#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b4m h ASP 170 N 0.00 0.00 1.03 0.00 5.19 -1.98 -3.20 116.42 117.46 3b4m h ASP 170 Ca 0.00 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 3b4m h ASP 170 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 3b4m h ASP 170 CO 0.00 0.48 -0.26 0.00 -3.12 0.00 0.00 179.24 176.34 3b4m h ALA 171 N 1.52 0.98 -0.59 3.45 0.00 -1.95 -3.15 119.26 119.52 3b4m h ALA 171 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3b4m h ALA 171 Cb 1.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3b4m h ALA 171 CO 0.06 0.32 0.00 0.54 0.00 0.00 0.00 179.25 180.17 3b4m n ARG 172 N -3.37 3.22 -4.61 0.00 1.74 -1.21 -4.88 116.66 107.56 3b4m n ARG 172 Ca 0.00 -2.66 -0.31 0.00 -0.77 0.00 0.00 57.85 54.11 3b4m n ARG 172 Cb 0.47 -1.67 -0.12 0.00 -1.02 0.00 0.00 32.46 30.12 3b4m n ARG 172 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3b4m s SER 173 N -1.04 4.00 0.12 0.55 0.01 -1.19 -0.41 113.70 115.75 3b4m s SER 173 Ca 0.44 -0.35 0.07 0.00 1.31 0.00 0.00 55.95 57.42 3b4m s SER 173 Cb 0.27 -0.73 -0.04 0.00 0.21 0.00 0.00 66.02 65.73 3b4m s SER 173 CO 0.24 0.26 -0.09 0.27 0.41 0.00 0.00 173.24 174.34 3b4m s ILE 174 N -0.94 3.40 0.13 1.44 -4.36 0.64 -1.36 121.20 120.15 3b4m s ILE 174 Ca 0.15 -1.33 -0.21 0.00 -0.26 0.00 0.00 60.65 59.00 3b4m s ILE 174 Cb -0.11 -2.62 -0.07 0.00 1.25 0.00 0.00 42.46 40.91 3b4m s ILE 174 CO 0.06 0.06 0.66 -0.47 0.24 0.00 0.00 174.94 175.49 3b4m s TYR 175 N -1.33 3.81 -0.37 1.37 5.04 0.65 -1.79 117.35 124.73 3b4m s TYR 175 Ca 0.23 1.41 0.02 0.00 -2.44 0.00 0.00 57.07 56.28 3b4m s TYR 175 Cb -0.11 -2.60 0.11 0.00 0.35 0.00 0.00 41.96 39.71 3b4m s TYR 175 CO 0.15 0.52 0.13 0.08 -1.34 0.00 0.00 175.55 175.08 3b4m s VAL 176 N -1.20 1.69 0.58 3.14 1.01 -0.36 -2.68 120.40 122.58 3b4m s VAL 176 Ca 0.34 -2.19 -0.15 0.00 0.00 0.00 0.00 61.98 59.98 3b4m s VAL 176 Cb -0.20 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 3b4m s VAL 176 CO 0.22 -0.70 1.04 -0.83 0.00 0.00 0.00 175.10 174.82 3b4m s GLY 177 N 0.90 2.06 -0.40 4.51 0.00 0.10 -1.81 107.32 112.69 3b4m s GLY 177 Ca 0.13 0.30 -0.01 0.00 0.00 0.00 0.00 44.72 45.14 3b4m s GLY 177 CO -0.11 0.60 0.37 -2.01 0.00 0.00 0.00 173.10 171.95 3b4m n ASN 178 N -2.00 -4.62 -3.93 1.64 5.15 -1.15 -2.35 115.26 108.00 3b4m n ASN 178 Ca 0.08 -0.12 -0.27 0.00 -0.60 0.00 0.00 54.58 53.67 3b4m n ASN 178 Cb 0.53 -2.97 -0.17 0.00 -0.53 0.00 0.00 39.78 36.64 3b4m n ASN 178 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3b4m s VAL 179 N -3.05 1.10 1.01 3.44 1.01 0.13 -4.68 120.40 119.36 3b4m s VAL 179 Ca 0.06 -0.34 -0.17 0.00 0.00 0.00 0.00 61.98 61.53 3b4m s VAL 