#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cnl s SER 176 N 0.00 -0.08 0.36 0.00 1.04 -1.26 -5.18 113.70 108.58 2cnl s SER 176 Ca 0.00 -0.13 -0.15 0.00 0.48 0.00 0.00 55.95 56.15 2cnl s SER 176 Cb 0.00 0.29 0.04 0.00 0.10 0.00 0.00 66.02 66.46 2cnl s SER 176 CO 0.00 -0.49 0.73 -0.83 0.98 0.00 0.00 173.24 173.63 2cnl s GLY 177 N -1.66 0.46 0.08 7.32 0.00 -1.26 -5.05 107.32 107.20 2cnl s GLY 177 Ca -0.10 -0.79 0.25 0.00 0.00 0.00 0.00 44.72 44.07 2cnl s GLY 177 CO 0.00 -0.38 1.39 3.33 0.00 0.00 0.00 173.10 177.45 2cnl n VAL 178 N -0.52 0.24 -1.33 1.40 0.24 -1.26 -4.34 118.33 112.75 2cnl n VAL 178 Ca -0.07 -0.18 0.06 0.00 -2.04 0.00 0.00 64.34 62.12 2cnl n VAL 178 Cb 0.60 -0.05 0.19 0.00 -1.47 0.00 0.00 33.84 33.11 2cnl n VAL 178 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2cnl n ASP 179 N -1.90 2.23 -4.04 -1.34 5.68 -1.26 -5.05 116.55 110.87 2cnl n ASP 179 Ca 0.04 -3.50 -0.10 0.00 -0.50 0.00 0.00 54.79 50.73 2cnl n ASP 179 Cb 0.40 -0.51 -0.08 0.00 -1.14 0.00 0.00 41.12 39.80 2cnl n ASP 179 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 2cnl s ASP 180 N -2.91 0.13 -1.24 -1.12 -4.77 -1.26 -4.94 116.67 100.56 2cnl s ASP 180 Ca 0.37 -1.03 -0.03 0.00 -3.30 0.00 0.00 52.55 48.56 2cnl s ASP 180 Cb 0.34 0.39 -0.01 0.00 -1.09 0.00 0.00 42.92 42.55 2cnl s ASP 180 CO -0.01 -0.85 0.77 -0.67 0.70 0.00 0.00 175.17 175.11 2cnl n ASP 181 N -0.19 -2.41 -4.77 2.11 -0.08 -1.26 -4.87 116.55 105.08 2cnl n ASP 181 Ca -0.06 -0.81 -0.39 0.00 -1.51 0.00 0.00 54.79 52.03 2cnl n ASP 181 Cb 0.63 -4.25 -0.02 0.00 2.34 0.00 0.00 41.12 39.83 2cnl n ASP 181 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 2cnl s MET 182 N -5.71 4.15 0.13 -0.67 -1.94 -1.26 -4.94 119.30 109.06 2cnl s MET 182 Ca 0.11 2.00 -0.17 0.00 -1.71 0.00 0.00 55.69 55.92 2cnl s MET 182 Cb -0.03 -2.83 -0.02 0.00 2.01 0.00 0.00 34.83 33.96 2cnl s MET 182 CO 0.80 -0.29 1.75 0.00 -0.01 0.00 0.00 175.02 177.27 2cnl h ALA 183 N 2.92 0.43 -2.65 3.03 0.00 -2.04 -3.38 119.26 117.56 2cnl h ALA 183 Ca -0.49 -0.06 -0.69 0.00 0.00 0.00 0.00 54.91 53.67 2cnl h ALA 183 Cb 1.23 -0.13 -0.19 0.00 0.00 0.00 0.00 17.79 18.70 2cnl h ALA 183 CO 0.64 -0.06 -0.44 0.00 0.00 0.00 0.00 179.25 179.38 2cnl s HIS 185 N 1.75 3.31 0.10 0.00 0.09 -1.26 -5.03 115.29 114.24 2cnl s HIS 185 Ca 0.06 1.12 0.02 0.00 -0.00 0.00 0.00 55.06 56.27 2cnl s HIS 185 Cb -0.18 -3.54 -0.04 0.00 -0.00 0.00 0.00 32.58 28.82 2cnl s HIS 185 CO 0.11 -1.80 -0.08 0.15 -0.00 0.00 0.00 174.74 173.12 2cnl s LYS 186 N 1.23 0.86 0.16 1.40 1.02 -1.26 -5.17 119.74 117.98 2cnl s LYS 186 Ca 0.61 -1.31 0.06 0.00 0.02 0.00 0.00 55.97 55.35 2cnl s LYS 186 Cb -0.32 -0.31 -0.04 0.00 -0.52 0.00 0.00 37.83 36.63 2cnl s LYS 186 CO 0.29 0.01 -0.14 0.96 -0.92 0.00 0.00 175.35 175.56 2cnl s ILE 187 N -3.37 1.47 0.44 2.17 -4.36 -1.26 -5.12 121.20 111.16 2cnl s ILE 187 Ca 0.11 -1.99 -0.25 0.00 -0.26 0.00 0.00 60.65 58.26 2cnl s ILE 187 Cb 0.03 -1.81 -0.08 0.00 1.25 0.00 0.00 42.46 41.85 2cnl s ILE 187 CO -0.03 -0.55 1.35 -2.84 0.24 0.00 0.00 174.94 173.10 2cnl s PRO 188 N -3.28 3.79 0.47 0.37 0.02 -1.26 -4.89 135.00 130.22 2cnl s PRO 188 Ca 0.16 2.24 0.31 0.00 0.02 0.00 0.00 61.00 63.73 2cnl s PRO 188 Cb -0.02 -2.66 1.32 0.00 0.02 0.00 0.00 34.50 33.16 2cnl s PRO 188 CO 0.04 -0.67 1.92 -0.39 -0.33 0.00 0.00 177.00 177.57 2cnl h VAL 189 N 2.30 0.00 -0.02 3.83 -1.51 -2.04 -1.93 116.25 116.88 2cnl h VAL 189 Ca -0.50 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.58 