#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c1e s SER 176 N 0.00 -0.05 0.35 0.00 1.04 -1.26 -5.18 113.70 108.60 2c1e s SER 176 Ca 0.00 -0.30 -0.17 0.00 0.48 0.00 0.00 55.95 55.96 2c1e s SER 176 Cb 0.00 0.34 0.04 0.00 0.10 0.00 0.00 66.02 66.50 2c1e s SER 176 CO 0.00 -0.61 0.76 -0.83 0.98 0.00 0.00 173.24 173.54 2c1e s GLY 177 N -2.16 0.22 0.02 7.32 0.00 -1.26 -5.05 107.32 106.40 2c1e s GLY 177 Ca -0.04 -0.60 0.26 0.00 0.00 0.00 0.00 44.72 44.34 2c1e s GLY 177 CO -0.04 -0.24 1.57 3.33 0.00 0.00 0.00 173.10 177.71 2c1e n VAL 178 N -0.51 0.07 -1.21 1.40 0.24 -1.26 -4.28 118.33 112.78 2c1e n VAL 178 Ca -0.07 -0.05 0.09 0.00 -2.04 0.00 0.00 64.34 62.28 2c1e n VAL 178 Cb 0.60 -0.05 0.15 0.00 -1.47 0.00 0.00 33.84 33.07 2c1e n VAL 178 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2c1e n ASP 179 N -1.61 2.15 -4.18 -1.34 5.68 -1.26 -5.06 116.55 110.93 2c1e n ASP 179 Ca 0.06 -3.21 -0.11 0.00 -0.50 0.00 0.00 54.79 51.02 2c1e n ASP 179 Cb 0.35 -0.44 -0.10 0.00 -1.14 0.00 0.00 41.12 39.79 2c1e n ASP 179 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 2c1e s ASP 180 N -2.89 0.74 -1.21 -1.12 -4.77 -1.26 -4.93 116.67 101.23 2c1e s ASP 180 Ca 0.32 -1.17 -0.09 0.00 -3.30 0.00 0.00 52.55 48.32 2c1e s ASP 180 Cb 0.29 0.20 -0.01 0.00 -1.09 0.00 0.00 42.92 42.31 2c1e s ASP 180 CO 0.01 -0.64 0.75 -0.67 0.70 0.00 0.00 175.17 175.32 2c1e n ASP 181 N -0.13 -3.57 -4.77 2.11 2.03 -1.26 -4.89 116.55 106.07 2c1e n ASP 181 Ca -0.07 -0.89 -0.37 0.00 0.52 0.00 0.00 54.79 53.97 2c1e n ASP 181 Cb 0.63 -3.90 -0.01 0.00 -0.72 0.00 0.00 41.12 37.12 2c1e n ASP 181 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2c1e s MET 182 N -5.77 3.79 0.15 -0.67 -1.94 -1.26 -4.94 119.30 108.66 2c1e s MET 182 Ca 0.26 1.78 -0.13 0.00 -1.71 0.00 0.00 55.69 55.89 2c1e s MET 182 Cb -0.08 -2.44 0.03 0.00 2.01 0.00 0.00 34.83 34.35 2c1e s MET 182 CO 0.83 -0.52 1.65 0.00 -0.01 0.00 0.00 175.02 176.96 2c1e h ALA 183 N 2.12 0.67 -2.46 3.03 0.00 -2.05 -3.39 119.26 117.18 2c1e h ALA 183 Ca -0.49 -0.22 -0.68 0.00 0.00 0.00 0.00 54.91 53.51 2c1e h ALA 183 Cb 1.25 -0.19 -0.18 0.00 0.00 0.00 0.00 17.79 18.67 2c1e h ALA 183 CO 0.60 0.38 -0.23 0.00 0.00 0.00 0.00 179.25 180.01 2c1e s HIS 185 N 2.11 3.30 0.06 0.00 0.09 -1.26 -5.03 115.29 114.56 2c1e s HIS 185 Ca 0.12 1.07 0.00 0.00 -0.00 0.00 0.00 55.06 56.26 2c1e s HIS 185 Cb -0.17 -3.59 -0.04 0.00 -0.00 0.00 0.00 32.58 28.79 2c1e s HIS 185 CO 0.13 -1.99 -0.05 0.15 -0.00 0.00 0.00 174.74 172.98 2c1e s LYS 186 N 1.13 0.65 0.19 1.40 1.02 -1.26 -5.17 119.74 117.69 2c1e s LYS 186 Ca 0.62 -1.16 0.07 0.00 0.02 0.00 0.00 55.97 55.53 2c1e s LYS 186 Cb -0.34 0.02 -0.05 0.00 -0.52 0.00 0.00 37.83 36.95 2c1e s LYS 186 CO 0.30 -0.06 -0.13 0.96 -0.92 0.00 0.00 175.35 175.49 2c1e s ILE 187 N -3.36 1.58 0.48 2.17 -4.36 -1.26 -5.12 121.20 111.33 2c1e s ILE 187 Ca 0.05 -2.17 -0.23 0.00 -0.26 0.00 0.00 60.65 58.03 2c1e s ILE 187 Cb 0.04 -1.99 -0.07 0.00 1.25 0.00 0.00 42.46 41.69 2c1e s ILE 187 CO -0.06 -0.64 1.28 -2.84 0.24 0.00 0.00 174.94 172.91 2c1e s PRO 188 N -3.67 3.57 0.31 0.37 0.02 -1.26 -4.89 135.00 129.44 2c1e s PRO 188 Ca 0.21 2.05 0.26 0.00 0.02 0.00 0.00 61.00 63.54 2c1e s PRO 188 Cb 0.00 -2.43 1.01 0.00 0.02 0.00 0.00 34.50 33.09 2c1e s PRO 188 CO 0.05 -0.79 1.76 -0.39 -0.33 0.00 0.00 177.00 177.31 2c1e h VAL 189 N 1.85 0.00 -0.03 3.83 -1.51 -2.04 -2.31 116.25 116.04 2c1e h VAL 189 Ca -0.50 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 