#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a01 s PRO 176 N 0.00 1.95 0.20 -1.40 0.04 -1.26 -5.01 135.00 129.52 3a01 s PRO 176 Ca 0.00 0.14 0.10 0.00 0.04 0.00 0.00 61.00 61.29 3a01 s PRO 176 Cb 0.00 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.65 3a01 s PRO 176 CO 0.00 -1.61 1.43 -0.92 0.04 0.00 0.00 177.00 175.93 3a01 h TYR 177 N -1.07 0.00 0.00 0.56 3.20 -2.05 -3.18 116.97 114.43 3a01 h TYR 177 Ca -0.46 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.41 3a01 h TYR 177 Cb 1.33 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.60 3a01 h TYR 177 CO 0.32 0.78 0.00 -0.56 -1.64 0.00 0.00 178.16 177.05 3a01 h GLN 178 N 0.00 0.00 -0.01 1.82 -0.00 -2.02 -2.66 115.11 112.24 3a01 h GLN 178 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 3a01 h GLN 178 Cb 1.47 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.95 3a01 h GLN 178 CO 0.10 0.00 -0.17 0.09 -0.00 0.00 0.00 178.83 178.85 3a01 n ASN 179 N -2.74 1.08 -4.59 0.06 3.02 -1.20 -4.85 115.26 106.04 3a01 n ASN 179 Ca 0.02 -1.01 -0.34 0.00 -0.03 0.00 0.00 54.58 53.21 3a01 n ASN 179 Cb 0.30 0.08 -0.11 0.00 -0.61 0.00 0.00 39.78 39.44 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 -2.37 3.71 0.10 3.52 0.52 -1.00 -5.05 118.95 118.39 3a01 s ARG 180 Ca 0.28 -0.42 -0.31 0.00 -0.52 0.00 0.00 55.73 54.77 3a01 s ARG 180 Cb 0.20 -3.03 -0.08 0.00 0.52 0.00 0.00 34.95 32.55 3a01 s ARG 180 CO 0.47 0.33 1.47 -0.08 0.02 0.00 0.00 175.30 177.51 3a01 s THR 181 N 0.17 3.16 0.69 0.02 -1.32 -1.26 -4.98 115.64 112.12 3a01 s THR 181 Ca 0.02 0.78 -0.17 0.00 -1.21 0.00 0.00 61.69 61.11 3a01 s THR 181 Cb -0.13 -3.50 -0.04 0.00 -1.51 0.00 0.00 72.50 67.32 3a01 s THR 181 CO 0.02 0.04 0.66 -2.65 -2.21 0.00 0.00 174.62 170.47 3a01 n PRO 182 N 4.39 0.42 0.00 7.08 -0.02 -1.26 -5.18 135.00 140.44 3a01 n PRO 182 Ca 0.13 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 3a01 n PRO 182 Cb 0.41 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 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 -0.90 0.94 0.00 0.52 -0.02 -1.26 -5.30 135.00 128.98 3a01 n PRO 183 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 3a01 n PRO 183 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 3a01 n PRO 183 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3a01 n ARG 189 N 0.00 0.00 -2.20 -0.52 1.74 -1.26 -5.33 116.66 109.09 3a01 n ARG 189 Ca 0.00 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 3a01 n ARG 189 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 3a01 n ARG 189 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3a01 n THR 190 N 0.00 -0.68 -2.00 0.55 -2.24 -1.26 -5.09 114.28 103.56 3a01 n THR 190 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 3a01 n