2cnl h VAL 189 Cb 1.26 1.30 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 2cnl h VAL 189 CO 0.61 0.00 -0.02 -0.62 -1.23 0.00 0.00 177.57 176.32 2cnl n GLU 190 N -2.83 1.83 -1.87 5.19 -0.58 -1.26 -4.95 120.64 116.17 2cnl n GLU 190 Ca 0.01 -1.24 -0.32 0.00 -0.42 0.00 0.00 57.16 55.19 2cnl n GLU 190 Cb 0.26 -1.47 0.03 0.00 -0.57 0.00 0.00 31.44 29.69 2cnl n GLU 190 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2cnl s ALA 191 N -2.03 2.69 -0.84 0.62 0.00 -0.73 -4.09 121.76 117.39 2cnl s ALA 191 Ca 0.34 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.61 2cnl s ALA 191 Cb 0.21 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 20.10 2cnl s ALA 191 CO 0.34 -0.99 0.00 -0.25 0.00 0.00 0.00 175.76 174.86 2cnl n ASP 192 N -2.42 -3.38 -4.62 0.00 8.00 0.28 -5.00 116.55 109.41 2cnl n ASP 192 Ca 0.08 0.04 -0.31 0.00 0.71 0.00 0.00 54.79 55.31 2cnl n ASP 192 Cb 0.53 -2.48 -0.10 0.00 -0.02 0.00 0.00 41.12 39.05 2cnl n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2cnl s PHE 193 N -2.45 2.91 -0.05 1.24 0.08 -1.23 -4.84 117.98 113.65 2cnl s PHE 193 Ca 0.00 -0.04 -0.01 0.00 0.12 0.00 0.00 56.93 57.01 2cnl s PHE 193 Cb 0.00 -1.58 0.03 0.00 -0.57 0.00 0.00 43.02 40.90 2cnl s PHE 193 CO 0.00 0.41 0.00 -1.17 -0.10 0.00 0.00 175.22 174.37 2cnl s LEU 194 N -1.73 0.78 -0.26 -0.37 1.98 -1.26 -0.74 118.68 117.07 2cnl s LEU 194 Ca 0.20 -0.05 -0.03 0.00 -2.89 0.00 0.00 54.13 51.36 2cnl s LEU 194 Cb -0.11 -0.33 0.02 0.00 0.66 0.00 0.00 46.19 46.43 2cnl s LEU 194 CO 0.11 -0.16 -0.02 -0.31 -1.89 0.00 0.00 176.35 174.08 2cnl s TYR 195 N 1.59 3.09 -0.65 5.38 1.51 0.13 -5.01 117.35 123.40 2cnl s TYR 195 Ca -0.01 -1.39 -0.14 0.00 -1.01 0.00 0.00 57.07 54.51 2cnl s TYR 195 Cb -0.13 -2.11 0.16 0.00 -0.11 0.00 0.00 41.96 39.77 2cnl s TYR 195 CO -0.03 -0.68 0.59 0.00 -1.11 0.00 0.00 175.55 174.31 2cnl s ALA 196 N 1.37 3.79 0.19 3.71 0.00 -1.26 -0.86 121.76 128.71 2cnl s ALA 196 Ca 0.01 -2.87 -0.24 0.00 0.00 0.00 0.00 51.96 48.86 2cnl s ALA 196 Cb -0.17 -3.30 -0.08 0.00 0.00 0.00 0.00 23.12 19.57 2cnl s ALA 196 CO -0.02 -2.11 0.77 0.71 0.00 0.00 0.00 175.76 175.10 2cnl s TYR 197 N 0.95 3.81 -0.04 0.00 2.02 -0.43 -4.96 117.35 118.70 2cnl s TYR 197 Ca 0.10 1.57 0.31 0.00 -0.37 0.00 0.00 57.07 58.68 2cnl s TYR 197 Cb -0.22 -2.73 1.15 0.00 -0.40 0.00 0.00 41.96 39.77 2cnl s TYR 197 CO -0.02 0.44 1.90 0.66 -1.57 0.00 0.00 175.55 176.96 2cnl h SER 198 N 3.96 0.00 -5.21 2.29 4.64 -1.93 0.01 113.55 117.31 2cnl h SER 198 Ca -0.47 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.76 2cnl h SER 198 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.17 2cnl h SER 198 CO 0.66 0.00 -0.24 0.28 -0.87 0.00 0.00 176.83 176.66 2cnl s THR 199 N -3.56 0.06 0.71 2.95 -1.32 -1.26 -3.59 115.64 109.63 2cnl s THR 199 Ca 0.03 -1.23 -0.14 0.00 -1.21 0.00 0.00 61.69 59.14 2cnl s THR 199 Cb 0.08 -1.74 0.02 0.00 -1.51 0.00 0.00 72.50 69.35 2cnl s THR 199 CO 0.56 -0.28 1.13 0.00 -2.21 0.00 0.00 174.62 173.82 2cnl s ALA 200 N -3.94 2.31 0.19 11.08 0.00 -0.75 -4.13 121.76 126.52 2cnl s ALA 200 Ca 0.14 0.56 -0.33 0.00 0.00 0.00 0.00 51.96 52.34 2cnl s ALA 200 Cb 0.02 -3.35 -0.14 0.00 0.00 0.00 0.00 23.12 19.66 2cnl s ALA 200 CO -0.01 -1.55 1.49 -2.30 0.00 0.00 0.00 175.76 173.39 2cnl n PRO 201 N -2.76 2.05 -0.57 0.00 -0.02 -1.26 -2.05 135.00 130.39 2cnl n PRO 201 Ca 0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 2cnl n PRO 201 Cb 0.52 