2c1e h VAL 189 Cb 1.27 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 2c1e h VAL 189 CO 0.60 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 176.32 2c1e n GLU 190 N -2.41 2.00 -1.79 5.19 -0.58 -1.26 -4.96 120.64 116.83 2c1e n GLU 190 Ca 0.02 -1.45 -0.32 0.00 -0.42 0.00 0.00 57.16 54.99 2c1e n GLU 190 Cb 0.28 -1.47 0.03 0.00 -0.57 0.00 0.00 31.44 29.71 2c1e n GLU 190 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2c1e s ALA 191 N -2.00 2.72 -0.90 0.62 0.00 -0.87 -4.08 121.76 117.25 2c1e s ALA 191 Ca 0.33 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.50 2c1e s ALA 191 Cb 0.20 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 20.13 2c1e s ALA 191 CO 0.32 -1.02 0.00 -0.25 0.00 0.00 0.00 175.76 174.81 2c1e n ASP 192 N -2.62 -3.50 -4.60 0.00 8.00 0.12 -5.00 116.55 108.94 2c1e n ASP 192 Ca 0.08 0.01 -0.31 0.00 0.71 0.00 0.00 54.79 55.28 2c1e n ASP 192 Cb 0.53 -2.68 -0.10 0.00 -0.02 0.00 0.00 41.12 38.85 2c1e n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2c1e s PHE 193 N -2.50 2.86 -0.04 1.24 0.08 -1.23 -4.85 117.98 113.54 2c1e s PHE 193 Ca 0.00 -0.07 -0.00 0.00 0.12 0.00 0.00 56.93 56.98 2c1e s PHE 193 Cb 0.00 -1.55 0.03 0.00 -0.57 0.00 0.00 43.02 40.92 2c1e s PHE 193 CO 0.00 0.40 0.00 -1.17 -0.10 0.00 0.00 175.22 174.35 2c1e s LEU 194 N -1.74 0.92 -0.25 -0.37 1.98 -1.26 -0.91 118.68 117.05 2c1e s LEU 194 Ca 0.19 -0.04 -0.03 0.00 -2.89 0.00 0.00 54.13 51.36 2c1e s LEU 194 Cb -0.11 -0.30 0.02 0.00 0.66 0.00 0.00 46.19 46.46 2c1e s LEU 194 CO 0.11 -0.13 -0.03 -0.31 -1.89 0.00 0.00 176.35 174.09 2c1e s TYR 195 N 1.38 3.07 -0.67 5.38 1.51 0.51 -5.01 117.35 123.50 2c1e s TYR 195 Ca -0.05 -1.37 -0.14 0.00 -1.01 0.00 0.00 57.07 54.50 2c1e s TYR 195 Cb -0.13 -2.10 0.17 0.00 -0.11 0.00 0.00 41.96 39.79 2c1e s TYR 195 CO -0.02 -0.68 0.61 0.00 -1.11 0.00 0.00 175.55 174.35 2c1e s ALA 196 N 1.38 3.83 0.22 3.71 0.00 -1.26 -0.85 121.76 128.78 2c1e s ALA 196 Ca 0.01 -2.95 -0.23 0.00 0.00 0.00 0.00 51.96 48.79 2c1e s ALA 196 Cb -0.16 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.55 2c1e s ALA 196 CO -0.03 -2.14 0.79 0.71 0.00 0.00 0.00 175.76 175.09 2c1e s TYR 197 N 0.82 3.77 -0.00 0.00 2.02 -0.49 -4.97 117.35 118.49 2c1e s TYR 197 Ca 0.11 1.57 0.25 0.00 -0.37 0.00 0.00 57.07 58.63 2c1e s TYR 197 Cb -0.20 -2.74 0.84 0.00 -0.40 0.00 0.00 41.96 39.46 2c1e s TYR 197 CO -0.03 0.39 1.79 0.66 -1.57 0.00 0.00 175.55 176.79 2c1e h SER 198 N 3.77 0.00 -5.34 2.29 4.64 -1.93 -0.49 113.55 116.49 2c1e h SER 198 Ca -0.47 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.72 2c1e h SER 198 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.16 2c1e h SER 198 CO 0.66 0.16 -0.36 0.28 -0.87 0.00 0.00 176.83 176.70 2c1e s THR 199 N -3.50 0.04 0.66 2.95 -1.32 -1.26 -3.54 115.64 109.67 2c1e s THR 199 Ca 0.02 -1.56 -0.15 0.00 -1.21 0.00 0.00 61.69 58.79 2c1e s THR 199 Cb 0.09 -2.08 -0.00 0.00 -1.51 0.00 0.00 72.50 69.00 2c1e s THR 199 CO 0.63 -0.18 1.12 0.00 -2.21 0.00 0.00 174.62 173.98 2c1e s ALA 200 N -4.03 2.45 0.19 11.08 0.00 -0.85 -4.08 121.76 126.54 2c1e s ALA 200 Ca 0.23 0.60 -0.33 0.00 0.00 0.00 0.00 51.96 52.46 2c1e s ALA 200 Cb 0.03 -3.33 -0.13 0.00 0.00 0.00 0.00 23.12 19.69 2c1e s ALA 200 CO 0.05 -1.29 1.55 -2.30 0.00 0.00 0.00 175.76 173.76 2c1e n PRO 201 N -2.36 2.21 -0.62 0.00 -0.02 -1.26 -1.91 135.00 131.03 2c1e n PRO 201 Ca 0.11 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 2c1e n PRO 201 