THR 190 Cb 0.00 -2.49 -0.03 0.00 -2.10 0.00 0.00 70.33 65.72 3a01 n THR 190 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3a01 s SER 191 N -2.18 6.49 0.43 3.42 0.15 -1.26 -4.95 113.70 115.81 3a01 s SER 191 Ca 0.00 2.05 -0.24 0.00 0.70 0.00 0.00 55.95 58.46 3a01 s SER 191 Cb 0.00 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 3a01 s SER 191 CO 0.00 -1.10 1.18 -0.36 1.20 0.00 0.00 173.24 174.17 3a01 s PHE 192 N 4.68 2.93 0.89 3.44 0.08 -1.26 -4.99 117.98 123.75 3a01 s PHE 192 Ca 0.75 1.53 -0.10 0.00 0.12 0.00 0.00 56.93 59.23 3a01 s PHE 192 Cb -0.31 -3.42 0.13 0.00 -0.57 0.00 0.00 43.02 38.85 3a01 s PHE 192 CO 0.30 -1.52 1.14 0.95 -0.10 0.00 0.00 175.22 176.00 3a01 s THR 193 N -1.46 2.22 -0.42 0.64 -4.23 -1.26 -4.73 115.64 106.40 3a01 s THR 193 Ca 0.61 0.07 0.23 0.00 -1.18 0.00 0.00 61.69 61.42 3a01 s THR 193 Cb -0.31 -2.16 0.24 0.00 1.34 0.00 0.00 72.50 71.61 3a01 s THR 193 CO 0.38 -0.09 1.70 -2.11 -0.54 0.00 0.00 174.62 173.95 3a01 n ARG 194 N -4.12 0.18 -0.06 3.99 1.85 -1.26 -1.20 116.66 116.04 3a01 n ARG 194 Ca 0.12 0.47 -0.11 0.00 -1.00 0.00 0.00 57.85 57.33 3a01 n ARG 194 Cb 0.52 -1.89 -0.10 0.00 -1.05 0.00 0.00 32.46 29.94 3a01 n ARG 194 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 3a01 h ILE 195 N 0.00 1.35 -0.67 8.89 1.08 -1.99 -2.35 117.51 123.82 3a01 h ILE 195 Ca 0.00 -2.00 0.14 0.00 -0.39 0.00 0.00 64.86 62.62 3a01 h ILE 195 Cb 0.28 2.55 -0.12 0.00 -3.07 0.00 0.00 36.82 36.46 3a01 h ILE 195 CO 0.00 0.46 -0.03 1.56 -0.69 0.00 0.00 178.15 179.45 3a01 h GLN 196 N -0.99 0.09 0.77 2.37 4.20 -1.79 -1.66 115.11 118.09 3a01 h GLN 196 Ca -0.00 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 3a01 h GLN 196 Cb 0.75 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.52 3a01 h GLN 196 CO 0.00 0.06 -0.37 0.28 -0.67 0.00 0.00 178.83 178.13 3a01 h VAL 197 N 0.09 0.05 -1.05 -0.54 2.07 -1.24 -1.57 116.25 114.05 3a01 h VAL 197 Ca 0.35 -0.23 0.28 0.00 0.82 0.00 0.00 66.70 67.93 3a01 h VAL 197 Cb 0.59 0.06 -0.11 0.00 -1.52 0.00 0.00 31.29 30.32 3a01 h VAL 197 CO -0.60 0.01 0.66 0.00 0.02 0.00 0.00 177.57 177.65 3a01 h ALA 198 N -1.20 2.17 0.16 1.67 0.00 -1.30 0.24 119.26 121.00 3a01 h ALA 198 Ca -0.11 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3a01 h ALA 198 Cb 0.80 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3a01 h ALA 198 CO 0.17 -0.61 -0.08 0.93 0.00 0.00 0.00 179.25 179.66 3a01 h GLU 199 N 0.41 -0.21 -0.55 0.00 4.39 -1.15 -1.02 114.58 116.45 3a01 h GLU 199 Ca 0.63 0.01 0.11 0.00 0.34 0.00 0.00 59.36 60.45 3a01 h GLU 199 Cb 1.54 0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 30.13 3a01 h GLU 199 CO -0.36 0.22 -0.14 -0.07 -1.16 0.00 0.00 179.01 177.50 3a01 h LEU 200 N -0.85 -0.52 -1.11 