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2cnl n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cnl n GLY 202 N 2.83 1.28 3.82 -1.23 0.00 -1.26 -5.04 105.19 105.59 2cnl n GLY 202 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2cnl n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cnl s TYR 203 N -3.35 3.18 0.82 1.61 1.51 -0.87 -5.11 117.35 115.14 2cnl s TYR 203 Ca 0.00 -0.02 -0.11 0.00 -1.01 0.00 0.00 57.07 55.93 2cnl s TYR 203 Cb 0.00 -1.51 0.08 0.00 -0.11 0.00 0.00 41.96 40.42 2cnl s TYR 203 CO 0.00 0.52 1.09 0.71 -1.11 0.00 0.00 175.55 176.76 2cnl s TYR 204 N -1.81 2.48 -0.06 2.71 1.51 -1.26 -4.83 117.35 116.09 2cnl s TYR 204 Ca 0.32 1.45 0.06 0.00 -1.01 0.00 0.00 57.07 57.88 2cnl s TYR 204 Cb -0.10 -3.09 -0.01 0.00 -0.11 0.00 0.00 41.96 38.65 2cnl s TYR 204 CO 0.24 -2.02 -0.24 0.45 -1.11 0.00 0.00 175.55 172.88 2cnl s SER 205 N -3.40 2.91 -0.00 2.29 0.15 -1.26 -4.86 113.70 109.53 2cnl s SER 205 Ca 0.62 -0.49 -0.13 0.00 0.70 0.00 0.00 55.95 56.65 2cnl s SER 205 Cb -0.17 -0.85 -0.05 0.00 -1.71 0.00 0.00 66.02 63.23 2cnl s SER 205 CO 0.56 0.22 0.37 0.26 1.20 0.00 0.00 173.24 175.86 2cnl s TRP 206 N -0.08 3.69 -0.02 3.44 0.52 -1.26 -5.09 118.94 120.13 2cnl s TRP 206 Ca -0.05 0.91 0.01 0.00 0.02 0.00 0.00 56.10 56.98 2cnl s TRP 206 Cb -0.14 -2.22 0.02 0.00 -1.15 0.00 0.00 33.47 29.98 2cnl s TRP 206 CO 0.04 0.64 -0.01 0.50 0.02 0.00 0.00 176.95 178.14 2cnl s ARG 207 N -1.20 0.31 -0.22 4.98 3.52 -1.26 -2.70 118.95 122.39 2cnl s ARG 207 Ca 0.24 0.01 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 2cnl s ARG 207 Cb -0.16 -0.42 -0.02 0.00 -1.56 0.00 0.00 34.95 32.79 2cnl s ARG 207 CO 0.13 -0.07 0.64 1.21 -0.81 0.00 0.00 175.30 176.40 2cnl s ASN 208 N 0.68 6.66 0.53 -2.12 3.84 -0.12 -4.90 114.94 119.50 2cnl s ASN 208 Ca -0.07 0.81 0.27 0.00 0.21 0.00 0.00 52.86 54.08 2cnl s ASN 208 Cb -0.10 -2.35 1.48 0.00 -0.55 0.00 0.00 41.25 39.73 2cnl s ASN 208 CO -0.01 -0.32 1.81 0.77 -2.79 0.00 0.00 177.10 176.56 2cnl h SER 209 N 7.62 0.00 0.00 -4.21 4.64 -2.00 -0.23 113.55 119.37 2cnl h SER 209 Ca -0.30 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.83 2cnl h SER 209 Cb 1.13 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 2cnl h SER 209 CO 0.78 0.00 -1.73 0.29 -0.87 0.00 0.00 176.83 175.30 2cnl n LYS 210 N -2.61 0.31 0.01 4.77 4.01 -1.26 -4.75 118.16 118.63 2cnl n LYS 210 Ca -0.02 0.08 0.11 0.00 -0.51 0.00 0.00 58.31 57.97 2cnl n LYS 210 Cb 0.25 -1.22 0.06 0.00 -0.51 0.00 0.00 35.03 33.61 2cnl n LYS 210 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 2cnl n ASP 211 N -2.97 0.71 0.00 4.39 8.00 -1.16 -5.09 116.55 120.43 2cnl n ASP 211 Ca -0.23 -0.52 0.00 0.00 0.71 0.00 0.00 54.79 54.75 2cnl n ASP 211 Cb 0.73 0.66 0.00 0.00 -0.02 0.00 0.00 41.12 42.49 2cnl n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cnl n GLY 212 N 1.47 -3.95 3.78 0.44 0.00 -0.11 -4.90 105.19 101.92 2cnl n GLY 212 Ca 0.04 -2.13 -0.36 0.00 0.00 0.00 0.00 46.02 43.57 2cnl n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cnl s SER 213 N -0.17 6.17 0.19 1.61 1.04 -1.26 -0.95 113.70 120.33 2cnl s SER 213 Ca 0.00 2.19 -0.12 0.00 0.48 0.00 0.00 55.95 58.50 2cnl s SER 213 Cb 0.00 -2.59 0.15 0.00 0.10 0.00 0.00 66.02 63.68 2cnl s SER 213 CO 0.00 -0.91 1.83 -0.50 0.98 0.00 0.00 173.24 174.64 2cnl h TRP 214 N 1.84 0.71 0.22 5.02 6.55 -1.89 -1.23 115.95 127.18 2cnl h TRP 214 Ca -0.49 0.02 -0.01 0.00 0.95 0.00 0.00 58.89 59.36 2cnl h TRP 