Cb 0.52 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 2c1e n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c1e n GLY 202 N 3.05 1.06 3.78 -1.23 0.00 -1.26 -5.05 105.19 105.55 2c1e n GLY 202 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 2c1e n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c1e s TYR 203 N -3.35 3.05 0.78 1.61 1.51 -0.80 -5.11 117.35 115.04 2c1e s TYR 203 Ca 0.00 -0.10 -0.11 0.00 -1.01 0.00 0.00 57.07 55.85 2c1e s TYR 203 Cb 0.00 -1.41 0.06 0.00 -0.11 0.00 0.00 41.96 40.50 2c1e s TYR 203 CO 0.00 0.53 1.09 0.71 -1.11 0.00 0.00 175.55 176.77 2c1e s TYR 204 N -2.00 2.63 -0.05 2.71 1.51 -1.26 -4.82 117.35 116.06 2c1e s TYR 204 Ca 0.32 1.47 0.06 0.00 -1.01 0.00 0.00 57.07 57.90 2c1e s TYR 204 Cb -0.08 -3.04 -0.01 0.00 -0.11 0.00 0.00 41.96 38.71 2c1e s TYR 204 CO 0.23 -1.81 -0.22 0.45 -1.11 0.00 0.00 175.55 173.10 2c1e s SER 205 N -3.49 2.68 0.01 2.29 0.15 -1.26 -4.84 113.70 109.24 2c1e s SER 205 Ca 0.61 -0.44 -0.07 0.00 0.70 0.00 0.00 55.95 56.74 2c1e s SER 205 Cb -0.17 -0.69 -0.05 0.00 -1.71 0.00 0.00 66.02 63.40 2c1e s SER 205 CO 0.56 0.21 0.28 0.26 1.20 0.00 0.00 173.24 175.76 2c1e s TRP 206 N -0.13 3.59 -0.02 3.44 0.52 -1.26 -5.10 118.94 119.98 2c1e s TRP 206 Ca -0.02 0.62 0.00 0.00 0.02 0.00 0.00 56.10 56.72 2c1e s TRP 206 Cb -0.12 -2.02 0.03 0.00 -1.15 0.00 0.00 33.47 30.20 2c1e s TRP 206 CO 0.03 0.61 0.03 0.50 0.02 0.00 0.00 176.95 178.14 2c1e s ARG 207 N -1.68 -0.00 -0.20 4.98 3.52 -1.26 -2.74 118.95 121.56 2c1e s ARG 207 Ca 0.27 0.17 -0.25 0.00 -0.13 0.00 0.00 55.73 55.79 2c1e s ARG 207 Cb -0.13 -0.26 -0.01 0.00 -1.56 0.00 0.00 34.95 32.98 2c1e s ARG 207 CO 0.15 -0.16 0.81 1.21 -0.81 0.00 0.00 175.30 176.51 2c1e s ASN 208 N 1.02 6.88 0.67 -2.12 3.84 -0.02 -4.89 114.94 120.32 2c1e s ASN 208 Ca -0.09 1.09 0.29 0.00 0.21 0.00 0.00 52.86 54.36 2c1e s ASN 208 Cb -0.12 -2.44 1.58 0.00 -0.55 0.00 0.00 41.25 39.72 2c1e s ASN 208 CO -0.03 -0.44 1.89 0.77 -2.79 0.00 0.00 177.10 176.51 2c1e h SER 209 N 7.49 0.00 0.00 -4.21 4.64 -2.00 -0.31 113.55 119.16 2c1e h SER 209 Ca -0.27 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.81 2c1e h SER 209 Cb 1.12 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.17 2c1e h SER 209 CO 0.85 0.00 -1.86 1.17 -0.87 0.00 0.00 176.83 176.12 2c1e n LYS 210 N -2.89 0.35 0.01 4.77 4.81 -1.26 -4.75 118.16 119.20 2c1e n LYS 210 Ca -0.02 0.12 0.12 0.00 -0.87 0.00 0.00 58.31 57.66 2c1e n LYS 210 Cb 0.40 -1.17 0.21 0.00 0.02 0.00 0.00 35.03 34.49 2c1e n LYS 210 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2c1e n ASP 211 N -3.35 0.55 0.00 3.14 8.00 -1.16 -5.08 116.55 118.66 2c1e n ASP 211 Ca -0.29 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.00 2c1e n ASP 211 Cb 0.75 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 42.15 2c1e n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c1e n GLY 212 N 1.46 -3.70 3.77 0.44 0.00 -0.14 -4.89 105.19 102.13 2c1e n GLY 212 Ca 0.05 -2.14 -0.37 0.00 0.00 0.00 0.00 46.02 43.56 2c1e n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c1e s SER 213 N -0.32 6.19 0.22 1.61 1.04 -1.26 -0.84 113.70 120.33 2c1e s SER 213 Ca 0.00 2.30 -0.09 0.00 0.48 0.00 0.00 55.95 58.64 2c1e s SER 213 Cb 0.00 -2.60 0.20 0.00 0.10 0.00 0.00 66.02 63.72 2c1e s SER 213 CO 0.00 -0.91 1.87 -0.50 0.98 0.00 0.00 173.24 174.69 2c1e h TRP 214 N 2.06 0.95 0.32 5.02 6.55 -1.89 -1.35 115.95 127.61 2c1e h TRP 214 Ca -0.49 0.02 -0.02 0.00 0.95 0.00 