#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h5j s HIS 185 N 0.00 3.31 0.38 0.00 0.09 -1.26 -5.06 115.29 112.75 2h5j s HIS 185 Ca 0.00 0.94 0.08 0.00 -0.00 0.00 0.00 55.06 56.08 2h5j s HIS 185 Cb 0.00 -2.89 -0.07 0.00 -0.00 0.00 0.00 32.58 29.62 2h5j s HIS 185 CO 0.00 -0.31 0.00 0.15 -0.00 0.00 0.00 174.74 174.58 2h5j s LYS 186 N 2.46 1.97 0.14 1.40 1.02 -1.26 -5.16 119.74 120.31 2h5j s LYS 186 Ca 0.29 -1.97 0.09 0.00 0.02 0.00 0.00 55.97 54.40 2h5j s LYS 186 Cb -0.16 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 2h5j s LYS 186 CO 0.09 0.03 -0.20 0.96 -0.92 0.00 0.00 175.35 175.31 2h5j s ILE 187 N -2.63 1.81 0.58 2.17 -4.36 -1.26 -5.13 121.20 112.38 2h5j s ILE 187 Ca 0.35 -1.76 -0.21 0.00 -0.26 0.00 0.00 60.65 58.78 2h5j s ILE 187 Cb 0.05 -1.74 -0.04 0.00 1.25 0.00 0.00 42.46 41.99 2h5j s ILE 187 CO 0.18 -0.18 1.33 -2.84 0.24 0.00 0.00 174.94 173.67 2h5j s PRO 188 N -2.39 2.98 0.27 0.37 0.02 -1.26 -4.86 135.00 130.13 2h5j s PRO 188 Ca 0.12 2.15 0.25 0.00 0.02 0.00 0.00 61.00 63.54 2h5j s PRO 188 Cb -0.08 -2.12 0.94 0.00 0.02 0.00 0.00 34.50 33.26 2h5j s PRO 188 CO 0.06 -1.29 1.75 -0.39 -0.33 0.00 0.00 177.00 176.79 2h5j h VAL 189 N 1.17 0.00 -0.02 3.83 -1.51 -2.05 -2.71 116.25 114.97 2h5j h VAL 189 Ca -0.51 -0.35 0.00 0.00 -1.23 0.00 0.00 66.70 64.61 2h5j h VAL 189 Cb 1.31 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 2h5j h VAL 189 CO 0.56 0.00 -0.08 -0.62 -1.23 0.00 0.00 177.57 176.20 2h5j n GLU 190 N -2.33 1.75 -1.59 5.19 -0.58 -1.26 -4.95 120.64 116.87 2h5j n GLU 190 Ca 0.03 -1.25 -0.32 0.00 -0.42 0.00 0.00 57.16 55.20 2h5j n GLU 190 Cb 0.31 -1.47 0.05 0.00 -0.57 0.00 0.00 31.44 29.75 2h5j n GLU 190 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2h5j s ALA 191 N -2.11 2.56 -0.95 0.62 0.00 -1.02 -4.05 121.76 116.79 2h5j s ALA 191 Ca 0.31 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.50 2h5j s ALA 191 Cb 0.20 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 20.09 2h5j s ALA 191 CO 0.37 -1.30 0.02 -0.25 0.00 0.00 0.00 175.76 174.61 2h5j n ASP 192 N -2.96 -3.67 -4.69 0.00 8.00 0.72 -5.00 116.55 108.94 2h5j n ASP 192 Ca 0.08 -0.02 -0.35 0.00 0.71 0.00 0.00 54.79 55.21 2h5j n ASP 192 Cb 0.53 -2.88 -0.09 0.00 -0.02 0.00 0.00 41.12 38.66 2h5j n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2h5j s PHE 193 N -2.58 3.20 -0.11 1.24 0.08 -1.25 -4.87 117.98 113.68 2h5j s PHE 193 Ca 0.01 0.21 -0.00 0.00 0.12 0.00 0.00 56.93 57.27 2h5j s PHE 193 Cb -0.01 -1.81 0.02 0.00 -0.57 0.00 0.00 43.02 40.66 2h5j s PHE 193 CO 0.01 0.47 -0.08 -1.17 -0.10 0.00 0.00 175.22 174.36 2h5j s LEU 194 N -0.84 1.22 -0.34 -0.37 1.98 -1.26 0.24 118.68 119.30 2h5j s LEU 194 Ca 0.13 -0.31 -0.05 0.00 -2.89 0.00 0.00 54.13 51.00 2h5j s LEU 194 Cb -0.11 -0.86 0.05 0.00 0.66 0.00 0.00 46.19 45.93 2h5j s LEU 194 CO 0.02 -0.11 0.10 -0.31 -1.89 0.00 0.00 176.35 174.16 2h5j s TYR 195 N 1.68 3.29 -0.74 5.38 1.51 0.14 -5.01 117.35 123.60 2h5j s TYR 195 Ca 0.05 -1.60 -0.16 0.00 -1.01 0.00 0.00 57.07 54.35 2h5j s TYR 195 Cb -0.13 -2.37 0.16 0.00 -0.11 0.00 0.00 41.96 39.52 2h5j s TYR 195 CO -0.08 -0.77 0.77 0.00 -1.11 0.00 0.00 175.55 174.36 2h5j s ALA 196 N 1.35 3.73 0.22 3.71 0.00 -1.26 -1.16 121.76 