214 Cb 1.24 -0.23 0.00 0.00 -0.86 0.00 0.00 29.16 29.32 2cnl h TRP 214 CO 0.54 0.40 -0.11 0.35 -1.05 0.00 0.00 178.44 178.57 2cnl h PHE 215 N 0.74 -0.28 -0.63 0.49 3.57 -1.89 -1.83 116.94 117.12 2cnl h PHE 215 Ca 0.25 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 2cnl h PHE 215 Cb 0.03 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 2cnl h PHE 215 CO -0.05 -0.04 0.07 0.82 -2.23 0.00 0.00 178.31 176.88 2cnl h ILE 216 N -0.49 1.26 0.03 1.41 1.08 -1.94 0.15 117.51 119.01 2cnl h ILE 216 Ca -0.03 -1.05 0.03 0.00 -0.39 0.00 0.00 64.86 63.42 2cnl h ILE 216 Cb 0.37 0.69 -0.04 0.00 -3.07 0.00 0.00 36.82 34.77 2cnl h ILE 216 CO 0.05 0.39 -0.27 1.56 -0.69 0.00 0.00 178.15 179.19 2cnl h GLN 217 N 0.98 -0.42 -0.67 2.37 4.20 -1.20 -1.38 115.11 118.99 2cnl h GLN 217 Ca 0.19 0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.87 2cnl h GLN 217 Cb 0.46 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 2cnl h GLN 217 CO 0.02 -0.28 0.19 0.77 -0.67 0.00 0.00 178.83 178.86 2cnl h SER 218 N -0.43 0.99 -0.27 1.46 0.02 -1.09 -2.17 113.55 112.07 2cnl h SER 218 Ca 0.06 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 60.78 2cnl h SER 218 Cb 0.50 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2cnl h SER 218 CO -0.22 0.94 0.15 0.25 -1.14 0.00 0.00 176.83 176.81 2cnl h LEU 219 N 0.98 0.33 -0.69 5.07 5.85 -0.46 -0.70 115.31 125.69 2cnl h LEU 219 Ca 0.21 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 2cnl h LEU 219 Cb 0.32 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2cnl h LEU 219 CO -0.00 0.31 0.25 0.00 -0.34 0.00 0.00 178.44 178.65 2cnl h ALA 221 N 1.11 0.68 -0.11 0.00 0.00 -1.13 -0.02 119.26 119.80 2cnl h ALA 221 Ca 0.23 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 2cnl h ALA 221 Cb 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2cnl h ALA 221 CO -0.01 0.18 -0.61 0.52 0.00 0.00 0.00 179.25 179.33 2cnl h MET 222 N 0.71 0.36 -0.31 0.00 2.07 -0.92 -2.34 114.93 114.50 2cnl h MET 222 Ca 0.19 -0.25 -0.06 0.00 -2.07 0.00 0.00 59.70 57.51 2cnl h MET 222 Cb 0.02 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 29.77 2cnl h MET 222 CO -0.03 0.86 -0.05 -0.07 1.07 0.00 0.00 176.91 178.68 2cnl h LEU 223 N 0.27 0.59 -1.23 1.22 3.38 -0.86 0.21 115.31 118.90 2cnl h LEU 223 Ca -0.01 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 2cnl h LEU 223 Cb 1.13 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 2cnl h LEU 223 CO 0.10 0.80 0.40 0.11 0.09 0.00 0.00 178.44 179.95 2cnl h LYS 224 N 0.37 0.93 0.03 1.13 1.57 -0.94 -0.54 116.57 119.12 2cnl h LYS 224 Ca 0.08 -0.08 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 2cnl h LYS 224 Cb 0.53 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 2cnl h LYS 224 CO 0.03 0.66 -1.45 0.37 -0.57 0.00 0.00 179.45 178.49 2cnl h GLN 225 N 0.94 0.06 0.00 3.15 4.15 -1.27 -3.42 115.11 118.73 2cnl h GLN 225 Ca 0.25 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.56 2cnl h GLN 225 Cb -0.02 0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2cnl h GLN 225 CO -0.04 0.81 0.00 0.66 -1.93 0.00 0.00 178.83 178.33 2cnl n TYR 226 N -3.25 0.00 0.27 3.99 4.01 0.73 -4.75 117.16 118.17 2cnl n TYR 226 Ca -0.12 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.77 2cnl n TYR 226 Cb 1.01 0.00 0.87 0.00 -0.31 0.00 0.00 39.34 40.91 2cnl n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2cnl h ALA 227 N 0.00 1.65 -0.56 -0.72 0.00 -1.22 0.88 119.26 119.29 2cnl h ALA 227 