1.33 3.38 -0.67 -0.12 115.31 116.76 3a01 h LEU 200 Ca -0.02 0.16 0.16 0.00 0.09 0.00 0.00 57.88 58.27 3a01 h LEU 200 Cb 0.53 0.34 -0.09 0.00 0.09 0.00 0.00 40.66 41.53 3a01 h LEU 200 CO 0.04 -0.18 0.61 -0.08 0.09 0.00 0.00 178.44 178.92 3a01 h GLU 201 N -0.00 0.77 -0.03 1.13 4.57 -0.54 -1.05 114.58 119.43 3a01 h GLU 201 Ca 0.26 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.35 3a01 h GLU 201 Cb 0.40 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 3a01 h GLU 201 CO -0.56 0.51 -0.14 -0.22 -1.18 0.00 0.00 179.01 177.41 3a01 h LYS 202 N 0.79 0.15 -0.87 1.92 3.64 0.32 -2.91 116.57 119.60 3a01 h LYS 202 Ca 0.52 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.78 3a01 h LYS 202 Cb 0.77 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.57 3a01 h LYS 202 CO -0.29 0.78 0.52 -0.09 -2.27 0.00 0.00 179.45 178.10 3a01 h ARG 203 N -0.45 1.18 -0.59 1.90 9.65 -0.96 -2.87 114.38 122.23 3a01 h ARG 203 Ca -0.01 -0.11 0.10 0.00 -1.10 0.00 0.00 59.98 58.87 3a01 h ARG 203 Cb 0.80 -0.25 -0.08 0.00 -1.39 0.00 0.00 29.97 29.06 3a01 h ARG 203 CO 0.03 0.82 0.16 0.35 2.80 0.00 0.00 179.97 184.13 3a01 h PHE 204 N 1.19 0.27 0.00 2.20 3.57 -1.19 0.64 116.94 123.61 3a01 h PHE 204 Ca 0.31 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.80 3a01 h PHE 204 Cb -0.05 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 3a01 h PHE 204 CO -0.00 0.02 -0.19 1.25 -2.23 0.00 0.00 178.31 177.16 3a01 h HIS 205 N 0.31 0.00 0.00 0.41 2.76 -1.31 -1.09 115.15 116.23 3a01 h HIS 205 Ca 0.31 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.32 3a01 h HIS 205 Cb 0.42 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.36 3a01 h HIS 205 CO -0.22 0.19 -0.75 0.87 -1.30 0.00 0.00 177.93 176.73 3a01 h LYS 206 N 0.00 0.00 -0.79 5.26 1.57 -0.98 -3.46 116.57 118.17 3a01 h LYS 206 Ca -0.00 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 3a01 h LYS 206 Cb 0.47 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 32.57 3a01 h LYS 206 CO 0.02 0.75 -0.24 -1.14 -0.57 0.00 0.00 179.45 178.27 3a01 s GLN 207 N -3.04 0.44 0.57 3.15 0.74 0.07 -5.04 119.66 116.54 3a01 s GLN 207 Ca 0.01 0.52 0.35 0.00 0.05 0.00 0.00 55.36 56.30 3a01 s GLN 207 Cb 0.10 0.26 1.52 0.00 1.10 0.00 0.00 33.01 35.99 3a01 s GLN 207 CO 0.78 -0.74 2.04 0.87 -0.55 0.00 0.00 175.29 177.69 3a01 h LYS 208 N 7.84 0.00 -4.83 1.67 1.79 -1.81 -3.37 116.57 117.85 3a01 h LYS 208 Ca -0.08 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.12 3a01 h LYS 208 Cb 1.18 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 31.67 3a01 h LYS 208 CO 0.10 0.00 -0.71 0.71 -1.08 0.00 0.00 179.45 178.46 3a01 s TYR 209 N -3.74 1.02 -0.01 -1.35 2.02 -1.26 -4.95 117.35 109.09 3a01 s TYR 209 Ca 0.00 -0.79 0.05 0.00 -0.37 0.00 0.00 57.07 55.96 3a01 s TYR 209 Cb 0.09 -0.56 -0.01 0.00 -0.40 0.00 0.00 41.96 41.08 3a01 s TYR 209 CO 0.52 -0.05 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.79 3a01 s LEU 210 N -2.86 2.04 0.94 -1.29 1.43 -1.26 -5.13 118.68 112.54 3a01 s LEU 210 Ca 0.11 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 52.79 3a01 s LEU 210 Cb 0.02 -0.82 0.15 0.00 0.03 0.00 0.00 46.19 45.57 3a01 s LEU 210 CO -0.02 0.19 1.09 0.00 0.23 0.00 0.00 176.35 177.84 3a01 s ALA 211 N -0.41 1.24 0.10 4.21 0.00 -1.26 -4.89 121.76 120.75 3a01 s ALA 211 Ca 0.06 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.85 3a01 s ALA 211 Cb -0.06 -3.28 -0.13 0.00 0.00 0.00 0.00 23.12 19.65 3a01 s ALA 211 CO -0.00 -2.66 1.63 0.77 0.00 0.00 0.00 175.76 175.49 3a01 h SER 212 N -1.78 -0.83 -0.70 0.00 0.02 -2.00 -2.42 113.55 105.83 3a01 h SER 212 Ca -0.49 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 3a01 h SER 212 Cb 1.28 0.28 -0.03 0.00 0.14 0.00 0.00 62.40 64.07 3a01 h SER 212 CO 0.50 -0.44 0.44 0.00 -1.14 0.00 0.00 176.83 176.19 3a01 h ALA 213 N -0.12 1.46 0.00 3.77 0.00 -1.99 -1.43 119.26 120.95 3a01 h ALA 213 Ca -0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3a01 h ALA 213 Cb 0.60 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3a01 h ALA 213 CO -0.05 0.49 -0.14 0.93 0.00 0.00 0.00 179.25 180.47 3a01 h GLU 214 N 0.96 0.00 0.04 0.00 5.08 -1.87 -1.10 114.58 117.69 3a01 h GLU 214 Ca 0.26 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.49 3a01 h GLU 214 Cb -0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3a01 h GLU 214 CO -0.05 0.14 -0.61 -0.09 -1.00 0.00 0.00 179.01 177.40 3a01 h ARG 215 N 0.00 0.09 -0.77 2.33 1.12 -0.87 -2.77 114.38 113.51 3a01 h ARG 215 Ca -0.00 -0.15 0.15 0.00 -1.11 0.00 0.00 59.98 58.87 3a01 h ARG 215 Cb 0.25 0.06 -0.10 0.00 -0.01 0.00 0.00 29.97 30.17 3a01 h ARG 215 CO 0.02 1.07 0.32 0.00 -3.11 0.00 0.00 179.97 178.27 3a01 h ALA 216 N -0.10 1.11 -0.30 2.80 0.00 -1.11 0.48 119.26 122.14 3a01 h ALA 216 Ca -0.14 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3a01 h ALA 216 Cb 1.29 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 3a01 h ALA 216 CO -0.01 -0.21 -0.17 0.00 0.00 0.00 0.00 179.25 178.86 3a01 h ALA 217 N 1.56 1.15 -0.10 0.00 0.00 -1.27 -1.73 119.26 118.87 3a01 h ALA 217 Ca 0.43 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 3a01 h ALA 217 Cb 0.66 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3a01 h ALA 217 CO -0.41 0.54 -0.73 1.25 0.00 0.00 0.00 179.25 179.90 3a01 h LEU 218 N 0.49 0.58 0.41 0.00 5.85 -0.98 -2.18 115.31 119.48 3a01 h LEU 218 Ca 0.08 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 3a01 h LEU 218 Cb 0.57 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3a01 