0.00 58.89 59.36 2c1e h TRP 214 Cb 1.25 -0.32 0.00 0.00 -0.86 0.00 0.00 29.16 29.23 2c1e h TRP 214 CO 0.53 0.57 -0.16 0.35 -1.05 0.00 0.00 178.44 178.69 2c1e h PHE 215 N 1.00 -0.40 -0.69 0.49 3.57 -1.89 -1.68 116.94 117.35 2c1e h PHE 215 Ca 0.30 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.72 2c1e h PHE 215 Cb -0.05 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 2c1e h PHE 215 CO -0.03 -0.16 0.15 0.82 -2.23 0.00 0.00 178.31 176.87 2c1e h ILE 216 N -0.58 1.26 -0.06 1.41 1.08 -1.94 0.22 117.51 118.91 2c1e h ILE 216 Ca -0.04 -0.97 0.03 0.00 -0.39 0.00 0.00 64.86 63.49 2c1e h ILE 216 Cb 0.42 0.57 -0.04 0.00 -3.07 0.00 0.00 36.82 34.70 2c1e h ILE 216 CO 0.07 0.37 -0.18 1.56 -0.69 0.00 0.00 178.15 179.28 2c1e h GLN 217 N 1.04 -0.26 -0.63 2.37 4.20 -1.22 -1.14 115.11 119.47 2c1e h GLN 217 Ca 0.21 0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.85 2c1e h GLN 217 Cb 0.38 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 2c1e h GLN 217 CO 0.00 -0.17 0.02 0.77 -0.67 0.00 0.00 178.83 178.79 2c1e h SER 218 N -0.27 1.07 -0.18 1.46 0.02 -1.02 -2.22 113.55 112.41 2c1e h SER 218 Ca 0.07 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2c1e h SER 218 Cb 0.37 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2c1e h SER 218 CO -0.21 1.10 0.10 0.25 -1.14 0.00 0.00 176.83 176.93 2c1e h LEU 219 N 1.00 0.23 -0.72 5.07 5.85 -0.29 -1.15 115.31 125.30 2c1e h LEU 219 Ca 0.18 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2c1e h LEU 219 Cb 0.54 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 2c1e h LEU 219 CO 0.03 0.25 0.33 0.00 -0.34 0.00 0.00 178.44 178.71 2c1e h ALA 221 N 1.16 0.53 -0.21 0.00 0.00 -1.18 -0.04 119.26 119.53 2c1e h ALA 221 Ca 0.24 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 2c1e h ALA 221 Cb 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2c1e h ALA 221 CO -0.03 0.02 -0.42 0.52 0.00 0.00 0.00 179.25 179.34 2c1e h MET 222 N 0.55 0.49 -0.31 0.00 2.07 -1.00 -2.02 114.93 114.70 2c1e h MET 222 Ca 0.15 -0.25 -0.07 0.00 -2.07 0.00 0.00 59.70 57.46 2c1e h MET 222 Cb 0.00 0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 29.73 2c1e h MET 222 CO -0.03 0.83 -0.07 -0.07 1.07 0.00 0.00 176.91 178.63 2c1e h LEU 223 N 0.40 0.61 -1.36 1.22 3.38 -0.90 0.24 115.31 118.90 2c1e h LEU 223 Ca 0.03 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 2c1e h LEU 223 Cb 0.91 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2c1e h LEU 223 CO 0.08 0.83 0.34 0.11 0.09 0.00 0.00 178.44 179.89 2c1e h LYS 224 N 0.38 0.77 0.00 1.13 1.57 -0.88 -0.33 116.57 119.22 2c1e h LYS 224 Ca 0.08 -0.06 -0.27 0.00 -1.87 0.00 0.00 60.65 58.52 2c1e h LYS 224 Cb 0.56 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 2c1e h LYS 224 CO 0.03 0.55 -1.54 0.37 -0.57 0.00 0.00 179.45 178.29 2c1e h GLN 225 N 0.79 0.00 0.00 3.15 4.15 -1.18 -3.42 115.11 118.60 2c1e h GLN 225 Ca 0.21 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.62 2c1e h GLN 225 Cb -0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.67 2c1e h GLN 225 CO -0.04 0.63 0.00 0.66 -1.93 0.00 0.00 178.83 178.15 2c1e n TYR 226 N -3.13 0.00 0.20 3.99 4.01 0.82 -4.76 117.16 118.30 2c1e n TYR 226 Ca -0.13 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 57.78 2c1e n TYR 226 Cb 1.02 0.00 0.83 0.00 -0.31 0.00 0.00 39.34 40.88 2c1e n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2c1e h ALA 227 N 0.00 1.80 -0.51 -0.72 0.00 -1.18 0.17 119.26 118.83 2c1e h