179 Cb -0.01 -1.09 0.24 0.00 0.00 0.00 0.00 36.38 35.52 3b4m s VAL 179 CO 0.36 0.38 1.06 -0.90 0.00 0.00 0.00 175.10 176.00 3b4m n ASP 180 N 4.82 -1.16 -0.72 3.32 5.75 -1.26 -3.65 116.55 123.64 3b4m n ASP 180 Ca -0.14 -1.23 0.07 0.00 -0.01 0.00 0.00 54.79 53.49 3b4m n ASP 180 Cb 0.50 -0.90 0.22 0.00 -1.03 0.00 0.00 41.12 39.91 3b4m n ASP 180 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3b4m n TYR 181 N -4.23 0.47 0.64 2.11 0.18 -1.26 -3.21 117.16 111.86 3b4m n TYR 181 Ca 0.14 -0.24 0.07 0.00 1.88 0.00 0.00 57.90 59.76 3b4m n TYR 181 Cb 0.52 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.50 3b4m n TYR 181 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3b4m n GLY 182 N 1.15 -0.02 3.68 -7.48 0.00 -1.26 -4.98 105.19 96.29 3b4m n GLY 182 Ca 0.14 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 3b4m n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b4m s ALA 183 N -1.59 3.70 0.02 4.61 0.00 -1.20 -5.02 121.76 122.28 3b4m s ALA 183 Ca 0.14 1.35 0.02 0.00 0.00 0.00 0.00 51.96 53.47 3b4m s ALA 183 Cb 0.12 -3.77 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 3b4m s ALA 183 CO 0.31 -1.28 -0.00 0.95 0.00 0.00 0.00 175.76 175.73 3b4m s THR 184 N 3.13 4.10 0.31 0.00 -4.23 -1.26 -5.03 115.64 112.66 3b4m s THR 184 Ca 0.81 -0.68 0.05 0.00 -1.18 0.00 0.00 61.69 60.68 3b4m s THR 184 Cb -0.43 -2.85 0.30 0.00 1.34 0.00 0.00 72.50 70.86 3b4m s THR 184 CO 0.36 0.33 1.84 0.00 -0.54 0.00 0.00 174.62 176.61 3b4m h ALA 185 N 4.18 1.67 -0.61 3.99 0.00 -1.95 0.34 119.26 126.88 3b4m h ALA 185 Ca -0.49 0.03 0.12 0.00 0.00 0.00 0.00 54.91 54.57 3b4m h ALA 185 Cb 1.17 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 3b4m h ALA 185 CO 0.58 0.07 0.07 1.49 0.00 0.00 0.00 179.25 181.46 3b4m h GLU 186 N 0.84 0.19 -0.08 0.00 4.81 -2.00 -2.22 114.58 116.12 3b4m h GLU 186 Ca 0.49 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.54 3b4m h GLU 186 Cb 0.64 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 29.99 3b4m h GLU 186 CO -0.26 0.12 -0.61 0.93 -0.73 0.00 0.00 179.01 178.46 3b4m h GLU 187 N 0.19 0.56 -0.63 1.92 5.08 -1.37 -2.58 114.58 117.76 3b4m h GLU 187 Ca 0.32 -0.49 -0.06 0.00 -1.00 0.00 0.00 59.36 58.13 3b4m h GLU 187 Cb 0.51 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 3b4m h GLU 187 CO -0.46 1.12 0.17 -0.07 -1.00 0.00 0.00 179.01 178.77 3b4m h LEU 188 N 0.18 0.94 0.30 1.33 3.38 -1.30 -1.43 115.31 118.71 3b4m h LEU 188 Ca -0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 3b4m h LEU 188 Cb 1.27 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 3b4m h LEU 188 CO 0.13 0.92 -0.21 -0.08 0.09 0.00 0.00 178.44 179.29 3b4m h GLU 189 