h LEU 218 CO 0.04 1.13 -0.36 0.00 -0.34 0.00 0.00 178.44 178.90 3a01 h ALA 219 N 0.86 -0.81 -0.72 1.25 0.00 -0.66 -2.61 119.26 116.58 3a01 h ALA 219 Ca -0.03 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.76 3a01 h ALA 219 Cb 1.31 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 19.57 3a01 h ALA 219 CO 0.13 -0.99 0.46 -0.09 0.00 0.00 0.00 179.25 178.77 3a01 h ARG 220 N -0.78 0.90 -0.18 0.00 2.43 -1.23 -0.53 114.38 114.99 3a01 h ARG 220 Ca -0.03 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.13 3a01 h ARG 220 Cb 0.68 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 3a01 h ARG 220 CO -0.04 0.59 0.15 0.78 -1.51 0.00 0.00 179.97 179.94 3a01 h GLY 221 N 0.93 0.00 -1.13 2.80 0.00 -1.32 -2.94 103.07 101.40 3a01 h GLY 221 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 3a01 h GLY 221 CO -0.08 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.50 3a01 n LEU 222 N -4.24 2.58 -3.54 3.11 4.77 -0.28 -4.96 117.00 114.44 3a01 n LEU 222 Ca 0.01 -1.67 -0.26 0.00 -0.03 0.00 0.00 56.01 54.06 3a01 n LEU 222 Cb 0.28 -0.15 0.04 0.00 -2.33 0.00 0.00 43.42 41.25 3a01 n LEU 222 CO 0.32 0.61 0.11 0.29 -1.33 0.00 0.00 177.39 177.39 3a01 n LYS 223 N 0.53 -5.85 -4.28 3.23 4.76 -0.75 -4.96 118.16 110.85 3a01 n LYS 223 Ca 0.10 0.73 -0.28 0.00 -2.87 0.00 0.00 58.31 55.98 3a01 n LYS 223 Cb 0.37 -5.64 -0.10 0.00 -1.84 0.00 0.00 35.03 27.82 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 -6.24 2.00 0.80 1.97 -1.94 -0.92 -5.06 119.30 109.91 3a01 s MET 224 Ca 0.52 -1.20 -0.11 0.00 -1.71 0.00 0.00 55.69 53.19 3a01 s MET 224 Cb -0.25 -2.17 0.07 0.00 2.01 0.00 0.00 34.83 34.49 3a01 s MET 224 CO 0.65 0.46 1.09 0.95 -0.01 0.00 0.00 175.02 178.15 3a01 s THR 225 N -1.47 3.19 0.11 2.05 -4.23 -1.26 -4.29 115.64 109.74 3a01 s THR 225 Ca 0.22 0.39 -0.18 0.00 -1.18 0.00 0.00 61.69 60.94 3a01 s THR 225 Cb -0.10 -2.98 -0.05 0.00 1.34 0.00 0.00 72.50 70.71 3a01 s THR 225 CO 0.14 -0.50 1.63 -0.78 -0.54 0.00 0.00 174.62 174.56 3a01 h ASP 226 N -1.17 0.42 -0.70 3.99 1.82 -1.94 -2.90 116.42 115.94 3a01 h ASP 226 Ca -0.46 -0.19 0.12 0.00 -0.39 0.00 0.00 57.03 56.10 3a01 h ASP 226 Cb 1.25 -0.11 -0.09 0.00 0.68 0.00 0.00 39.33 41.07 3a01 h ASP 226 CO 0.55 0.50 0.27 0.00 -1.61 0.00 0.00 179.24 178.95 3a01 h ALA 227 N 0.93 0.95 -0.07 -0.78 0.00 -1.99 0.32 119.26 118.63 3a01 h ALA 227 Ca 0.09 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3a01 h ALA 227 Cb 0.23 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3a01 h ALA 227 CO -0.00 -0.19 -0.15 1.96 0.00 0.00 0.00 179.25 180.87 3a01 h GLN 228 N 0.44 0.10 0.04 0.00 4.20 -1.90 0.45 115.11 118.43 3a01 h GLN 228 Ca 0.37 -0.02 -0.18 0.00 0.06 0.00 0.00 58.65 58.88 3a01 h GLN 