ALA 227 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c1e h ALA 227 Cb 0.03 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2c1e h ALA 227 CO 0.00 -0.30 0.00 -0.40 0.00 0.00 0.00 179.25 178.55 2c1e n ASP 228 N -3.79 4.99 0.00 0.00 5.75 -1.26 -4.24 116.55 118.00 2c1e n ASP 228 Ca 0.02 -2.80 0.00 0.00 -0.01 0.00 0.00 54.79 51.99 2c1e n ASP 228 Cb 0.33 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 39.81 2c1e n ASP 228 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2c1e n LYS 229 N 0.48 0.44 -4.39 0.11 5.02 0.35 -5.03 118.16 115.14 2c1e n LYS 229 Ca 0.25 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.31 2c1e n LYS 229 Cb 1.03 -0.57 -0.11 0.00 -0.02 0.00 0.00 35.03 35.36 2c1e n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2c1e s LEU 230 N -1.88 2.47 0.51 -0.35 1.43 0.23 -5.12 118.68 115.97 2c1e s LEU 230 Ca 0.00 -0.91 -0.21 0.00 -1.03 0.00 0.00 54.13 51.98 2c1e s LEU 230 Cb 0.00 -0.97 -0.07 0.00 0.03 0.00 0.00 46.19 45.18 2c1e s LEU 230 CO 0.00 0.02 1.14 -0.70 0.23 0.00 0.00 176.35 177.04 2c1e s GLU 231 N -2.95 3.53 0.26 1.70 -6.30 -1.26 -4.76 118.70 108.92 2c1e s GLU 231 Ca 0.20 1.67 -0.01 0.00 -2.50 0.00 0.00 54.97 54.33 2c1e s GLU 231 Cb -0.06 -2.17 0.55 0.00 0.00 0.00 0.00 34.13 32.45 2c1e s GLU 231 CO 0.09 -0.72 1.74 0.35 0.02 0.00 0.00 175.26 176.74 2c1e h PHE 232 N 1.55 0.64 -0.49 5.30 3.57 -1.23 -1.32 116.94 124.97 2c1e h PHE 232 Ca -0.50 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.00 2c1e h PHE 232 Cb 1.26 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 2c1e h PHE 232 CO 0.52 0.09 0.15 0.52 -2.23 0.00 0.00 178.31 177.36 2c1e h MET 233 N 0.51 0.72 -0.05 1.11 2.86 -1.92 -0.23 114.93 117.93 2c1e h MET 233 Ca 0.47 -0.12 -0.13 0.00 -2.06 0.00 0.00 59.70 57.85 2c1e h MET 233 Cb 0.73 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 2c1e h MET 233 CO -0.41 0.63 -0.56 0.45 1.06 0.00 0.00 176.91 178.07 2c1e h HIS 234 N 0.70 0.18 -0.23 -0.22 3.86 -1.64 -0.75 115.15 117.04 2c1e h HIS 234 Ca 0.16 -0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.25 2c1e h HIS 234 Cb 0.22 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 2c1e h HIS 234 CO 0.01 0.67 -0.08 0.82 0.86 0.00 0.00 177.93 180.21 2c1e h ILE 235 N 0.11 1.29 0.00 2.45 2.04 -0.58 -2.33 117.51 120.49 2c1e h ILE 235 Ca -0.00 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 64.69 2c1e h ILE 235 Cb 1.03 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 2c1e h ILE 235 CO 0.08 0.35 -0.22 -0.07 0.00 0.00 0.00 178.15 178.29 2c1e h LEU 236 N 0.20 0.00 -0.65 1.44 3.38 -0.85 -1.55 115.31 117.27 2c1e h LEU 236 Ca 0.06 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 2c1e h LEU 236 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2c1e h LEU 236 CO 0.03 0.22 -0.46 0.74 0.09 0.00 0.00 178.44 179.06 2c1e h THR 237 N 0.00 1.31 -0.24 0.22 2.02 -0.88 -0.40 112.91 114.95 2c1e h THR 237 Ca -0.00 -1.66 -0.10 0.00 0.77 0.00 0.00 66.41 65.42 2c1e h THR 237 Cb 0.43 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 2c1e h THR 237 CO 0.03 0.52 -0.27 0.03 0.37 0.00 0.00 175.52 176.19 2c1e h ARG 238 N 0.41 0.46 -0.41 6.66 2.47 -0.76 -1.65 114.38 121.56 2c1e h ARG 238 Ca 0.03 -0.18 -0.06 0.00 -1.26 0.00 0.00 59.98 58.51 2c1e h ARG 238 Cb 0.96 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 29.24 2c1e h ARG 238 CO 0.09 0.70 0.03 0.28 0.56 0.00 0.00 179.97 181.63 2c1e h VAL 239 N 0.41 1.25 -0.36 2.04 2.07 -0.86 -0.58 116.25 