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2cnl h ALA 227 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2cnl h ALA 227 CO 0.00 -0.07 0.00 -0.40 0.00 0.00 0.00 179.25 178.78 2cnl n ASP 228 N -3.91 5.14 0.00 0.00 5.75 -1.26 -4.23 116.55 118.03 2cnl n ASP 228 Ca -0.02 -2.76 0.00 0.00 -0.01 0.00 0.00 54.79 52.00 2cnl n ASP 228 Cb 0.14 -0.62 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 2cnl n ASP 228 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2cnl n LYS 229 N 0.65 0.26 -4.42 0.11 5.02 -0.16 -5.03 118.16 114.58 2cnl n LYS 229 Ca 0.26 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.29 2cnl n LYS 229 Cb 1.04 -0.58 -0.11 0.00 -0.02 0.00 0.00 35.03 35.36 2cnl n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2cnl s LEU 230 N -2.58 2.50 0.47 -0.35 1.43 0.12 -5.12 118.68 115.15 2cnl s LEU 230 Ca 0.00 -0.87 -0.23 0.00 -1.03 0.00 0.00 54.13 52.01 2cnl s LEU 230 Cb 0.00 -1.20 -0.07 0.00 0.03 0.00 0.00 46.19 44.95 2cnl s LEU 230 CO 0.00 0.11 1.17 -0.70 0.23 0.00 0.00 176.35 177.16 2cnl s GLU 231 N -2.81 3.71 0.28 1.70 -6.30 -1.26 -4.77 118.70 109.25 2cnl s GLU 231 Ca 0.22 1.79 0.02 0.00 -2.50 0.00 0.00 54.97 54.50 2cnl s GLU 231 Cb -0.08 -2.38 0.65 0.00 0.00 0.00 0.00 34.13 32.32 2cnl s GLU 231 CO 0.11 -0.60 1.71 0.35 0.02 0.00 0.00 175.26 176.86 2cnl h PHE 232 N 1.99 0.65 -0.61 5.30 3.57 -1.27 -0.65 116.94 125.92 2cnl h PHE 232 Ca -0.49 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.01 2cnl h PHE 232 Cb 1.25 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.81 2cnl h PHE 232 CO 0.53 0.02 0.23 0.52 -2.23 0.00 0.00 178.31 177.37 2cnl h MET 233 N 0.45 0.89 -0.11 1.11 2.86 -1.92 -0.28 114.93 117.94 2cnl h MET 233 Ca 0.52 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.90 2cnl h MET 233 Cb 0.91 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 2cnl h MET 233 CO -0.48 0.74 -0.44 0.45 1.06 0.00 0.00 176.91 178.24 2cnl h HIS 234 N 0.88 0.30 -0.16 -0.22 3.86 -1.51 -0.56 115.15 117.74 2cnl h HIS 234 Ca 0.20 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.30 2cnl h HIS 234 Cb 0.19 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 2cnl h HIS 234 CO 0.01 0.65 -0.01 0.82 0.86 0.00 0.00 177.93 180.27 2cnl h ILE 235 N 0.21 1.26 0.00 2.45 2.04 -0.61 -2.34 117.51 120.52 2cnl h ILE 235 Ca 0.01 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 2cnl h ILE 235 Cb 0.87 1.53 -0.00 0.00 -0.74 0.00 0.00 36.82 38.48 2cnl h ILE 235 CO 0.07 0.26 -0.14 -0.07 0.00 0.00 0.00 178.15 178.27 2cnl h LEU 236 N 0.02 0.00 -0.67 1.44 3.38 -0.81 -1.04 115.31 117.62 2cnl h LEU 236 Ca 0.04 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 2cnl h LEU 236 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2cnl h LEU 236 CO 0.01 0.14 -0.34 0.74 0.09 0.00 0.00 178.44 179.08 2cnl h THR 237 N 0.00 1.29 -0.42 0.22 2.02 -0.84 -0.36 112.91 114.82 2cnl h THR 237 Ca -0.00 -1.48 -0.08 0.00 0.77 0.00 0.00 66.41 65.61 2cnl h THR 237 Cb 0.26 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 2cnl h THR 237 CO 0.02 0.48 -0.08 0.03 0.37 0.00 0.00 175.52 176.34 2cnl h ARG 238 N 0.54 0.73 -0.45 6.66 2.47 -0.69 -1.76 114.38 121.88 2cnl h ARG 238 Ca 0.06 -0.22 -0.04 0.00 -1.26 0.00 0.00 59.98 58.52 2cnl h ARG 238 Cb 0.85 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.08 2cnl h ARG 238 CO 0.07 0.79 0.14 0.28 0.56 0.00 0.00 179.97 181.81 2cnl h VAL 239 N 0.67 1.22 -0.44 2.04 2.07 -0.77 -0.69 116.25 120.35 2cnl h VAL 239 