128.35 2h5j s ALA 196 Ca -0.01 -2.84 -0.27 0.00 0.00 0.00 0.00 51.96 48.84 2h5j s ALA 196 Cb -0.20 -3.58 -0.09 0.00 0.00 0.00 0.00 23.12 19.26 2h5j s ALA 196 CO 0.01 -2.38 0.86 0.71 0.00 0.00 0.00 175.76 174.96 2h5j s TYR 197 N 1.45 3.89 0.12 0.00 2.02 -0.45 -4.98 117.35 119.40 2h5j s TYR 197 Ca 0.17 1.75 0.23 0.00 -0.37 0.00 0.00 57.07 58.85 2h5j s TYR 197 Cb -0.16 -2.86 0.84 0.00 -0.40 0.00 0.00 41.96 39.38 2h5j s TYR 197 CO -0.04 0.44 1.79 0.66 -1.57 0.00 0.00 175.55 176.84 2h5j h SER 198 N 4.03 0.00 -5.43 2.29 4.64 -1.94 -0.56 113.55 116.57 2h5j h SER 198 Ca -0.46 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.68 2h5j h SER 198 Cb 1.20 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.15 2h5j h SER 198 CO 0.67 0.25 -0.52 0.28 -0.87 0.00 0.00 176.83 176.64 2h5j s THR 199 N -3.61 0.05 0.57 2.95 -1.32 -1.26 -3.56 115.64 109.46 2h5j s THR 199 Ca 0.01 -1.79 -0.17 0.00 -1.21 0.00 0.00 61.69 58.53 2h5j s THR 199 Cb 0.10 -2.18 -0.05 0.00 -1.51 0.00 0.00 72.50 68.87 2h5j s THR 199 CO 0.65 -0.23 1.05 0.00 -2.21 0.00 0.00 174.62 173.88 2h5j s ALA 200 N -4.07 2.78 0.21 11.08 0.00 -1.08 -4.10 121.76 126.58 2h5j s ALA 200 Ca 0.28 0.43 -0.32 0.00 0.00 0.00 0.00 51.96 52.35 2h5j s ALA 200 Cb 0.06 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.80 2h5j s ALA 200 CO 0.06 -0.69 1.34 -2.30 0.00 0.00 0.00 175.76 174.17 2h5j n PRO 201 N -1.79 1.77 -0.77 0.00 -0.02 -1.26 -1.53 135.00 131.40 2h5j n PRO 201 Ca 0.09 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2h5j n PRO 201 Cb 0.53 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2h5j n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h5j n GLY 202 N 2.18 1.37 3.79 -1.23 0.00 -1.26 -5.04 105.19 104.99 2h5j n GLY 202 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 2h5j n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2h5j s TYR 203 N -3.73 3.10 0.72 1.61 1.51 -0.58 -5.11 117.35 114.87 2h5j s TYR 203 Ca 0.00 -0.05 -0.16 0.00 -1.01 0.00 0.00 57.07 55.85 2h5j s TYR 203 Cb 0.00 -1.47 0.01 0.00 -0.11 0.00 0.00 41.96 40.40 2h5j s TYR 203 CO 0.00 0.52 1.05 0.66 -1.11 0.00 0.00 175.55 176.68 2h5j n TYR 204 N -0.52 0.97 -4.79 2.71 4.02 -1.26 -4.82 117.16 113.47 2h5j n TYR 204 Ca -0.08 0.40 -0.31 0.00 -0.01 0.00 0.00 57.90 57.90 2h5j n TYR 204 Cb 0.56 -2.12 -0.13 0.00 -0.02 0.00 0.00 39.34 37.63 2h5j n TYR 204 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2h5j s SER 205 N -1.65 3.80 -0.06 7.72 0.15 -1.26 -4.83 113.70 117.57 2h5j s SER 205 Ca 0.75 -0.36 -0.01 0.00 0.70 0.00 0.00 55.95 57.02 2h5j s SER 205 Cb -0.35 -0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 63.27 2h5j s SER 205 CO 0.48 0.29 0.02 0.26 1.20 0.00 0.00 173.24 175.50 2h5j s TRP 206 N -0.84 3.19 -0.04 3.44 0.52 -1.26 -5.09 118.94 118.86 2h5j s TRP 206 Ca 0.13 0.20 0.01 0.00 0.02 0.00 0.00 56.10 56.46 2h5j s TRP 206 Cb -0.10 -1.77 0.02 0.00 -1.15 0.00 0.00 33.47 30.47 2h5j s TRP 206 CO 0.03 0.50 -0.05 0.50 0.02 0.00 0.00 176.95 177.96 2h5j s ARG 207 N -1.16 0.81 -0.21 4.98 3.52 -1.26 -2.90 118.95 122.74 2h5j s ARG 207 Ca 0.16 -0.12 -0.11 0.00 -0.13 0.00 0.00 55.73 55.53 2h5j s ARG 207 Cb -0.11 -0.81 -0.05 0.00 -1.56 0.00 0.00 34.95 32.42 2h5j s ARG 207 CO 0.06 -0.06 0.19 1.21 -0.81 0.00 0.00 175.30 175.89 2h5j s ASN 208 N 0.80 6.23 0.43 -2.12 3.84 -0.54 -4.90 114.94 118.68 2h5j s ASN 208 Ca -0.11 0.25 0.22 0.00 0.21 0.00 0.00 52.86 53.43 2h5j s ASN 208 Cb -0.14 -2.12 1.19 0.00 -0.55 0.00 0.00 41.25 39.63 2h5j s ASN 208 CO 0.00 0.10 1.80 0.28 -2.79 0.00 0.00 177.10 176.50 2h5j h SER 209 N 7.04 0.34 0.00 -4.21 0.02 -2.01 0.19 113.55 114.92 2h5j h SER 209 Ca -0.39 0.06 -0.34 0.00 -0.84 0.00 0.00 61.79 60.27 2h5j h SER 209 Cb 1.16 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.64 2h5j h SER 209 CO 0.72 0.08 -2.30 1.17 -1.14 0.00 0.00 176.83 175.36 2h5j n LYS 210 N -4.52 0.70 0.00 3.45 4.81 -1.26 -4.63 118.16 116.71 2h5j n LYS 210 Ca 0.24 0.10 0.11 0.00 -0.87 0.00 0.00 58.31 57.88 2h5j n LYS 210 Cb 0.90 -1.47 -0.01 0.00 0.02 0.00 0.00 35.03 34.48 2h5j n LYS 210 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2h5j n ASP 211 N -3.05 1.18 0.00 3.14 8.00 -1.17 -5.09 116.55 119.56 2h5j n ASP 211 Ca -0.38 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.11 2h5j n ASP 211 Cb 0.98 0.72 0.00 0.00 -0.02 0.00 0.00 41.12 42.79 2h5j n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h5j n GLY 212 N 1.47 -3.40 3.77 0.44 0.00 0.64 -4.83 105.19 103.28 2h5j n GLY 212 Ca 0.06 -1.91 -0.37 0.00 0.00 0.00 0.00 46.02 43.80 2h5j n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2h5j s SER 213 N -1.19 6.12 0.16 1.61 1.04 -1.26 -1.46 113.70 118.71 2h5j s SER 213 Ca 0.00 2.32 -0.18 0.00 0.48 0.00 0.00 55.95 58.57 2h5j s SER 213 Cb 0.00 -2.60 0.08 0.00 0.10 0.00 0.00 66.02 63.59 2h5j s SER 213 CO 0.00 -0.95 1.66 -0.50 0.98 0.00 0.00 173.24 174.42 2h5j h TRP 214 N 2.00 -0.32 0.32 5.02 4.06 -1.90 0.21 115.95 125.34 2h5j h TRP 214 Ca -0.49 0.04 -0.02 0.00 2.06 0.00 0.00 58.89 60.48 2h5j h TRP 214 Cb 1.25 0.20 0.00 0.00 -1.00 0.00 0.00 29.16 29.61 2h5j h TRP 214 CO 0.53 -0.21 -0.15 0.35 -3.56 0.00 0.00 178.44 175.39 2h5j h PHE 215 N -0.07 -0.40 -0.59 0.49 3.57 -1.89 0.81 116.94 118.87 2h5j h PHE 215 Ca 0.18 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 2h5j h PHE 215 Cb 0.34 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 2h5j h PHE 215 CO -0.36 -0.19 0.06 0.82 -2.23 0.00 0.00 178.31 176.40 2h5j h ILE 216 N -0.51 1.26 -0.52 1.41 1.08 -1.92 0.67 117.51 118.97 2h5j h ILE 216 Ca -0.04 -1.04 -0.08 0.00 -0.39 0.00 0.00 64.86 63.31 2h5j h ILE 216 Cb 0.38 0.74 -0.02 0.00 -3.07 0.00 0.00 36.82 34.86 2h5j h ILE 216 CO 0.07 0.38 -0.01 0.06 -0.69 0.00 0.00 178.15 177.96 2h5j h GLN 217 N 0.91 0.90 -0.45 2.37 3.07 -0.83 -1.26 115.11 119.83 2h5j h GLN 217 Ca 0.18 -0.26 -0.12 0.00 0.09 0.00 0.00 58.65 58.53 2h5j h GLN 217 Cb 0.46 -0.09 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 2h5j h GLN 217 CO 0.02 0.90 -0.21 0.77 0.09 0.00 0.00 178.83 180.39 2h5j h SER 218 N 0.83 0.92 -0.48 0.06 0.02 -0.17 -1.94 113.55 112.79 2h5j h SER 218 Ca 0.15 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.72 2h5j h SER 218 Cb 0.51 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 2h5j h SER 218 CO 0.03 1.10 0.14 0.25 -1.14 0.00 0.00 176.83 177.21 2h5j h LEU 219 N 0.78 0.70 -0.63 5.07 5.85 0.68 -1.50 115.31 126.26 2h5j h LEU 219 Ca 0.10 -0.21 -0.07 0.00 0.84 0.00 0.00 57.88 