120.22 2c1e h VAL 239 Ca 0.06 -0.95 0.06 0.00 0.82 0.00 0.00 66.70 66.68 2c1e h VAL 239 Cb 0.69 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 2c1e h VAL 239 CO 0.05 0.33 0.06 0.78 0.02 0.00 0.00 177.57 178.81 2c1e h ASN 240 N 0.55 -0.02 -0.67 0.57 4.21 -0.67 -1.46 115.58 118.09 2c1e h ASN 240 Ca 0.12 0.06 -0.07 0.00 1.21 0.00 0.00 56.30 57.62 2c1e h ASN 240 Cb 0.43 0.09 -0.03 0.00 -1.12 0.00 0.00 38.32 37.69 2c1e h ASN 240 CO 0.01 0.03 0.15 -0.09 -1.29 0.00 0.00 177.43 176.24 2c1e h ARG 241 N 0.17 1.09 -0.12 0.81 2.43 -1.07 -1.33 114.38 116.36 2c1e h ARG 241 Ca 0.17 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2c1e h ARG 241 Cb 0.20 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2c1e h ARG 241 CO -0.24 0.98 0.06 -0.22 -1.51 0.00 0.00 179.97 179.04 2c1e h LYS 242 N 1.01 0.18 -0.32 0.20 3.64 -0.68 -1.40 116.57 119.20 2c1e h LYS 242 Ca 0.21 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2c1e h LYS 242 Cb 0.39 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2c1e h LYS 242 CO 0.01 0.23 0.05 0.28 -2.27 0.00 0.00 179.45 177.75 2c1e h VAL 243 N 0.08 1.24 -0.77 2.00 2.07 -1.24 -1.39 116.25 118.24 2c1e h VAL 243 Ca 0.04 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2c1e h VAL 243 Cb 0.11 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 2c1e h VAL 243 CO -0.01 0.27 0.42 0.00 0.02 0.00 0.00 177.57 178.28 2c1e h ALA 244 N 0.89 1.30 0.09 1.67 0.00 -1.16 -3.10 119.26 118.95 2c1e h ALA 244 Ca 0.10 -0.11 -0.37 0.00 0.00 0.00 0.00 54.91 54.52 2c1e h ALA 244 Cb 0.36 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2c1e h ALA 244 CO 0.01 0.57 -2.14 0.25 0.00 0.00 0.00 179.25 177.94 2c1e n THR 245 N -4.36 1.70 0.10 0.00 -2.24 -0.54 -4.61 114.28 104.34 2c1e n THR 245 Ca 0.08 -0.63 0.01 0.00 -2.27 0.00 0.00 64.05 61.25 2c1e n THR 245 Cb 0.10 -1.65 -0.02 0.00 -2.10 0.00 0.00 70.33 66.66 2c1e n THR 245 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2c1e h GLU 246 N 0.04 0.00 -5.97 -0.78 5.08 -1.36 -3.47 114.58 108.12 2c1e h GLU 246 Ca -0.47 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.22 2c1e h GLU 246 Cb 1.99 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 31.12 2c1e h GLU 246 CO 0.03 0.45 -0.59 -0.06 -1.00 0.00 0.00 179.01 177.85 2c1e s PHE 247 N -2.94 3.24 -0.19 4.33 0.08 -1.17 -5.08 117.98 116.25 2c1e s PHE 247 Ca 0.02 0.22 -0.10 0.00 0.12 0.00 0.00 56.93 57.19 2c1e s PHE 247 Cb 0.08 -1.77 0.07 0.00 -0.57 0.00 0.00 43.02 40.82 2c1e s PHE 247 CO 0.77 0.53 0.45 -2.00 -0.10 0.00 0.00 175.22 174.87 2c1e s GLU 248 N -1.29 0.43 0.74 0.44 2.12 -1.26 -4.66 118.70 115.22 2c1e s GLU 248 Ca 0.18 0.88 -0.14 0.00 0.36 0.00 0.00 54.97 56.24 2c1e s GLU 248 Cb -0.12 0.04 0.04 0.00 0.26 0.00 0.00 34.13 34.36 2c1e s GLU 248 CO 0.08 -0.17 1.18 -1.54 -0.54 0.00 0.00 175.26 174.27 2c1e s SER 249 N 1.57 4.26 -0.08 -1.70 1.04 -0.10 -4.84 113.70 113.85 2c1e s SER 249 Ca -0.09 2.25 0.01 0.00 0.48 0.00 0.00 55.95 58.60 2c1e s SER 249 Cb -0.08 -2.58 0.02 0.00 0.10 0.00 0.00 66.02 63.48 2c1e s SER 249 CO -0.14 -2.21 -0.10 0.12 0.98 0.00 0.00 173.24 171.89 2c1e s PHE 250 N -2.16 1.41 -0.16 5.02 5.36 -1.26 -1.45 117.98 124.75 2c1e s PHE 250 Ca 0.72 -0.59 -0.18 0.00 -0.96 0.00 0.00 56.93 55.92 2c1e s PHE 250 Cb -0.26 -1.10 0.05 0.00 -0.34 0.00 0.00 43.02 41.36 2c1e s PHE 250 CO 0.46 -0.36 0.49 0.45 -1.46 0.00 0.00 175.22 174.79 2c1e s SER 251 N 1.09 -0.49 0.45 6.13 0.15 -1.26 -4.92 113.70 114.85 2c1e s SER 251 Ca -0.07 