N 0.92 -0.47 -1.60 1.13 4.22 -1.46 -2.63 114.58 114.70 3b4m h GLU 189 Ca 0.20 0.03 0.51 0.00 0.08 0.00 0.00 59.36 60.18 3b4m h GLU 189 Cb 0.33 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 29.58 3b4m h GLU 189 CO -0.00 -0.31 1.09 0.00 -2.18 0.00 0.00 179.01 177.61 3b4m n ALA 190 N -2.40 1.56 0.28 2.92 0.00 -0.97 0.15 120.51 122.06 3b4m n ALA 190 Ca -0.06 0.77 0.15 0.00 0.00 0.00 0.00 53.44 54.30 3b4m n ALA 190 Cb 0.21 -1.07 0.50 0.00 0.00 0.00 0.00 19.45 19.08 3b4m n ALA 190 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3b4m h HIS 191 N 0.00 0.00 0.00 0.00 -0.00 -0.89 -3.22 115.15 111.05 3b4m h HIS 191 Ca 0.89 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 61.26 3b4m h HIS 191 Cb 3.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 30.58 3b4m h HIS 191 CO -0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.93 179.12 3b4m n PHE 192 N -3.00 0.00 -0.34 5.26 3.72 0.40 -4.72 117.46 118.77 3b4m n PHE 192 Ca 0.02 0.00 0.21 0.00 -0.05 0.00 0.00 57.45 57.63 3b4m n PHE 192 Cb 0.38 0.00 0.44 0.00 -0.94 0.00 0.00 39.48 39.36 3b4m n PHE 192 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3b4m h HIS 193 N 0.00 0.92 0.00 1.38 2.76 -0.29 0.10 115.15 120.02 3b4m h HIS 193 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 3b4m h HIS 193 Cb 0.01 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.72 3b4m h HIS 193 CO 0.00 -0.00 0.14 0.78 -1.30 0.00 0.00 177.93 177.54 3b4m h GLY 194 N 0.47 0.00 0.51 5.26 0.00 -1.85 -2.86 103.07 104.60 3b4m h GLY 194 Ca 0.67 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.00 3b4m h GLY 194 CO -0.47 0.00 -0.88 0.00 0.00 0.00 0.00 176.54 175.19 3b4m n GLY 196 N 1.45 3.39 3.69 0.00 0.00 -1.08 -4.47 105.19 108.17 3b4m n GLY 196 Ca 0.04 -1.68 -0.44 0.00 0.00 0.00 0.00 46.02 43.94 3b4m n GLY 196 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3b4m n SER 197 N 0.00 3.29 -4.61 1.61 2.88 -1.26 -4.67 113.62 110.86 3b4m n SER 197 Ca 0.00 1.11 -0.34 0.00 -1.33 0.00 0.00 58.87 58.30 3b4m n SER 197 Cb 0.00 -1.48 -0.10 0.00 -0.75 0.00 0.00 64.21 61.88 3b4m n SER 197 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3b4m s VAL 198 N 0.51 4.45 -0.16 2.46 1.01 -1.26 -0.97 120.40 126.44 3b4m s VAL 198 Ca 0.72 -0.16 -0.18 0.00 0.00 0.00 0.00 61.98 62.36 3b4m s VAL 198 Cb -0.61 -2.96 -0.15 0.00 0.00 0.00 0.00 36.38 32.66 3b4m s VAL 198 CO 0.42 0.50 0.24 0.78 0.00 0.00 0.00 175.10 177.04 3b4m h ASN 199 N 6.38 0.00 -4.54 3.32 2.35 -1.33 -3.45 115.58 118.31 3b4m h ASN 199 Ca -0.38 -0.45 -0.29 0.00 -0.55 0.00 0.00 56.30 54.63 3b4m h ASN 199 Cb 1.18 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 39.32 3b4m h ASN 