58.54 2h5j h LEU 219 Cb 0.76 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2h5j h LEU 219 CO 0.06 0.73 0.10 0.00 -0.34 0.00 0.00 178.44 178.99 2h5j h ALA 221 N 1.03 0.94 -0.22 0.00 0.00 -1.14 -1.24 119.26 118.63 2h5j h ALA 221 Ca 0.19 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 2h5j h ALA 221 Cb 0.43 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2h5j h ALA 221 CO 0.01 0.63 -0.58 0.52 0.00 0.00 0.00 179.25 179.84 2h5j h MET 222 N 0.88 0.78 -0.43 0.00 2.07 -1.09 -0.77 114.93 116.36 2h5j h MET 222 Ca 0.16 -0.54 0.04 0.00 -2.07 0.00 0.00 59.70 57.29 2h5j h MET 222 Cb 0.52 0.08 -0.04 0.00 -1.87 0.00 0.00 31.60 30.29 2h5j h MET 222 CO 0.03 1.17 0.19 -0.07 1.07 0.00 0.00 176.91 179.29 2h5j h LEU 223 N 0.52 0.24 -0.70 1.22 3.38 -0.97 0.54 115.31 119.54 2h5j h LEU 223 Ca -0.01 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2h5j h LEU 223 Cb 1.19 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 2h5j h LEU 223 CO 0.12 0.18 0.32 0.50 0.09 0.00 0.00 178.44 179.65 2h5j h LYS 224 N 0.38 1.02 0.00 1.13 3.64 -1.15 0.31 116.57 121.90 2h5j h LYS 224 Ca 0.19 -0.16 -0.16 0.00 -1.27 0.00 0.00 60.65 59.25 2h5j h LYS 224 Cb 0.14 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2h5j h LYS 224 CO -0.16 0.82 -0.78 0.37 -2.27 0.00 0.00 179.45 177.43 2h5j h GLN 225 N 0.99 0.00 0.00 1.90 4.15 -0.76 -3.41 115.11 117.98 2h5j h GLN 225 Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.66 2h5j h GLN 225 Cb 0.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.84 2h5j h GLN 225 CO -0.03 0.78 -0.11 0.66 -1.93 0.00 0.00 178.83 178.20 2h5j n TYR 226 N -3.43 0.00 0.23 3.99 4.01 0.15 -4.73 117.16 117.38 2h5j n TYR 226 Ca 0.00 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.89 2h5j n TYR 226 Cb 0.80 0.00 0.81 0.00 -0.31 0.00 0.00 39.34 40.64 2h5j n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2h5j h ALA 227 N 0.00 1.02 -0.19 -0.72 0.00 -0.50 0.34 119.26 119.22 2h5j h ALA 227 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2h5j h ALA 227 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2h5j h ALA 227 CO 0.00 -0.02 0.00 -0.40 0.00 0.00 0.00 179.25 178.83 2h5j n ASP 228 N -2.56 0.99 0.00 0.00 5.68 -1.26 -4.29 116.55 115.12 2h5j n ASP 228 Ca -0.02 -1.99 0.00 0.00 -0.50 0.00 0.00 54.79 52.28 2h5j n ASP 228 Cb 0.08 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 39.93 2h5j n ASP 228 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2h5j n LYS 229 N 0.04 0.00 -3.58 0.11 2.85 -0.04 -5.04 118.16 112.50 2h5j n LYS 229 Ca 0.06 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.97 2h5j n LYS 229 Cb 0.16 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.48 2h5j n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2h5j s LEU 230 N -0.56 4.36 0.67 -5.58 1.43 -0.32 -5.08 118.68 113.60 2h5j s LEU 230 Ca 0.00 0.79 -0.16 0.00 -1.03 0.00 0.00 54.13 53.73 2h5j s LEU 230 Cb 0.00 -2.92 0.01 0.00 0.03 0.00 0.00 46.19 43.30 2h5j s LEU 230 CO 0.00 0.19 1.17 -0.70 0.23 0.00 0.00 176.35 177.24 2h5j s GLU 231 N -1.83 2.60 0.17 1.70 -6.30 -1.26 -4.74 118.70 109.05 2h5j s GLU 231 Ca 0.32 1.64 -0.14 0.00 -2.50 0.00 0.00 54.97 54.29 2h5j s GLU 231 Cb -0.14 -1.90 0.08 0.00 0.00 0.00 0.00 