228 Cb 0.51 -0.02 0.02 0.00 0.30 0.00 0.00 27.48 28.29 3a01 h GLN 228 CO -0.36 0.25 -0.73 0.28 -0.67 0.00 0.00 178.83 177.60 3a01 h VAL 229 N 0.10 1.42 -0.04 -0.54 2.07 -1.00 0.19 116.25 118.45 3a01 h VAL 229 Ca 0.02 -2.21 0.03 0.00 0.82 0.00 0.00 66.70 65.36 3a01 h VAL 229 Cb 0.33 2.71 -0.06 0.00 -1.52 0.00 0.00 31.29 32.75 3a01 h VAL 229 CO 0.02 0.65 -0.40 0.50 0.02 0.00 0.00 177.57 178.35 3a01 h LYS 230 N -0.09 -0.51 -0.47 1.57 3.64 -0.35 -0.65 116.57 119.70 3a01 h LYS 230 Ca -0.10 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3a01 h LYS 230 Cb 1.46 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 33.37 3a01 h LYS 230 CO 0.14 -0.34 0.28 1.15 -2.27 0.00 0.00 179.45 178.41 3a01 h THR 231 N -0.53 1.15 -0.82 1.00 2.02 -0.16 -1.71 112.91 113.87 3a01 h THR 231 Ca 0.06 -0.36 0.09 0.00 0.77 0.00 0.00 66.41 66.97 3a01 h THR 231 Cb 0.63 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 67.50 3a01 h THR 231 CO -0.33 0.16 0.47 -0.25 0.37 0.00 0.00 175.52 175.93 3a01 h TRP 232 N 0.63 0.85 -0.40 3.16 7.01 -0.23 0.06 115.95 127.03 3a01 h TRP 232 Ca 0.17 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 61.06 3a01 h TRP 232 Cb 0.01 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.80 3a01 h TRP 232 CO -0.03 0.36 -0.30 0.74 -2.79 0.00 0.00 178.44 176.42 3a01 h PHE 233 N 0.80 1.07 0.08 2.65 -1.00 -0.57 0.13 116.94 120.10 3a01 h PHE 233 Ca 0.39 -0.30 0.01 0.00 2.81 0.00 0.00 57.97 60.88 3a01 h PHE 233 Cb 0.33 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.64 3a01 h PHE 233 CO -0.06 1.11 -0.15 0.37 -1.61 0.00 0.00 178.31 177.97 3a01 h GLN 234 N 0.72 -0.28 -0.68 1.51 5.75 -0.43 0.15 115.11 121.85 3a01 h GLN 234 Ca 0.07 0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.62 3a01 h GLN 234 Cb 0.89 0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.46 3a01 h GLN 234 CO 0.08 -0.18 0.43 -0.91 -2.65 0.00 0.00 178.83 175.59 3a01 h ASN 235 N -0.29 0.70 -0.94 -0.69 2.35 -0.90 -1.78 115.58 114.04 3a01 h ASN 235 Ca 0.03 -0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.78 3a01 h ASN 235 Cb 0.31 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.48 3a01 h ASN 235 CO -0.09 0.49 0.61 -0.09 -1.65 0.00 0.00 177.43 176.70 3a01 h ARG 236 N 0.84 1.25 -0.59 0.81 9.65 0.14 -1.97 114.38 124.50 3a01 h ARG 236 Ca 0.27 -0.08 -0.08 0.00 -1.10 0.00 0.00 59.98 58.99 3a01 h ARG 236 Cb 0.01 -0.28 -0.02 0.00 -1.39 0.00 0.00 29.97 28.29 3a01 h ARG 236 CO -0.10 0.83 0.06 0.00 2.80 0.00 0.00 179.97 183.56 3a01 h ARG 237 N 1.28 1.00 -0.14 0.20 3.08 -0.15 0.38 114.38 120.03 3a01 h ARG 237 Ca 0.34 -0.29 0.03 0.00 0.07 0.00 0.00 59.98 60.13 3a01 h ARG 237 Cb -0.13 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 3a01 h ARG 237 CO -0.07 