199 CO 0.65 1.07 -0.74 -0.60 -1.65 0.00 0.00 177.43 176.16 3b4m s ARG 200 N -2.19 0.52 -0.09 0.81 3.52 -1.11 -5.04 118.95 115.38 3b4m s ARG 200 Ca -0.19 -0.62 0.04 0.00 -0.13 0.00 0.00 55.73 54.83 3b4m s ARG 200 Cb 0.02 -0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.06 3b4m s ARG 200 CO 0.45 0.07 -0.22 0.08 -0.81 0.00 0.00 175.30 174.87 3b4m s VAL 201 N -1.06 1.92 -0.15 7.11 1.01 -1.26 -2.02 120.40 125.95 3b4m s VAL 201 Ca -0.07 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 60.98 3b4m s VAL 201 Cb -0.08 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.66 3b4m s VAL 201 CO 0.00 0.53 -0.16 -0.89 0.00 0.00 0.00 175.10 174.58 3b4m s THR 202 N 0.33 1.74 -0.16 3.92 2.01 -0.65 -4.99 115.64 117.83 3b4m s THR 202 Ca -0.17 -0.75 -0.04 0.00 0.31 0.00 0.00 61.69 61.05 3b4m s THR 202 Cb -0.17 -1.60 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 3b4m s THR 202 CO 0.08 0.49 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.84 3b4m s ILE 203 N 1.33 4.00 -0.16 1.82 1.01 -1.26 0.11 121.20 128.06 3b4m s ILE 203 Ca 0.03 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.37 3b4m s ILE 203 Cb -0.13 -2.77 0.01 0.00 0.01 0.00 0.00 42.46 39.58 3b4m s ILE 203 CO -0.10 0.48 -0.18 -0.76 0.00 0.00 0.00 174.94 174.38 3b4m s LEU 204 N 0.44 2.30 -0.04 2.97 1.02 -0.54 -4.99 118.68 119.83 3b4m s LEU 204 Ca -0.03 -0.55 0.05 0.00 0.02 0.00 0.00 54.13 53.62 3b4m s LEU 204 Cb -0.14 -1.51 -0.01 0.00 0.02 0.00 0.00 46.19 44.55 3b4m s LEU 204 CO 0.02 0.06 -0.20 0.00 0.02 0.00 0.00 176.35 176.25 3b4m n ASP 206 N 3.00 1.59 -4.14 0.00 8.00 0.91 -4.95 116.55 120.96 3b4m n ASP 206 Ca -0.17 -1.30 -0.18 0.00 0.71 0.00 0.00 54.79 53.85 3b4m n ASP 206 Cb 0.53 0.29 -0.12 0.00 -0.02 0.00 0.00 41.12 41.79 3b4m n ASP 206 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3b4m s LYS 207 N -1.32 0.78 0.00 -1.24 -0.14 -1.24 -4.96 119.74 111.62 3b4m s LYS 207 Ca 0.11 -0.84 0.00 0.00 -1.36 0.00 0.00 55.97 53.88 3b4m s LYS 207 Cb 0.10 -0.75 0.00 0.00 -1.68 0.00 0.00 37.83 35.50 3b4m s LYS 207 CO 0.24 0.17 0.69 1.19 -0.76 0.00 0.00 175.35 176.88 3b4m n PHE 208 N 1.53 0.00 -3.82 3.18 3.72 -1.26 -4.57 117.46 116.24 3b4m n PHE 208 Ca -0.20 -0.22 -0.06 0.00 -0.05 0.00 0.00 57.45 56.92 3b4m n PHE 208 Cb 0.54 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 3b4m n PHE 208 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3b4m s SER 209 N -0.44 -0.11 0.71 4.37 1.04 -1.26 -5.00 113.70 113.00 3b4m s SER 209 Ca 0.00 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.73 3b4m s SER 209 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 3b4m s SER 209 CO 0.00 -1.23 0.00 0.61 0.98 