34.13 32.16 2h5j s GLU 231 CO 0.17 -1.46 1.83 0.35 0.02 0.00 0.00 175.26 176.18 2h5j h PHE 232 N 0.13 0.62 -0.99 5.30 3.57 -1.24 -1.99 116.94 122.36 2h5j h PHE 232 Ca -0.48 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.12 2h5j h PHE 232 Cb 1.28 -0.21 -0.07 0.00 2.79 0.00 0.00 35.95 39.74 2h5j h PHE 232 CO 0.50 0.38 0.63 0.52 -2.23 0.00 0.00 178.31 178.11 2h5j h MET 233 N 0.67 1.04 -0.41 1.11 2.86 -1.92 0.25 114.93 118.54 2h5j h MET 233 Ca 0.20 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.72 2h5j h MET 233 Cb -0.04 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.37 2h5j h MET 233 CO -0.06 0.69 0.02 1.25 1.06 0.00 0.00 176.91 179.87 2h5j h HIS 234 N 1.08 0.76 -0.70 -0.22 -0.00 -1.81 0.15 115.15 114.41 2h5j h HIS 234 Ca 0.45 -0.12 0.04 0.00 -0.00 0.00 0.00 60.37 60.74 2h5j h HIS 234 Cb 0.30 -0.20 -0.05 0.00 -0.00 0.00 0.00 27.41 27.47 2h5j h HIS 234 CO -0.00 0.76 0.42 0.82 -0.00 0.00 0.00 177.93 179.93 2h5j h ILE 235 N 0.54 1.05 0.00 6.26 2.04 -0.55 0.58 117.51 127.43 2h5j h ILE 235 Ca 0.12 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 2h5j h ILE 235 Cb 0.44 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2h5j h ILE 235 CO 0.02 0.15 -0.15 -0.07 0.00 0.00 0.00 178.15 178.09 2h5j h LEU 236 N 0.80 0.00 -0.19 1.44 3.38 0.01 -1.89 115.31 118.87 2h5j h LEU 236 Ca 0.29 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 58.04 2h5j h LEU 236 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2h5j h LEU 236 CO -0.14 0.15 -0.92 0.74 0.09 0.00 0.00 178.44 178.37 2h5j h THR 237 N 0.00 1.40 0.00 0.22 2.02 0.13 -0.95 112.91 115.72 2h5j h THR 237 Ca -0.00 -2.42 -0.04 0.00 0.77 0.00 0.00 66.41 64.72 2h5j h THR 237 Cb 0.52 2.39 -0.01 0.00 -1.74 0.00 0.00 68.15 69.32 2h5j h THR 237 CO 0.02 0.72 -0.18 0.03 0.37 0.00 0.00 175.52 176.48 2h5j h ARG 238 N 0.23 0.00 -0.16 6.66 2.47 -0.22 -2.30 114.38 121.08 2h5j h ARG 238 Ca -0.07 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.48 2h5j h ARG 238 Cb 1.55 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.88 2h5j h ARG 238 CO 0.16 0.18 -0.54 0.28 0.56 0.00 0.00 179.97 180.61 2h5j h VAL 239 N 0.00 1.33 -0.67 2.04 2.07 -1.12 -1.81 116.25 118.09 2h5j h VAL 239 Ca -0.00 -1.79 0.10 0.00 0.82 0.00 0.00 66.70 65.83 2h5j h VAL 239 Cb 0.34 2.01 -0.08 0.00 -1.52 0.00 0.00 31.29 32.05 2h5j h VAL 239 CO 0.02 0.55 0.29 0.78 0.02 0.00 0.00 177.57 179.23 2h5j h ASN 240 N 0.31 0.32 -0.34 0.57 4.21 -0.92 -1.20 115.58 118.52 2h5j h ASN 240 Ca -0.02 0.08 -0.11 0.00 1.21 0.00 0.00 56.30 57.45 2h5j h ASN 240 Cb 1.16 0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 38.39 2h5j h ASN 240 CO 0.11 0.17 -0.23 -0.09 -1.29 0.00 0.00 177.43 176.10 2h5j h ARG 241 N 0.48 0.77 0.07 0.81 2.43 -1.22 -1.96 114.38 115.77 2h5j h ARG 241 Ca 0.34 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2h5j h ARG 241 Cb 0.43 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2h5j h ARG 241 CO -0.31 0.99 -0.04 -0.22 -1.51 0.00 0.00 179.97 178.88 2h5j h LYS 242 N 0.55 -0.09 -0.49 0.20 3.64 -1.12 -0.20 116.57 119.06 2h5j h LYS 242 Ca 0.07 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2h5j h LYS 242 Cb 0.79 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 2h5j