Ca 0.12 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 66.96 2cnl h VAL 239 Cb 0.53 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 2cnl h VAL 239 CO 0.03 0.27 0.13 0.78 0.02 0.00 0.00 177.57 178.80 2cnl h ASN 240 N 0.60 0.11 -0.59 0.57 4.21 -0.58 -1.25 115.58 118.65 2cnl h ASN 240 Ca 0.15 0.06 -0.08 0.00 1.21 0.00 0.00 56.30 57.63 2cnl h ASN 240 Cb 0.27 0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 37.51 2cnl h ASN 240 CO -0.00 0.09 0.05 -0.09 -1.29 0.00 0.00 177.43 176.19 2cnl h ARG 241 N 0.29 1.01 -0.02 0.81 2.43 -1.04 -1.33 114.38 116.53 2cnl h ARG 241 Ca 0.21 -0.30 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2cnl h ARG 241 Cb 0.23 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2cnl h ARG 241 CO -0.24 0.97 0.01 -0.22 -1.51 0.00 0.00 179.97 178.99 2cnl h LYS 242 N 0.91 0.03 -0.52 0.20 3.64 -0.72 -0.83 116.57 119.27 2cnl h LYS 242 Ca 0.17 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2cnl h LYS 242 Cb 0.49 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 2cnl h LYS 242 CO 0.02 0.11 0.16 0.28 -2.27 0.00 0.00 179.45 177.75 2cnl h VAL 243 N -0.06 1.23 -0.72 2.00 2.07 -1.21 -1.25 116.25 118.30 2cnl h VAL 243 Ca 0.01 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.68 2cnl h VAL 243 Cb 0.09 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2cnl h VAL 243 CO -0.00 0.29 0.22 0.00 0.02 0.00 0.00 177.57 178.10 2cnl h ALA 244 N 1.02 1.02 0.11 1.67 0.00 -1.11 -3.14 119.26 118.82 2cnl h ALA 244 Ca 0.17 -0.23 -0.37 0.00 0.00 0.00 0.00 54.91 54.48 2cnl h ALA 244 Cb 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2cnl h ALA 244 CO -0.00 0.66 -2.05 0.25 0.00 0.00 0.00 179.25 178.10 2cnl n THR 245 N -4.25 1.74 0.52 0.00 -2.24 -0.33 -4.58 114.28 105.15 2cnl n THR 245 Ca 0.06 -0.63 0.12 0.00 -2.27 0.00 0.00 64.05 61.33 2cnl n THR 245 Cb 0.23 -1.70 0.22 0.00 -2.10 0.00 0.00 70.33 66.98 2cnl n THR 245 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2cnl h GLU 246 N 0.03 0.00 -6.49 -0.78 5.08 -1.35 -3.47 114.58 107.59 2cnl h GLU 246 Ca -0.45 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.23 2cnl h GLU 246 Cb 2.00 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 31.02 2cnl h GLU 246 CO 0.06 0.00 -0.80 -0.06 -1.00 0.00 0.00 179.01 177.21 2cnl s PHE 247 N -3.17 2.60 -0.21 4.33 0.08 -1.19 -5.07 117.98 115.36 2cnl s PHE 247 Ca 0.07 -0.23 -0.13 0.00 0.12 0.00 0.00 56.93 56.76 2cnl s PHE 247 Cb 0.12 -1.52 0.06 0.00 -0.57 0.00 0.00 43.02 41.12 2cnl s PHE 247 CO 0.69 0.22 0.51 -2.00 -0.10 0.00 0.00 175.22 174.54 2cnl s GLU 248 N -1.19 0.53 0.70 0.44 2.12 -1.26 -4.66 118.70 115.38 2cnl s GLU 248 Ca 0.14 0.90 -0.14 0.00 0.36 0.00 0.00 54.97 56.22 2cnl s GLU 248 Cb -0.11 0.09 0.02 0.00 0.26 0.00 0.00 34.13 34.40 2cnl s GLU 248 CO 0.04 -0.14 1.12 -1.54 -0.54 0.00 0.00 175.26 174.20 2cnl s SER 249 N 1.22 4.79 -0.08 -1.70 1.04 -0.15 -4.85 113.70 113.97 2cnl s SER 249 Ca -0.08 2.01 0.01 0.00 0.48 0.00 0.00 55.95 58.37 2cnl s SER 249 Cb -0.06 -2.55 0.02 0.00 0.10 0.00 0.00 66.02 63.53 2cnl s SER 249 CO -0.12 -1.85 -0.08 0.12 0.98 0.00 0.00 173.24 172.29 2cnl s PHE 250 N -2.44 1.28 -0.10 5.02 5.36 -1.26 -1.39 117.98 124.46 2cnl s PHE 250 Ca 0.66 -0.53 -0.15 0.00 -0.96 0.00 0.00 56.93 55.95 2cnl s PHE 250 Cb -0.21 -1.04 0.04 0.00 -0.34 0.00 0.00 43.02 41.47 2cnl s PHE 250 CO 0.46 -0.35 0.39 0.45 -1.46 0.00 0.00 175.22 174.70 2cnl s SER 251 N 1.20 -0.36 0.45 6.13 0.15 -1.26 -4.93 113.70 115.08 