0.88 0.30 0.00 0.70 0.00 0.00 55.95 57.76 2c1e s SER 251 Cb -0.14 0.90 1.21 0.00 -1.71 0.00 0.00 66.02 66.27 2c1e s SER 251 CO -0.01 -0.23 1.89 -0.26 1.20 0.00 0.00 173.24 175.83 2c1e h PHE 252 N 5.06 0.00 -3.58 3.44 0.05 -2.00 -3.40 116.94 116.50 2c1e h PHE 252 Ca -0.28 0.00 -0.64 0.00 3.82 0.00 0.00 57.97 60.87 2c1e h PHE 252 Cb 1.17 0.00 -0.14 0.00 2.00 0.00 0.00 35.95 38.98 2c1e h PHE 252 CO 0.41 0.00 0.14 0.34 -0.18 0.00 0.00 178.31 179.02 2c1e s ASP 253 N -5.25 6.37 0.48 2.17 -1.08 -1.26 -4.93 116.67 113.16 2c1e s ASP 253 Ca 0.02 -0.11 0.26 0.00 -0.52 0.00 0.00 52.55 52.20 2c1e s ASP 253 Cb 0.09 -2.33 1.31 0.00 -1.46 0.00 0.00 42.92 40.53 2c1e s ASP 253 CO 0.50 -0.70 1.86 0.00 0.52 0.00 0.00 175.17 177.35 2c1e h ALA 254 N 8.70 2.58 -0.73 3.66 0.00 -1.95 -0.74 119.26 130.78 2c1e h ALA 254 Ca -0.26 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.68 2c1e h ALA 254 Cb 1.10 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2c1e h ALA 254 CO 0.87 -0.87 0.48 1.15 0.00 0.00 0.00 179.25 180.88 2c1e h THR 255 N 0.18 1.13 -0.45 0.00 2.02 -1.93 -2.74 112.91 111.13 2c1e h THR 255 Ca 0.47 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 67.34 2c1e h THR 255 Cb 1.55 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2c1e h THR 255 CO -0.10 0.17 0.00 0.49 0.37 0.00 0.00 175.52 176.44 2c1e n PHE 256 N -4.45 0.59 -3.30 3.16 3.01 -0.33 -5.00 117.46 111.14 2c1e n PHE 256 Ca 0.09 -0.40 -0.34 0.00 1.01 0.00 0.00 57.45 57.81 2c1e n PHE 256 Cb 0.10 -0.01 -0.06 0.00 -0.01 0.00 0.00 39.48 39.51 2c1e n PHE 256 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2c1e s HIS 257 N -1.09 3.51 -1.45 1.38 2.46 -0.94 -4.35 115.29 114.81 2c1e s HIS 257 Ca 0.34 1.07 -0.08 0.00 0.47 0.00 0.00 55.06 56.86 2c1e s HIS 257 Cb 0.18 -2.40 0.02 0.00 -0.13 0.00 0.00 32.58 30.26 2c1e s HIS 257 CO 0.24 0.31 0.93 0.00 -2.47 0.00 0.00 174.74 173.75 2c1e n ALA 258 N 0.28 -1.18 -2.80 1.58 0.00 -0.53 -4.96 120.51 112.91 2c1e n ALA 258 Ca -0.01 0.33 -0.26 0.00 0.00 0.00 0.00 53.44 53.50 2c1e n ALA 258 Cb 0.52 -4.72 -0.03 0.00 0.00 0.00 0.00 19.45 15.22 2c1e n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2c1e s LYS 259 N -6.12 3.49 0.42 0.00 -0.14 -1.26 -4.75 119.74 111.38 2c1e s LYS 259 Ca 0.49 -0.43 0.07 0.00 -1.36 0.00 0.00 55.97 54.73 2c1e s LYS 259 Cb -0.22 -2.83 -0.05 0.00 -1.68 0.00 0.00 37.83 33.05 2c1e s LYS 259 CO 0.60 0.37 0.17 0.15 -0.76 0.00 0.00 175.35 175.89 2c1e s LYS 260 N -3.60 2.20 -0.12 1.68 -0.14 -1.26 -0.93 119.74 117.58 2c1e s LYS 260 Ca 0.38 -1.89 -0.12 0.00 -1.36 0.00 0.00 55.97 52.97 2c1e s LYS 260 Cb -0.10 -1.94 0.03 0.00 -1.68 0.00 0.00 37.83 34.14 2c1e s LYS 260 CO 0.30 -0.14 0.35 -1.14 -0.76 0.00 0.00 175.35 173.96 2c1e s GLN 261 N -3.90 0.43 -0.15 1.68 0.74 -1.26 -5.02 119.66 112.18 2c1e s GLN 261 Ca 0.39 0.45 -0.01 0.00 0.05 0.00 0.00 55.36 56.24 2c1e s GLN 261 Cb 0.04 0.21 0.04 0.00 1.10 0.00 0.00 33.01 34.39 2c1e s GLN 261 CO 0.22 -0.06 -0.05 -1.50 -0.55 0.00 0.00 175.29 173.35 2c1e s ILE 262 N 0.09 0.97 1.07 -2.34 1.10 -1.26 -3.44 121.20 117.38 2c1e s ILE 262 Ca -0.01 -0.46 -0.12 0.00 -0.51 0.00 0.00 60.65 59.55 2c1e s ILE 262 Cb -0.03 -1.13 0.23 0.00 0.15 0.00 0.00 42.46 41.69 2c1e s ILE 262 CO 0.01 0.17 1.08 -2.84 -2.11 0.00 0.00 174.94 171.25 2c1e s PRO 263 N 1.70 -0.17 -0.18 3.50 0.02 -1.23 -2.01 135.00 136.63 2c1e s PRO 263 Ca 0.02 1.18 -0.02 0.00 0.02 0.00 0.00 61.00 62.20 2c1e s PRO 263 Cb -0.14 -1.62 0.06 0.00 0.02 