h LYS 242 CO 0.06 -0.01 0.27 0.28 -2.27 0.00 0.00 179.45 177.78 2h5j h VAL 243 N -0.15 1.15 0.00 2.00 2.07 -1.23 0.14 116.25 120.23 2h5j h VAL 243 Ca -0.01 -0.39 -0.14 0.00 0.82 0.00 0.00 66.70 66.99 2h5j h VAL 243 Cb 0.13 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 2h5j h VAL 243 CO 0.02 0.17 -0.65 0.00 0.02 0.00 0.00 177.57 177.13 2h5j h ALA 244 N 1.62 0.60 0.00 1.67 0.00 -1.04 -3.33 119.26 118.78 2h5j h ALA 244 Ca 0.18 -0.59 -0.28 0.00 0.00 0.00 0.00 54.91 54.22 2h5j h ALA 244 Cb 0.02 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2h5j h ALA 244 CO -0.03 0.81 -2.06 0.25 0.00 0.00 0.00 179.25 178.22 2h5j n THR 245 N -3.29 1.07 1.05 0.00 -2.24 -0.11 -4.67 114.28 106.08 2h5j n THR 245 Ca 0.01 -0.52 0.12 0.00 -2.27 0.00 0.00 64.05 61.39 2h5j n THR 245 Cb 0.78 -0.92 0.17 0.00 -2.10 0.00 0.00 70.33 68.26 2h5j n THR 245 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2h5j n GLU 246 N -2.83 0.27 -5.20 -0.78 1.02 0.45 -4.89 120.64 108.68 2h5j n GLU 246 Ca -0.30 -0.18 -0.30 0.00 -0.02 0.00 0.00 57.16 56.36 2h5j n GLU 246 Cb 0.92 -1.50 -0.16 0.00 -0.02 0.00 0.00 31.44 30.68 2h5j n GLU 246 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2h5j s PHE 247 N -2.85 2.24 -0.08 -0.32 0.08 -1.25 -5.07 117.98 110.73 2h5j s PHE 247 Ca 0.14 -0.42 -0.07 0.00 0.12 0.00 0.00 56.93 56.70 2h5j s PHE 247 Cb 0.18 -1.43 0.02 0.00 -0.57 0.00 0.00 43.02 41.22 2h5j s PHE 247 CO 0.69 -0.02 0.21 -2.00 -0.10 0.00 0.00 175.22 174.00 2h5j s GLU 248 N -0.68 0.24 0.43 0.44 2.12 -1.26 -4.74 118.70 115.24 2h5j s GLU 248 Ca 0.10 0.30 -0.22 0.00 0.36 0.00 0.00 54.97 55.51 2h5j s GLU 248 Cb -0.10 0.11 -0.10 0.00 0.26 0.00 0.00 34.13 34.30 2h5j s GLU 248 CO -0.01 -0.03 0.98 -1.54 -0.54 0.00 0.00 175.26 174.12 2h5j s SER 249 N 0.16 6.84 -0.20 -1.70 1.04 0.22 -4.87 113.70 115.19 2h5j s SER 249 Ca -0.00 1.79 -0.02 0.00 0.48 0.00 0.00 55.95 58.20 2h5j s SER 249 Cb -0.02 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2h5j s SER 249 CO -0.00 -0.43 -0.12 0.12 0.98 0.00 0.00 173.24 173.79 2h5j s PHE 250 N -2.02 2.88 -0.04 5.02 2.19 -1.26 -0.00 117.98 124.74 2h5j s PHE 250 Ca 0.61 -1.26 -0.06 0.00 0.33 0.00 0.00 56.93 56.56 2h5j s PHE 250 Cb -0.13 -2.02 0.01 0.00 -1.31 0.00 0.00 43.02 39.57 2h5j s PHE 250 CO 0.17 -0.67 0.15 0.45 1.83 0.00 0.00 175.22 177.15 2h5j s SER 251 N 1.38 -0.10 0.39 6.13 0.15 -1.26 -4.95 113.70 115.44 2h5j s SER 251 Ca 0.05 0.15 0.28 0.00 0.70 0.00 0.00 55.95 57.13 2h5j s SER 251 Cb -0.14 0.28 1.09 0.00 -1.71 0.00 0.00 66.02 65.54 2h5j s SER 251 CO -0.08 -0.15 1.83 -0.26 1.20 0.00 0.00 173.24 175.78 2h5j h PHE 252 N 5.41 0.00 -3.57 3.44 0.04 -2.00 -3.40 116.94 116.86 2h5j h PHE 252 Ca -0.27 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 59.87 2h5j h PHE 252 Cb 1.20 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 39.21 2h5j h PHE 252 CO 0.46 0.00 0.11 0.34 -0.60 0.00 0.00 178.31 178.63 2h5j s ASP 253 N -5.01 6.40 0.41 2.17 -1.08 -1.26 -4.93 116.67 113.36 2h5j s ASP 253 Ca 0.04 0.06 0.15 0.00 -0.52 0.00 0.00 52.55 52.27 2h5j s ASP 253 Cb 0.09 -2.32 1.02 0.00 -1.46 0.00 0.00 42.92 40.25 2h5j s ASP 253 CO 0.49 -0.60 1.88 0.00 0.52 0.00 0.00 175.17 177.46 2h5j h ALA 254 N 8.52 2.10 0.00 