2cnl s SER 251 Ca -0.05 0.56 0.29 0.00 0.70 0.00 0.00 55.95 57.45 2cnl s SER 251 Cb -0.14 0.63 1.07 0.00 -1.71 0.00 0.00 66.02 65.87 2cnl s SER 251 CO -0.02 -0.27 1.85 -0.26 1.20 0.00 0.00 173.24 175.74 2cnl h PHE 252 N 4.80 0.00 -3.57 3.44 0.05 -2.00 -3.41 116.94 116.24 2cnl h PHE 252 Ca -0.28 0.00 -0.63 0.00 3.82 0.00 0.00 57.97 60.88 2cnl h PHE 252 Cb 1.18 0.00 -0.14 0.00 2.00 0.00 0.00 35.95 38.99 2cnl h PHE 252 CO 0.44 0.00 0.18 0.34 -0.18 0.00 0.00 178.31 179.09 2cnl s ASP 253 N -5.40 6.41 0.47 2.17 -1.08 -1.26 -4.94 116.67 113.04 2cnl s ASP 253 Ca 0.03 0.04 0.23 0.00 -0.52 0.00 0.00 52.55 52.33 2cnl s ASP 253 Cb 0.09 -2.34 1.24 0.00 -1.46 0.00 0.00 42.92 40.45 2cnl s ASP 253 CO 0.54 -0.67 1.89 0.00 0.52 0.00 0.00 175.17 177.45 2cnl h ALA 254 N 8.59 2.42 -0.74 3.66 0.00 -1.96 -1.07 119.26 130.17 2cnl h ALA 254 Ca -0.26 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.65 2cnl h ALA 254 Cb 1.10 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 2cnl h ALA 254 CO 0.86 -0.68 0.49 1.15 0.00 0.00 0.00 179.25 181.08 2cnl h THR 255 N 0.23 1.19 -0.45 0.00 2.02 -1.94 -2.87 112.91 111.10 2cnl h THR 255 Ca 0.42 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2cnl h THR 255 Cb 1.27 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2cnl h THR 255 CO -0.10 0.19 0.00 0.49 0.37 0.00 0.00 175.52 176.47 2cnl n PHE 256 N -4.42 0.59 -3.27 3.16 3.01 -0.45 -5.00 117.46 111.08 2cnl n PHE 256 Ca 0.08 -0.37 -0.34 0.00 1.01 0.00 0.00 57.45 57.83 2cnl n PHE 256 Cb 0.03 -0.01 -0.06 0.00 -0.01 0.00 0.00 39.48 39.44 2cnl n PHE 256 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2cnl s HIS 257 N -1.16 3.55 -1.48 1.38 2.46 -0.91 -4.34 115.29 114.79 2cnl s HIS 257 Ca 0.35 1.13 -0.07 0.00 0.47 0.00 0.00 55.06 56.95 2cnl s HIS 257 Cb 0.20 -2.43 0.01 0.00 -0.13 0.00 0.00 32.58 30.22 2cnl s HIS 257 CO 0.26 0.32 0.86 0.00 -2.47 0.00 0.00 174.74 173.72 2cnl n ALA 258 N 0.43 -1.12 -2.77 1.58 0.00 -0.48 -4.96 120.51 113.19 2cnl n ALA 258 Ca -0.02 0.34 -0.24 0.00 0.00 0.00 0.00 53.44 53.52 2cnl n ALA 258 Cb 0.52 -4.59 -0.02 0.00 0.00 0.00 0.00 19.45 15.36 2cnl n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2cnl s LYS 259 N -5.98 3.48 0.43 0.00 -0.14 -1.26 -4.75 119.74 111.52 2cnl s LYS 259 Ca 0.43 -0.45 0.06 0.00 -1.36 0.00 0.00 55.97 54.65 2cnl s LYS 259 Cb -0.19 -2.76 -0.06 0.00 -1.68 0.00 0.00 37.83 33.13 2cnl s LYS 259 CO 0.53 0.28 0.06 0.15 -0.76 0.00 0.00 175.35 175.61 2cnl s LYS 260 N -4.00 2.06 -0.11 1.68 -0.14 -1.26 -0.98 119.74 116.98 2cnl s LYS 260 Ca 0.38 -2.09 -0.12 0.00 -1.36 0.00 0.00 55.97 52.79 2cnl s LYS 260 Cb -0.10 -1.71 0.03 0.00 -1.68 0.00 0.00 37.83 34.37 2cnl s LYS 260 CO 0.32 -0.12 0.32 -1.14 -0.76 0.00 0.00 175.35 173.98 2cnl s GLN 261 N -3.79 0.42 -0.10 1.68 0.74 -1.26 -5.02 119.66 112.32 2cnl s GLN 261 Ca 0.33 0.37 -0.00 0.00 0.05 0.00 0.00 55.36 56.10 2cnl s GLN 261 Cb 0.07 0.20 0.02 0.00 1.10 0.00 0.00 33.01 34.41 2cnl s GLN 261 CO 0.17 -0.06 -0.07 -1.50 -0.55 0.00 0.00 175.29 173.28 2cnl s ILE 262 N -0.02 0.98 1.09 -2.34 2.07 -1.26 -3.47 121.20 118.24 2cnl s ILE 262 Ca -0.02 -0.27 -0.13 0.00 -1.41 0.00 0.00 60.65 58.83 2cnl s ILE 262 Cb -0.03 -1.00 0.24 0.00 0.13 0.00 0.00 42.46 41.80 2cnl s ILE 262 CO 0.01 0.36 1.06 -2.84 -1.91 0.00 0.00 174.94 171.61 2cnl s PRO 263 N 1.62 -0.30 -0.19 3.50 0.02 -1.24 -1.81 135.00 136.61 2cnl s PRO 263 Ca 0.03 0.70 -0.03 0.00 0.02 0.00 0.00 61.00 61.72 2cnl s PRO 263 Cb -0.13 -1.64 