0.00 0.00 173.24 173.60 3b4m n GLY 210 N -0.53 1.37 3.74 7.32 0.00 -1.26 -4.54 105.19 111.29 3b4m n GLY 210 Ca -0.05 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 3b4m n GLY 210 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3b4m s HIS 211 N 0.00 3.12 0.77 1.61 3.76 -1.26 -5.00 115.29 118.28 3b4m s HIS 211 Ca 0.00 1.09 -0.10 0.00 -0.15 0.00 0.00 55.06 55.89 3b4m s HIS 211 Cb 0.00 -3.74 0.07 0.00 1.11 0.00 0.00 32.58 30.02 3b4m s HIS 211 CO 0.00 -2.38 1.12 -1.25 -0.85 0.00 0.00 174.74 171.38 3b4m s PRO 212 N -0.19 2.12 -0.29 8.40 0.04 -1.26 -4.82 135.00 138.99 3b4m s PRO 212 Ca 0.59 0.04 0.01 0.00 0.04 0.00 0.00 61.00 61.67 3b4m s PRO 212 Cb -0.40 -2.02 0.19 0.00 0.04 0.00 0.00 34.50 32.31 3b4m s PRO 212 CO 0.41 -1.43 0.71 0.21 0.04 0.00 0.00 177.00 176.93 3b4m s LYS 213 N -5.46 0.45 0.00 4.56 2.20 -1.26 -4.94 119.74 115.29 3b4m s LYS 213 Ca 0.61 0.49 0.00 0.00 -0.36 0.00 0.00 55.97 56.71 3b4m s LYS 213 Cb -0.11 0.23 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 3b4m s LYS 213 CO 0.48 -0.80 0.00 0.41 -0.36 0.00 0.00 175.35 175.08 3b4m n GLY 214 N 5.35 0.94 0.06 5.54 0.00 -1.24 -0.06 105.19 115.78 3b4m n GLY 214 Ca 0.05 -0.64 -0.00 0.00 0.00 0.00 0.00 46.02 45.43 3b4m n GLY 214 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3b4m n PHE 215 N -0.11 -0.01 -3.91 1.61 1.16 -0.92 -0.69 117.46 114.59 3b4m n PHE 215 Ca 0.00 -0.05 -0.09 0.00 -1.87 0.00 0.00 57.45 55.44 3b4m n PHE 215 Cb 0.00 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.81 3b4m n PHE 215 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3b4m s ALA 216 N -2.02 -0.27 -0.07 1.98 0.00 -0.75 -1.47 121.76 119.16 3b4m s ALA 216 Ca 0.01 -0.72 0.05 0.00 0.00 0.00 0.00 51.96 51.30 3b4m s ALA 216 Cb 0.00 0.89 -0.01 0.00 0.00 0.00 0.00 23.12 24.01 3b4m s ALA 216 CO 0.00 -0.72 -0.24 0.71 0.00 0.00 0.00 175.76 175.52 3b4m s TYR 217 N -3.95 2.39 -0.19 0.00 2.02 0.31 -1.23 117.35 116.70 3b4m s TYR 217 Ca 0.16 -0.79 -0.03 0.00 -0.37 0.00 0.00 57.07 56.04 3b4m s TYR 217 Cb 0.02 -1.58 -0.02 0.00 -0.40 0.00 0.00 41.96 39.98 3b4m s TYR 217 CO 0.01 -0.27 -0.05 0.42 -1.57 0.00 0.00 175.55 174.09 3b4m s ILE 218 N 0.00 3.52 -0.34 2.71 -1.09 -0.74 -1.64 121.20 123.63 3b4m s ILE 218 Ca -0.08 -0.47 -0.07 0.00 -2.23 0.00 0.00 60.65 57.81 3b4m s ILE 218 Cb -0.15 -2.57 0.04 0.00 -1.58 0.00 0.00 42.46 38.20 3b4m s ILE 218 CO 0.05 0.46 0.11 -0.70 -1.23 0.00 0.00 174.94 173.63 3b4m s GLU 219 N 0.96 2.64 0.70 2.79 2.12 -0.86 -0.26 118.70 126.79 3b4m s GLU 219 Ca -0.00 -1.17 -0.11 0.00 0.36 0.00 0.00 54.97 54.05 3b4m s GLU 219 Cb -0.15 -3.47 0.02 0.00 0.26 0.00 0.00 34.13 30.79 3b4m s GLU 219 CO 0.01 -0.66 1.08 -0.06 -0.54 0.00 0.00 175.26 175.08 3b4m s PHE 220 N 1.41 3.26 -0.01 5.30 0.08 0.45 -1.04 117.98 127.43 3b4m s PHE 220 Ca -0.01 0.94 -0.19 0.00 0.12 0.00 0.00 56.93 57.78 3b4m s PHE 220 Cb -0.19 -3.08 -0.11 0.00 -0.57 0.00 0.00 43.02 39.06 3b4m s PHE 220 CO 0.03 -1.21 0.87 0.77 -0.10 0.00 0.00 175.22 175.58 3b4m h SER 221 N -0.64 -0.59 -3.15 1.36 0.02 -1.35 -3.42 113.55 105.78 3b4m h SER 221 Ca -0.45 0.02 -0.54 0.00 -0.84 0.00 0.00 61.79 59.98 3b4m h SER 221 Cb 1.26 0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.94 3b4m h SER 221 CO 0.64 -0.24 -0.22 -0.62 -1.14 0.00 0.00 176.83 175.25 3b4m s ASP 222 N -4.40 6.46 0.18 3.07 2.15 -1.26 -5.01 116.67 117.86 3b4m s ASP 222 Ca -0.10 0.64 -0.10 0.00 0.43 0.00 0.00 52.55 53.42 3b4m s ASP 222 Cb 0.01 -2.11 0.07 0.00 -0.30 0.00 0.00 42.92 40.59 3b4m s ASP 222 CO 0.31 -0.10 1.67 0.11 -0.17 0.00 0.00 175.17 176.99 3b4m h LYS 223 N 2.10 1.01 -0.92 4.34 1.57 -1.89 -3.24 116.57 119.53 3b4m h LYS 223 Ca -0.47 -0.27 0.23 0.00 -1.87 0.00 0.00 60.65 58.27 3b4m h LYS 223 Cb 1.18 -0.12 -0.17 0.00 0.08 0.00 0.00 32.23 33.21 3b4m h LYS 223 CO 0.68 0.95 -0.02 0.93 -0.57 0.00 0.00 179.45 181.42 3b4m h GLU 224 N 0.92 0.04 -0.31 3.15 5.08 -1.95 0.14 114.58 121.65 3b4m h GLU 224 Ca 0.18 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.63 3b4m h GLU 224 Cb 0.43 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3b4m h GLU 224 CO 0.01 0.02 0.43 0.77 -1.00 0.00 0.00 179.01 179.25 3b4m h SER 225 N 0.04 0.00 0.28 1.42 0.02 -1.78 -2.00 113.55 111.53 3b4m h SER 225 Ca 0.53 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.46 3b4m h SER 225 Cb 1.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 3b4m h SER 225 CO -0.86 0.00 -0.13 0.58 -1.14 0.00 0.00 176.83 175.27 3b4m h VAL 226 N 0.00 0.75 -0.50 2.27 2.07 -0.91 0.27 116.25 120.20 3b4m h VAL 226 Ca 0.15 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 67.15 3b4m h VAL 226 Cb 1.01 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.78 3b4m h VAL 226 CO -0.00 0.12 0.21 0.03 0.02 0.00 0.00 177.57 177.94 3b4m h ARG 227 N -0.69 0.40 -0.34 1.57 3.08 -1.51 -2.73 114.38 114.15 3b4m h ARG 227 Ca -0.04 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.06 3b4m h ARG 227 Cb 0.48 -0.09 -0.08 0.00 0.08 0.00 0.00 29.97 30.36 3b4m h ARG 227 CO 0.06 0.26 -0.20 1.15 -1.07 0.00 0.00 179.97 180.18 3b4m h THR 228 N 0.41 0.44 0.00 2.04 2.02 -1.50 -2.95 112.91 113.37 3b4m h THR 228 Ca 0.23 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.40 3b4m h THR 228 Cb 0.21 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3b4m h THR 228 CO -0.21 0.00 -0.07 0.77 0.37 0.00 0.00 