0.00 0.00 34.50 32.82 2c1e s PRO 263 CO -0.08 -3.32 0.02 0.00 -0.33 0.00 0.00 177.00 173.29 2c1e s ILE 265 N 1.83 4.92 -0.34 0.00 1.01 -1.26 -1.40 121.20 125.97 2c1e s ILE 265 Ca -0.01 1.33 0.02 0.00 0.00 0.00 0.00 60.65 61.99 2c1e s ILE 265 Cb -0.17 -4.02 0.09 0.00 0.01 0.00 0.00 42.46 38.38 2c1e s ILE 265 CO -0.08 -0.01 0.05 -0.69 0.00 0.00 0.00 174.94 174.22 2c1e s VAL 266 N 2.59 2.55 -0.20 2.92 1.01 -0.03 -5.02 120.40 124.22 2c1e s VAL 266 Ca 0.30 -2.07 -0.04 0.00 0.00 0.00 0.00 61.98 60.18 2c1e s VAL 266 Cb -0.15 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 2c1e s VAL 266 CO 0.08 -0.47 -0.03 -0.55 0.00 0.00 0.00 175.10 174.13 2c1e s SER 267 N 1.17 4.54 -0.20 3.32 0.15 -1.26 -0.37 113.70 121.05 2c1e s SER 267 Ca 0.05 -0.29 0.12 0.00 0.70 0.00 0.00 55.95 56.54 2c1e s SER 267 Cb -0.20 -1.77 0.40 0.00 -1.71 0.00 0.00 66.02 62.74 2c1e s SER 267 CO -0.06 0.04 1.21 0.23 1.20 0.00 0.00 173.24 175.87 2c1e n MET 268 N 4.37 1.55 -2.06 5.44 2.81 -0.08 -5.03 117.12 124.11 2c1e n MET 268 Ca -0.18 -3.19 -0.32 0.00 -1.81 0.00 0.00 57.70 52.20 2c1e n MET 268 Cb 0.52 -1.60 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 2c1e n MET 268 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2c1e s LEU 269 N -3.18 3.43 0.00 4.03 1.43 -1.16 -0.71 118.68 122.52 2c1e s LEU 269 Ca 0.37 1.61 0.06 0.00 -1.03 0.00 0.00 54.13 55.14 2c1e s LEU 269 Cb 0.36 -4.50 0.04 0.00 0.03 0.00 0.00 46.19 42.11 2c1e s LEU 269 CO -0.05 -0.94 0.65 0.35 0.23 0.00 0.00 176.35 176.58 2c1e n THR 270 N -2.20 0.00 -4.06 5.49 -2.24 -1.26 -4.82 114.28 105.18 2c1e n THR 270 Ca 0.07 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.26 2c1e n THR 270 Cb 0.54 1.11 -0.07 0.00 -2.10 0.00 0.00 70.33 69.81 2c1e n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2c1e s LYS 271 N -0.63 1.33 0.49 -0.78 1.02 -1.26 -5.14 119.74 114.77 2c1e s LYS 271 Ca 0.07 -1.37 -0.19 0.00 0.02 0.00 0.00 55.97 54.49 2c1e s LYS 271 Cb 0.05 0.38 -0.08 0.00 -0.52 0.00 0.00 37.83 37.65 2c1e s LYS 271 CO 0.09 -0.50 1.01 -1.21 -0.92 0.00 0.00 175.35 173.82 2c1e s GLU 272 N -4.06 3.88 -0.14 1.68 2.02 -1.26 -5.04 118.70 115.78 2c1e s GLU 272 Ca 0.27 1.21 0.00 0.00 0.02 0.00 0.00 54.97 56.48 2c1e s GLU 272 Cb 0.03 -2.12 0.02 0.00 0.10 0.00 0.00 34.13 32.17 2c1e s GLU 272 CO 0.08 -0.34 -0.12 -1.17 0.02 0.00 0.00 175.26 173.72 2c1e s LEU 273 N -3.61 1.62 -0.08 1.80 0.20 -1.26 -5.05 118.68 112.30 2c1e s LEU 273 Ca 0.64 -0.48 0.05 0.00 0.69 0.00 0.00 54.13 55.03 2c1e s LEU 273 Cb -0.13 -1.11 -0.00 0.00 -0.43 0.00 0.00 46.19 44.51 2c1e s LEU 273 CO 0.22 -0.08 -0.23 -0.31 -0.29 0.00 0.00 176.35 175.66 2c1e s TYR 274 N 1.53 2.41 -0.69 5.38 2.02 -1.26 -0.54 117.35 126.20 2c1e s TYR 274 Ca 0.05 -0.87 0.23 0.00 -0.37 0.00 0.00 57.07 56.11 2c1e s TYR 274 Cb -0.13 -1.60 0.90 0.00 -0.40 0.00 0.00 41.96 40.73 2c1e s TYR 274 CO -0.10 -0.32 1.72 1.19 -1.57 0.00 0.00 175.55 176.46 2c1e n PHE 275 N 3.30 0.63 -4.09 2.71 3.72 -1.26 -4.78 117.46 117.69 2c1e n PHE 275 Ca -0.19 0.22 -0.24 0.00 -0.05 0.00 0.00 57.45 57.19 2c1e n PHE 275 Cb 0.53 -0.85 -0.07 0.00 -0.94 0.00 0.00 39.48 38.14 2c1e n PHE 275 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 2c1e s TYR 276 N -3.17 2.63 0.00 1.38 -0.85 -1.26 -5.07 117.35 111.01 2c1e s TYR 276 Ca 0.08 -0.52 0.00 0.00 -0.52 0.00 0.00 57.07 56.10 2c1e s TYR 276 Cb 0.11 -1.87 0.00 0.00 0.38 0.00 0.00 41.96 40.58 2c1e s TYR 276 CO 0.45 0.22 0.00 -2.39 -1.52 0.00 0.00 175.55 172.30