0.96 -0.03 1.15 -1.07 0.00 0.00 179.97 180.90 3a01 h THR 238 N 0.90 0.86 -0.32 2.04 2.02 -0.97 0.60 112.91 118.04 3a01 h THR 238 Ca 0.18 -0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.39 3a01 h THR 238 Cb 0.47 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 3a01 h THR 238 CO 0.02 0.00 0.10 0.50 0.37 0.00 0.00 175.52 176.51 3a01 h LYS 239 N 0.00 0.23 -0.13 6.66 3.64 -1.28 -0.79 116.57 124.90 3a01 h LYS 239 Ca 0.07 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3a01 h LYS 239 Cb 0.10 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3a01 h LYS 239 CO -0.14 0.15 -0.01 2.35 -2.27 0.00 0.00 179.45 179.53 3a01 h TRP 240 N 0.23 -0.03 -0.66 1.91 7.01 -0.27 -2.17 115.95 121.96 3a01 h TRP 240 Ca 0.15 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.12 3a01 h TRP 240 Cb 0.13 0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.19 3a01 h TRP 240 CO -0.15 -0.03 0.27 0.00 -2.79 0.00 0.00 178.44 175.74 3a01 h ARG 241 N 0.02 0.99 0.00 2.65 3.08 0.56 -1.53 114.38 120.15 3a01 h ARG 241 Ca 0.06 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3a01 h ARG 241 Cb 0.08 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3a01 h ARG 241 CO -0.11 0.82 0.00 2.89 -1.07 0.00 0.00 179.97 182.50 3a01 n ARG 242 N -4.41 0.22 -0.01 0.04 1.85 -0.33 -0.37 116.66 113.64 3a01 n ARG 242 Ca 0.05 0.26 -0.19 0.00 -1.00 0.00 0.00 57.85 56.96 3a01 n ARG 242 Cb 0.17 -1.80 -0.14 0.00 -1.05 0.00 0.00 32.46 29.64 3a01 n ARG 242 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 3a01 h GLN 243 N 0.00 0.17 0.34 2.89 4.20 -1.13 -3.14 115.11 118.44 3a01 h GLN 243 Ca 0.00 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.40 3a01 h GLN 243 Cb 0.61 0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.50 3a01 h GLN 243 CO 0.00 1.14 -0.21 1.15 -0.67 0.00 0.00 178.83 180.24 3a01 h THR 244 N -0.57 0.00 0.00 -0.54 2.02 -1.18 -0.31 112.91 112.33 3a01 h THR 244 Ca -0.19 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.99 3a01 h THR 244 Cb 1.50 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3a01 h THR 244 CO 0.04 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.93 3a01 h ALA 245 N -1.59 1.00 0.00 6.16 0.00 -0.90 -2.66 119.26 121.27 3a01 h ALA 245 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.52 3a01 h ALA 245 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 3a01 h ALA 245 CO 0.05 0.00 -2.29 -0.85 0.00 0.00 0.00 179.25 176.16 3a01 n GLU 246 N -2.59 0.82 0.00 0.00 0.28 -1.19 -5.05 120.64 112.90 3a01 n GLU 246 Ca -0.01 0.06 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 3a01 n GLU 246 Cb 0.10 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.50 3a01 n GLU 246 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36