175.52 176.37 3b4m h SER 229 N -0.15 0.00 0.00 4.18 4.64 -0.63 -2.41 113.55 119.19 3b4m h SER 229 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3b4m h SER 229 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3b4m h SER 229 CO -0.43 0.07 0.16 -0.07 -0.87 0.00 0.00 176.83 175.69 3b4m h LEU 230 N 0.00 0.00 0.00 5.97 3.38 -1.33 -0.93 115.31 122.40 3b4m h LEU 230 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3b4m h LEU 230 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3b4m h LEU 230 CO 0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.54 3b4m n ALA 231 N -1.89 1.80 0.72 1.53 0.00 -0.91 -2.31 120.51 119.46 3b4m n ALA 231 Ca -0.02 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.44 3b4m n ALA 231 Cb 0.21 -1.25 0.06 0.00 0.00 0.00 0.00 19.45 18.47 3b4m n ALA 231 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3b4m n LEU 232 N -1.37 2.34 -4.70 0.00 4.77 -0.35 -4.90 117.00 112.79 3b4m n LEU 232 Ca 0.06 -0.97 -0.43 0.00 -0.03 0.00 0.00 56.01 54.64 3b4m n LEU 232 Cb 0.15 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 3b4m n LEU 232 CO 0.13 0.42 1.38 -0.67 -1.33 0.00 0.00 177.39 177.31 3b4m n ASP 233 N 0.84 3.90 0.00 -1.43 2.03 -0.98 -0.49 116.55 120.42 3b4m n ASP 233 Ca 0.10 1.04 0.00 0.00 0.52 0.00 0.00 54.79 56.45 3b4m n ASP 233 Cb 0.42 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.27 3b4m n ASP 233 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3b4m n GLU 234 N 4.37 -0.33 -1.87 -0.67 1.02 0.85 -4.92 120.64 119.09 3b4m n GLU 234 Ca 0.17 0.08 -0.32 0.00 -0.02 0.00 0.00 57.16 57.06 3b4m n GLU 234 Cb 0.35 -3.31 0.03 0.00 -0.02 0.00 0.00 31.44 28.49 3b4m n GLU 234 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3b4m s SER 235 N -2.11 5.49 -0.51 1.62 1.04 0.36 -4.64 113.70 114.95 3b4m s SER 235 Ca 0.00 1.84 -0.24 0.00 0.48 0.00 0.00 55.95 58.04 3b4m s SER 235 Cb 0.00 -2.53 0.04 0.00 0.10 0.00 0.00 66.02 63.62 3b4m s SER 235 CO 0.00 -1.37 0.87 -0.76 0.98 0.00 0.00 173.24 172.96 3b4m s LEU 236 N -4.80 4.21 -0.14 2.42 1.43 -1.26 -0.99 118.68 119.56 3b4m s LEU 236 Ca 0.64 -0.27 -0.02 0.00 -1.03 0.00 0.00 54.13 53.44 3b4m s LEU 236 Cb -0.17 -2.88 -0.02 0.00 0.03 0.00 0.00 46.19 43.15 3b4m s LEU 236 CO 0.41 -1.09 -0.06 0.12 0.23 0.00 0.00 176.35 175.97 3b4m s PHE 237 N 3.61 2.97 -1.53 0.29 5.36 -0.28 -4.69 117.98 123.71 3b4m s PHE 237 Ca 0.30 -0.35 -0.05 0.00 -0.96 0.00 0.00 56.93 55.87 3b4m s PHE 237 Cb -0.13 -1.91 0.05 0.00 -0.34 0.00 0.00 43.02 40.69 3b4m s PHE 237 CO 0.20 -0.04 0.41 0.54 -1.46 0.00 0.00 175.22 174.87 3b4m n ARG 238 N 3.41 -2.57 -0.88 10.12 1.74 -1.26 -0.26 116.66 126.96 3b4m n ARG 238 Ca -0.18 0.31 