0.06 0.00 0.02 0.00 0.00 34.50 32.82 2cnl s PRO 263 CO -0.07 -3.27 0.05 0.00 -0.33 0.00 0.00 177.00 173.38 2cnl s ILE 265 N 1.93 4.94 -0.32 0.00 1.01 -1.26 -1.32 121.20 126.18 2cnl s ILE 265 Ca -0.00 1.39 0.04 0.00 0.00 0.00 0.00 60.65 62.07 2cnl s ILE 265 Cb -0.17 -4.03 0.09 0.00 0.01 0.00 0.00 42.46 38.36 2cnl s ILE 265 CO -0.08 0.04 0.00 -0.69 0.00 0.00 0.00 174.94 174.21 2cnl s VAL 266 N 2.23 2.25 -0.20 2.92 1.01 -0.04 -5.01 120.40 123.56 2cnl s VAL 266 Ca 0.32 -2.14 -0.05 0.00 0.00 0.00 0.00 61.98 60.12 2cnl s VAL 266 Cb -0.16 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 2cnl s VAL 266 CO 0.10 -0.43 -0.01 -0.55 0.00 0.00 0.00 175.10 174.21 2cnl s SER 267 N 0.96 4.76 -0.19 3.32 0.15 -1.26 -0.69 113.70 120.76 2cnl s SER 267 Ca 0.05 -0.22 0.13 0.00 0.70 0.00 0.00 55.95 56.62 2cnl s SER 267 Cb -0.19 -1.81 0.38 0.00 -1.71 0.00 0.00 66.02 62.69 2cnl s SER 267 CO -0.07 0.07 1.20 0.23 1.20 0.00 0.00 173.24 175.87 2cnl n MET 268 N 4.23 1.51 -2.00 5.44 2.81 0.08 -5.03 117.12 124.15 2cnl n MET 268 Ca -0.17 -3.08 -0.32 0.00 -1.81 0.00 0.00 57.70 52.32 2cnl n MET 268 Cb 0.52 -1.59 0.01 0.00 -0.71 0.00 0.00 33.22 31.45 2cnl n MET 268 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2cnl s LEU 269 N -3.13 3.40 0.00 4.03 1.43 -1.15 -0.56 118.68 122.70 2cnl s LEU 269 Ca 0.36 1.64 0.05 0.00 -1.03 0.00 0.00 54.13 55.15 2cnl s LEU 269 Cb 0.34 -4.51 0.03 0.00 0.03 0.00 0.00 46.19 42.09 2cnl s LEU 269 CO -0.04 -1.03 0.61 0.35 0.23 0.00 0.00 176.35 176.48 2cnl n THR 270 N -2.28 0.00 -4.00 5.49 -2.24 -1.26 -4.82 114.28 105.16 2cnl n THR 270 Ca 0.07 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.26 2cnl n THR 270 Cb 0.53 1.09 -0.07 0.00 -2.10 0.00 0.00 70.33 69.78 2cnl n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2cnl s LYS 271 N -0.46 1.17 0.51 -0.78 1.02 -1.26 -5.14 119.74 114.79 2cnl s LYS 271 Ca 0.05 -1.25 -0.19 0.00 0.02 0.00 0.00 55.97 54.60 2cnl s LYS 271 Cb 0.04 0.36 -0.07 0.00 -0.52 0.00 0.00 37.83 37.64 2cnl s LYS 271 CO 0.07 -0.42 1.04 -1.21 -0.92 0.00 0.00 175.35 173.91 2cnl s GLU 272 N -4.00 3.70 -0.15 1.68 2.02 -1.26 -5.04 118.70 115.65 2cnl s GLU 272 Ca 0.20 1.33 -0.00 0.00 0.02 0.00 0.00 54.97 56.52 2cnl s GLU 272 Cb 0.04 -2.08 0.03 0.00 0.10 0.00 0.00 34.13 32.22 2cnl s GLU 272 CO 0.02 -0.51 -0.09 -1.17 0.02 0.00 0.00 175.26 173.52 2cnl s LEU 273 N -3.71 1.61 -0.07 1.80 2.96 -1.26 -5.05 118.68 114.96 2cnl s LEU 273 Ca 0.66 -0.54 0.05 0.00 -0.22 0.00 0.00 54.13 54.09 2cnl s LEU 273 Cb -0.16 -1.02 -0.01 0.00 0.50 0.00 0.00 46.19 45.50 2cnl s LEU 273 CO 0.24 -0.12 -0.23 -0.31 -1.32 0.00 0.00 176.35 174.60 2cnl s TYR 274 N 1.58 2.51 -0.73 5.38 2.02 -1.26 -0.61 117.35 126.24 2cnl s TYR 274 Ca 0.03 -0.75 0.25 0.00 -0.37 0.00 0.00 57.07 56.23 2cnl s TYR 274 Cb -0.14 -1.64 0.91 0.00 -0.40 0.00 0.00 41.96 40.69 2cnl s TYR 274 CO -0.09 -0.23 1.76 1.19 -1.57 0.00 0.00 175.55 176.61 2cnl n PHE 275 N 3.06 0.68 -3.89 2.71 3.72 -1.26 -4.79 117.46 117.69 2cnl n PHE 275 Ca -0.18 0.22 -0.23 0.00 -0.05 0.00 0.00 57.45 57.21 2cnl n PHE 275 Cb 0.52 -0.86 -0.06 0.00 -0.94 0.00 0.00 39.48 38.15 2cnl n PHE 275 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 2cnl s TYR 276 N -3.14 2.65 0.00 1.38 -0.85 -1.26 -5.08 117.35 111.05 2cnl s TYR 276 Ca 0.09 -0.55 0.00 0.00 -0.52 0.00 0.00 57.07 56.09 2cnl s TYR 276 Cb 0.12 -2.05 0.00 0.00 0.38 0.00 0.00 41.96 40.41 2cnl s TYR 276 CO 0.50 0.05 0.00 -2.39 -1.52 0.00 0.00 175.55 172.20