#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h7h s ASP 176 N 0.00 0.59 0.97 3.17 1.01 -1.26 -5.15 116.67 116.00 3h7h s ASP 176 Ca 0.00 -0.09 -0.14 0.00 0.71 0.00 0.00 52.55 53.03 3h7h s ASP 176 Cb 0.00 -0.08 0.17 0.00 1.01 0.00 0.00 42.92 44.02 3h7h s ASP 176 CO 0.00 0.05 1.17 -2.16 0.21 0.00 0.00 175.17 174.44 3h7h s PRO 177 N -0.05 0.65 0.39 8.23 0.04 -1.26 -4.98 135.00 138.02 3h7h s PRO 177 Ca 0.01 0.08 0.08 0.00 0.04 0.00 0.00 61.00 61.21 3h7h s PRO 177 Cb -0.03 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.71 3h7h s PRO 177 CO -0.00 -2.49 0.53 -0.80 0.04 0.00 0.00 177.00 174.27 3h7h s ASN 178 N -4.19 5.71 -0.06 6.66 -0.87 -0.59 -4.90 114.94 116.70 3h7h s ASN 178 Ca 0.67 -0.37 0.01 0.00 -1.57 0.00 0.00 52.86 51.59 3h7h s ASN 178 Cb -0.12 -0.83 -0.03 0.00 -0.02 0.00 0.00 41.25 40.26 3h7h s ASN 178 CO 0.54 -0.65 -0.05 -0.76 -2.57 0.00 0.00 177.10 173.60 3h7h s LEU 179 N -4.28 3.27 -0.01 0.60 1.43 -1.26 -1.17 118.68 117.26 3h7h s LEU 179 Ca 0.51 0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.66 3h7h s LEU 179 Cb -0.09 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 3h7h s LEU 179 CO 0.32 0.35 -0.14 0.26 0.23 0.00 0.00 176.35 177.37 3h7h s TRP 180 N -0.86 1.30 0.07 0.29 0.52 0.34 -0.61 118.94 120.00 3h7h s TRP 180 Ca 0.13 -0.25 -0.14 0.00 0.02 0.00 0.00 56.10 55.87 3h7h s TRP 180 Cb -0.11 -0.83 -0.06 0.00 -1.15 0.00 0.00 33.47 31.31 3h7h s TRP 180 CO 0.03 -0.02 0.47 0.95 0.02 0.00 0.00 176.95 178.40 3h7h s THR 181 N -0.35 4.95 -0.09 2.01 -4.23 0.29 -0.17 115.64 118.04 3h7h s THR 181 Ca 0.05 0.79 -0.01 0.00 -1.18 0.00 0.00 61.69 61.34 3h7h s THR 181 Cb -0.06 -3.73 0.03 0.00 1.34 0.00 0.00 72.50 70.09 3h7h s THR 181 CO -0.01 0.40 0.00 -0.69 -0.54 0.00 0.00 174.62 173.79 3h7h s VAL 182 N -1.28 0.44 0.34 2.29 1.01 -0.20 -2.88 120.40 120.13 3h7h s VAL 182 Ca 0.31 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.01 3h7h s VAL 182 Cb -0.16 -0.63 -0.11 0.00 0.00 0.00 0.00 36.38 35.47 3h7h s VAL 182 CO 0.17 0.21 1.49 0.29 0.00 0.00 0.00 175.10 177.26 3h7h n LYS 183 N 5.12 2.59 -4.00 2.72 5.02 -1.26 -1.14 118.16 127.21 3h7h n LYS 183 Ca -0.08 0.91 -0.13 0.00 -2.02 0.00 0.00 58.31 56.99 3h7h n LYS 183 Cb 0.50 -2.63 -0.14 0.00 -0.02 0.00 0.00 35.03 32.74 3h7h n LYS 183 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h7h n LYS 185 N 2.76 1.52 -1.83 0.00 4.81 -0.11 -4.12 118.16 121.18 3h7h n LYS 185 Ca -0.14 0.55 -0.42 0.00 -0.87 0.00 0.00 58.31 57.43 3h7h n LYS 185 Cb 0.58 -2.27 -0.02 0.00 0.02 0.00 0.00 35.03 33.35 3h7h n LYS 185 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 3h7h s ILE 186 N 2.05 2.22 0.00 3.15 2.07 -1.26 -1.46 121.20 127.98 3h7h s ILE 186 Ca 0.89 0.18 0.00 0.00 -1.41 0.00 0.00 60.65 60.31 3h7h s ILE 186 Cb -0.89 -3.12 0.00 0.00 0.13 0.00 0.00 42.46 38.58 3h7h s ILE 186 CO 0.51 0.03 0.00 0.61 -1.91 0.00 0.00 174.94 174.18 3h7h n GLY 187 N 2.46 1.65 1.20 1.50 0.00 -1.26 -4.88 105.19 105.86 3h7h n GLY 187 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.19 3h7h n GLY 187 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h7h n GLU 188 N -2.00 3.34 -0.06 1.61 -0.58 -0.54 -4.72 120.64 117.69 3h7h n GLU 188 Ca 0.00 -2.67 -0.11 0.00 -0.42 0.00 0.00 57.16 53.96 3h7h n GLU 188 Cb 0.00 -1.72 -0.05 0.00 -0.57 0.00 0.00 31.44 29.10 3h7h n GLU 188 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3h7h h GLU 189 N 3.09 0.32 -0.12 3.49 3.07 -1.90 -0.49 114.58 122.05 3h7h h GLU 189 Ca 0.00 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 58.77 3h7h h GLU 189 Cb 1.26 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 3h7h h GLU 189 CO 0.17 0.45 0.04 -0.09 -1.40 0.00 0.00 179.01 178.17 3h7h h ARG 190 N 0.14 0.19 -0.99 2.33 2.43 -1.92 -1.05 114.38 115.51 3h7h h ARG 190 Ca 0.06 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.25 3h7h h ARG 190 Cb 0.27 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.73 3h7h h ARG 190 CO 0.00 0.34 0.64 0.00 -1.51 0.00 0.00 179.97 179.44 3h7h h ALA 191 N 0.84 1.41 -0.24 2.80 0.00 -1.86 -1.67 119.26 120.54 3h7h h ALA 191 Ca 0.04 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3h7h h ALA 191 Cb 0.23 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3h7h h ALA 191 CO -0.00 0.45 -0.43 1.15 0.00 0.00 0.00 179.25 180.42 3h7h h THR 192 N 1.17 1.31 -0.88 0.00 2.02 -0.81 -0.35 112.91 115.37 3h7h h THR 192 Ca 0.42 -1.64 0.05 0.00 0.77 0.00 0.00 66.41 66.01 3h7h h THR 192 Cb 0.15 1.76 -0.06 0.00 -1.74 0.00 0.00 68.15 68.25 3h7h h THR 192 CO -0.16 0.52 0.56 0.00 0.37 0.00 0.00 175.52 176.81 3h7h h ALA 193 N 0.64 1.19 -0.31 6.16 0.00 -0.90 -0.29 119.26 125.75 3h7h h ALA 193 Ca 0.01 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 3h7h h ALA 193 Cb 1.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3h7h h ALA 193 CO 0.10 0.35 -0.39 0.82 0.00 0.00 0.00 179.25 180.12 3h7h h ILE 194 N 1.04 1.29 -0.70 0.00 1.08 -1.12 -1.85 117.51 117.25 3h7h h ILE 194 Ca 0.37 -1.56 -0.03 0.00 -0.39 0.00 0.00 64.86 63.24 3h7h h ILE 194 Cb 0.10 1.47 -0.03 0.00 -3.07 0.00 0.00 36.82 35.29 3h7h h ILE 194 CO -0.15 0.51 0.30 0.77 -0.69 0.00 0.00 178.15 178.88 3h7h h SER 195 N 0.61 0.93 0.04 1.72 4.64 -0.54 -2.09 113.55 118.85 3h7h h SER 195 Ca 0.05 -0.12 -0.11 0.00 -0.47 0.00 0.00 61.79 61.14 3h7h h SER 195 Cb 0.94 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 3h7h h SER 195 CO 0.09 0.81 -0.34 -0.07 -0.87 0.00 0.00 176.83 176.45 3h7h h LEU 196 N 1.00 0.44 -0.42 5.97 3.38 -0.72 -0.68 115.31 124.28 3h7h h LEU 196 Ca 0.24 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.09 3h7h h LEU 196 Cb 0.16 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 3h7h h LEU 196 CO -0.02 0.76 0.15 -0.03 0.09 0.00 0.00 178.44 179.38 3h7h h MET 197 N 0.37 0.30 -0.68 1.13 4.05 -0.76 -0.17 114.93 119.17 3h7h h MET 197 Ca 0.04 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.40 3h7h h MET 197 Cb 0.78 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.48 3h7h h MET 197 CO 0.06 0.20 0.24 0.00 0.23 0.00 0.00 176.91 177.65 3h7h h ARG 198 N 0.31 1.04 -0.48 0.39 3.08 -0.98 -2.25 114.38 115.49 3h7h h ARG 198 Ca 0.20 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3h7h h ARG 198 Cb 0.18 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 3h7h h ARG 198 CO -0.20 0.88 0.26 -0.22 -1.07 0.00 0.00 179.97 179.62 3h7h h LYS 199 N 0.98 0.68 -0.37 0.04 3.64 -0.76 0.21 116.57 120.99 3h7h h LYS 199 Ca 0.22 -0.08 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 3h7h h LYS 199 Cb 0.25 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 