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 3b4m n ARG 238 Cb 0.53 -4.44 0.00 0.00 -1.02 0.00 0.00 32.46 27.53 3b4m n ARG 238 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3b4m n GLY 239 N -1.95 0.25 3.05 -0.13 0.00 -1.26 -4.99 105.19 100.16 3b4m n GLY 239 Ca -0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 3b4m n GLY 239 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3b4m s ARG 240 N -1.04 0.70 -0.04 1.61 1.70 0.64 -5.09 118.95 117.44 3b4m s ARG 240 Ca 0.00 -0.51 -0.30 0.00 -0.47 0.00 0.00 55.73 54.45 3b4m s ARG 240 Cb 0.00 -0.64 -0.03 0.00 -0.57 0.00 0.00 34.95 33.71 3b4m s ARG 240 CO 0.00 0.16 1.10 1.14 -1.08 0.00 0.00 175.30 176.62 3b4m s GLN 241 N -0.72 4.43 0.16 3.89 -2.07 -1.26 -1.13 119.66 122.96 3b4m s GLN 241 Ca 0.00 1.56 -0.00 0.00 -1.82 0.00 0.00 55.36 55.10 3b4m s GLN 241 Cb -0.06 -3.49 -0.04 0.00 -1.09 0.00 0.00 33.01 28.33 3b4m s GLN 241 CO 0.00 -0.29 0.34 0.96 -1.32 0.00 0.00 175.29 174.98 3b4m s ILE 242 N 1.69 5.25 -0.26 3.63 -4.36 -0.16 -4.84 121.20 122.15 3b4m s ILE 242 Ca 0.54 -0.40 -0.09 0.00 -0.26 0.00 0.00 60.65 60.43 3b4m s ILE 242 Cb -0.23 -3.71 -0.04 0.00 1.25 0.00 0.00 42.46 39.73 3b4m s ILE 242 CO 0.23 -0.09 0.13 -0.75 0.24 0.00 0.00 174.94 174.70 3b4m s LYS 243 N -3.13 3.81 -0.34 0.37 2.47 -0.99 -0.10 119.74 121.82 3b4m s LYS 243 Ca 0.37 -0.40 -0.03 0.00 -1.56 0.00 0.00 55.97 54.36 3b4m s LYS 243 Cb -0.11 -3.48 0.07 0.00 -1.46 0.00 0.00 37.83 32.84 3b4m s LYS 243 CO 0.28 -0.17 0.08 0.08 0.16 0.00 0.00 175.35 175.78 3b4m s VAL 244 N 1.64 3.16 0.02 4.02 1.01 -1.26 0.03 120.40 129.02 3b4m s VAL 244 Ca 0.07 -1.58 0.05 0.00 0.00 0.00 0.00 61.98 60.52 3b4m s VAL 244 Cb -0.15 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 3b4m s VAL 244 CO 0.07 -0.31 -0.16 0.27 0.00 0.00 0.00 175.10 174.98 3b4m s ILE 245 N 1.23 1.23 0.49 2.22 -4.36 -1.09 -4.70 121.20 116.23 3b4m s ILE 245 Ca -0.00 -0.88 -0.22 0.00 -0.26 0.00 0.00 60.65 59.29 3b4m s ILE 245 Cb -0.21 -1.07 -0.07 0.00 1.25 0.00 0.00 42.46 42.37 3b4m s ILE 245 CO -0.02 0.18 1.19 -2.84 0.24 0.00 0.00 174.94 173.70 3b4m s PRO 246 N -0.81 3.56 0.57 0.37 0.02 -1.26 -0.25 135.00 137.20 3b4m s PRO 246 Ca 0.04 1.83 0.35 0.00 0.02 0.00 0.00 61.00 63.24 3b4m s PRO 246 Cb -0.07 -2.30 1.63 0.00 0.02 0.00 0.00 34.50 33.77 3b4m s PRO 246 CO 0.01 -0.73 2.09 -0.22 -0.33 0.00 0.00 177.00 177.82 3b4m h LYS 247 N 1.78 0.00 0.00 5.54 3.64 -1.41 -3.43 116.57 122.69 3b4m h LYS 247 Ca -0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3b4m h LYS 247 Cb 1.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3b4m h LYS 247 CO 0.59 0.03 0.00 -2.13 -2.27 0.00 0.00 179.45 175.67