3.66 0.00 -1.95 -0.08 119.26 131.50 2h5j h ALA 254 Ca -0.26 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2h5j h ALA 254 Cb 1.11 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2h5j h ALA 254 CO 0.83 -0.34 -0.02 1.15 0.00 0.00 0.00 179.25 180.87 2h5j h THR 255 N 0.47 0.54 -0.25 0.00 2.02 -1.93 -2.46 112.91 111.29 2h5j h THR 255 Ca 0.43 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.55 2h5j h THR 255 Cb 0.97 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2h5j h THR 255 CO -0.16 0.02 0.00 0.49 0.37 0.00 0.00 175.52 176.23 2h5j n PHE 256 N -3.83 0.33 -3.46 3.16 3.01 -0.08 -5.02 117.46 111.57 2h5j n PHE 256 Ca -0.03 -0.38 -0.36 0.00 1.01 0.00 0.00 57.45 57.69 2h5j n PHE 256 Cb 0.10 -0.02 -0.06 0.00 -0.01 0.00 0.00 39.48 39.49 2h5j n PHE 256 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2h5j s HIS 257 N -0.97 3.67 -1.27 1.38 2.46 -0.93 -4.33 115.29 115.30 2h5j s HIS 257 Ca 0.19 0.99 -0.03 0.00 0.47 0.00 0.00 55.06 56.69 2h5j s HIS 257 Cb 0.11 -2.30 0.00 0.00 -0.13 0.00 0.00 32.58 30.26 2h5j s HIS 257 CO 0.14 0.55 0.38 0.00 -2.47 0.00 0.00 174.74 173.34 2h5j n ALA 258 N 1.30 -0.70 -2.40 1.58 0.00 1.00 -4.94 120.51 116.34 2h5j n ALA 258 Ca -0.10 0.21 -0.26 0.00 0.00 0.00 0.00 53.44 53.29 2h5j n ALA 258 Cb 0.52 -2.90 -0.00 0.00 0.00 0.00 0.00 19.45 17.07 2h5j n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2h5j s LYS 259 N -5.31 3.45 0.36 0.00 -0.14 -1.25 -4.70 119.74 112.15 2h5j s LYS 259 Ca 0.19 -0.05 0.05 0.00 -1.36 0.00 0.00 55.97 54.80 2h5j s LYS 259 Cb -0.08 -2.48 -0.07 0.00 -1.68 0.00 0.00 37.83 33.52 2h5j s LYS 259 CO 0.23 -0.12 0.04 0.15 -0.76 0.00 0.00 175.35 174.90 2h5j s LYS 260 N -4.60 1.79 -0.10 1.68 -0.14 -1.26 -0.61 119.74 116.50 2h5j s LYS 260 Ca 0.45 -2.01 -0.10 0.00 -1.36 0.00 0.00 55.97 52.95 2h5j s LYS 260 Cb -0.10 -1.15 0.03 0.00 -1.68 0.00 0.00 37.83 34.93 2h5j s LYS 260 CO 0.41 -0.16 0.29 -1.14 -0.76 0.00 0.00 175.35 173.99 2h5j s GLN 261 N -3.82 0.34 -0.06 1.68 0.74 -1.26 -5.02 119.66 112.26 2h5j s GLN 261 Ca 0.35 0.38 0.06 0.00 0.05 0.00 0.00 55.36 56.19 2h5j s GLN 261 Cb 0.09 0.17 -0.01 0.00 1.10 0.00 0.00 33.01 34.35 2h5j s GLN 261 CO 0.16 -0.04 -0.24 -1.50 -0.55 0.00 0.00 175.29 173.12 2h5j s ILE 262 N 0.12 1.99 1.04 -2.34 1.10 -1.26 -3.81 121.20 118.03 2h5j s ILE 262 Ca -0.00 -1.03 -0.17 0.00 -0.51 0.00 0.00 60.65 58.94 2h5j s ILE 262 Cb -0.02 -1.69 0.23 0.00 0.15 0.00 0.00 42.46 41.13 2h5j s ILE 262 CO 0.00 0.55 1.27 -2.84 -2.11 0.00 0.00 174.94 171.82 2h5j s PRO 263 N -0.10 0.04 -0.18 3.50 0.02 -1.23 -2.64 135.00 134.41 2h5j s PRO 263 Ca -0.05 -0.36 -0.05 0.00 0.02 0.00 0.00 61.00 60.57 2h5j s PRO 263 Cb -0.14 -1.77 0.07 0.00 0.02 0.00 0.00 34.50 32.68 2h5j s PRO 263 CO 0.04 -2.82 0.15 0.00 -0.33 0.00 0.00 177.00 174.04 2h5j s ILE 265 N 2.22 4.88 -0.30 0.00 1.01 -1.26 -1.34 121.20 126.40 2h5j s ILE 265 Ca 0.04 1.00 -0.02 0.00 0.00 0.00 0.00 60.65 61.67 2h5j s ILE 265 Cb -0.16 -4.06 0.05 0.00 0.01 0.00 0.00 42.46 38.30 2h5j s ILE 265 CO -0.10 -0.19 0.00 -0.69 0.00 0.00 0.00 174.94 173.96 2h5j s VAL 266 N 2.75 2.98 -0.16 2.92 1.01 -0.31 -5.02 120.40 124.58 2h5j s VAL 266 Ca 0.28 -1.41 0.00 0.00 0.00 0.00 0.00 61.98 60.86 2h5j s VAL 266 Cb -0.15 -2.72 0.00 0.00 0.00 0.00 0.00 36.38 33.51 2h5j s VAL 266 CO 0.12 -0.12 -0.16 -0.55 0.00 0.00 0.00 175.10 174.39 2h5j s SER 267 N 1.26 3.54 -0.27 3.32 0.15 -1.26 0.24 113.70 120.68 2h5j s SER 267 Ca -0.05 -0.52 0.12 0.00 0.70 0.00 0.00 55.95 56.20 2h5j s SER 267 Cb -0.20 -1.55 0.58 0.00 -1.71 0.00 0.00 66.02 63.15 2h5j s SER 267 CO -0.01 0.06 1.56 0.23 1.20 0.00 0.00 173.24 176.28 2h5j n MET 268 N 4.25 2.73 -1.84 5.44 2.81 0.14 -5.02 117.12 125.63 2h5j n MET 268 Ca -0.19 -3.03 -0.32 0.00 -1.81 0.00 0.00 57.70 52.35 2h5j n MET 268 Cb 0.51 -1.95 0.03 0.00 -0.71 0.00 0.00 33.22 31.10 2h5j n MET 268 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2h5j s LEU 269 N -3.03 3.34 0.00 4.03 1.43 -1.18 -0.20 118.68 123.06 2h5j s LEU 269 Ca 0.47 1.72 0.01 0.00 -1.03 0.00 0.00 54.13 55.30 2h5j s LEU 269 Cb 0.40 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 42.10 2h5j s LEU 269 CO 0.07 -1.28 0.32 0.35 0.23 0.00 0.00 176.35 176.04 2h5j n THR 270 N -2.51 0.00 -4.15 5.49 -2.24 -1.26 -4.82 114.28 104.79 2h5j n THR 270 Ca 0.08 -0.49 -0.11 0.00 -2.27 0.00 0.00 64.05 61.27 2h5j n THR 270 Cb 0.53 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.68 2h5j n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2h5j s LYS 271 N -0.55 1.08 0.41 -0.78 1.02 -1.26 -5.14 119.74 114.52 2h5j s LYS 271 Ca 0.01 -1.49 -0.24 0.00 0.02 0.00 0.00 55.97 54.27 2h5j s LYS 271 Cb 0.01 0.27 -0.09 0.00 -0.52 0.00 0.00 37.83 37.51 2h5j s LYS 271 CO 0.03 -0.34 1.08 -1.21 -0.92 0.00 0.00 175.35 173.98 2h5j s GLU 272 N -4.09 4.09 -0.24 1.68 2.02 -1.26 -5.05 118.70 115.85 2h5j s GLU 272 Ca 0.30 1.58 -0.03 0.00 0.02 0.00 0.00 54.97 56.84 2h5j s GLU 272 Cb 0.07 -2.53 0.01 0.00 0.10 0.00 0.00 34.13 31.78 2h5j s GLU 272 CO 0.06 -0.22 -0.04 -1.17 0.02 0.00 0.00 175.26 173.90 2h5j s LEU 273 N -2.69 3.13 -0.12 1.80 0.20 -1.26 -5.03 118.68 114.71 2h5j s LEU 273 Ca 0.59 -0.68 0.02 0.00 0.69 0.00 0.00 54.13 54.74 2h5j s LEU 273 Cb -0.24 -1.71 -0.01 0.00 -0.43 0.00 0.00 46.19 43.81 2h5j s LEU 273 CO 0.30 -0.09 -0.18 -0.31 -0.29 0.00 0.00 176.35 175.77 2h5j s TYR 274 N 1.40 2.70 -0.11 5.38 2.02 -1.26 -0.57 117.35 126.91 2h5j s TYR 274 Ca 0.03 -0.86 0.01 0.00 -0.37 0.00 0.00 57.07 55.87 2h5j s TYR 274 Cb -0.16 -1.79 0.13 0.00 -0.40 0.00 0.00 41.96 39.75 2h5j s TYR 274 CO -0.04 -0.33 1.38 1.19 -1.57 0.00 0.00 175.55 176.18 2h5j n PHE 275 N 3.58 0.68 -4.04 2.71 3.72 -1.26 -4.82 117.46 118.03 2h5j n PHE 275 Ca -0.19 -0.94 -0.12 0.00 -0.05 0.00 0.00 57.45 56.16 2h5j n PHE 275 Cb 0.53 -0.47 -0.05 0.00 -0.94 0.00 0.00 39.48 38.55 2h5j n PHE 275 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 2h5j s TYR 276 N -0.74 0.71 -0.03 1.38 -0.85 -1.26 -4.95 117.35 111.60 2h5j s TYR 276 Ca 0.13 -1.03 -0.18 0.00 -0.52 0.00 0.00 57.07 55.47 2h5j s TYR 276 Cb 0.11 0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.54 2h5j s TYR 276 CO 0.02 -1.07 0.39 -3.38 -1.52 0.00 0.00 175.55 169.99 2h5j s HIS 277 N -3.49 -0.30 -2.74 -3.49 -3.43 -1.26 -5.17 115.29 95.40 2h5j s HIS 277 Ca 0.27 0.51 0.26 0.00 -0.80 0.00 0.00 55.06 55.30 2h5j s HIS 277 Cb -0.00 0.16 0.63 0.00 -1.43 0.00 0.00 32.58 31.94 2h5j s HIS 277 CO 0.14 -0.42 1.51 0.72 -2.00 0.00 0.00 174.74 174.69