3h7h h LYS 199 CO -0.01 0.54 0.14 0.35 -2.27 0.00 0.00 179.45 178.20 3h7h h PHE 200 N 0.64 0.26 -0.56 1.91 3.57 -0.86 -1.93 116.94 119.98 3h7h h PHE 200 Ca 0.17 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 3h7h h PHE 200 Cb 0.07 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3h7h h PHE 200 CO -0.02 0.12 0.07 0.82 -2.23 0.00 0.00 178.31 177.07 3h7h h ILE 201 N 0.31 1.26 -0.99 1.41 2.04 -1.00 -2.62 117.51 117.92 3h7h h ILE 201 Ca 0.17 -1.00 0.06 0.00 1.00 0.00 0.00 64.86 65.09 3h7h h ILE 201 Cb 0.13 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 3h7h h ILE 201 CO -0.16 0.36 0.64 0.00 0.00 0.00 0.00 178.15 179.00 3h7h h ALA 202 N 0.99 1.41 -0.14 1.87 0.00 -0.17 -2.81 119.26 120.42 3h7h h ALA 202 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h7h h ALA 202 Cb 0.44 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3h7h h ALA 202 CO 0.01 0.44 0.00 0.66 0.00 0.00 0.00 179.25 180.37 3h7h n TYR 203 N -4.49 0.16 0.25 0.00 4.01 -0.76 -4.53 117.16 111.79 3h7h n TYR 203 Ca 0.15 -0.08 0.12 0.00 -0.16 0.00 0.00 57.90 57.93 3h7h n TYR 203 Cb 0.18 0.00 0.65 0.00 -0.31 0.00 0.00 39.34 39.85 3h7h n TYR 203 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 3h7h h GLN 204 N 4.06 0.00 -0.51 -0.72 3.07 -1.19 -1.78 115.11 118.04 3h7h h GLN 204 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.52 3h7h h GLN 204 Cb 0.87 0.00 -0.13 0.00 0.08 0.00 0.00 27.48 28.30 3h7h h GLN 204 CO 0.00 0.15 0.12 1.19 0.09 0.00 0.00 178.83 180.38 3h7h n PHE 205 N -3.50 1.60 -4.18 0.06 3.72 -1.26 -4.94 117.46 108.97 3h7h n PHE 205 Ca -0.01 -1.49 -0.28 0.00 -0.05 0.00 0.00 57.45 55.62 3h7h n PHE 205 Cb 0.31 -0.57 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 3h7h n PHE 205 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3h7h s THR 206 N -3.16 1.61 -2.01 4.37 -4.23 -0.67 -5.03 115.64 106.53 3h7h s THR 206 Ca 0.48 -1.67 0.12 0.00 -1.18 0.00 0.00 61.69 59.44 3h7h s THR 206 Cb 0.41 -2.28 0.34 0.00 1.34 0.00 0.00 72.50 72.31 3h7h s THR 206 CO 0.05 0.00 1.29 0.47 -0.54 0.00 0.00 174.62 175.88 3h7h n ASP 207 N -1.54 2.03 -3.13 3.99 8.00 -1.26 -4.13 116.55 120.51 3h7h n ASP 207 Ca -0.07 -1.99 -0.23 0.00 0.71 0.00 0.00 54.79 53.21 3h7h n ASP 207 Cb 0.65 -0.25 -0.04 0.00 -0.02 0.00 0.00 41.12 41.45 3h7h n ASP 207 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3h7h n THR 208 N 0.61 1.12 -1.69 -3.53 -2.24 -1.26 -5.11 114.28 102.19 3h7h n THR 208 Ca 0.13 -4.91 -0.32 0.00 -2.27 0.00 0.00 64.05 56.68 3h7h n THR 208 Cb 0.32 -1.08 0.04 0.00 -2.10 0.00 0.00 70.33 67.51 3h7h n THR 208 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3h7h s PRO 209 N -2.61 2.97 0.12 -0.78 0.04 -1.25 -4.90 135.00 128.59 3h7h s PRO 209 Ca 0.42 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 3h7h s PRO 209 Cb 0.28 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.76 3h7h s PRO 209 CO -0.10 -1.08 1.11 -0.51 0.04 0.00 0.00 177.00 176.47 3h7h s LEU 210 N -5.24 4.44 0.00 -3.56 1.02 -1.26 -4.94 118.68 109.14 3h7h s LEU 210 Ca 0.60 2.01 0.20 0.00 0.02 0.00 0.00 54.13 56.97 3h7h s LEU 210 Cb -0.15 -3.59 0.12 0.00 0.02 0.00 0.00 46.19 42.58 3h7h s LEU 210 CO 0.49 -0.30 1.11 0.00 0.02 0.00 0.00 176.35 177.67 3h7h n GLN 211 N 3.05 1.76 -1.44 1.70 6.02 -1.26 -4.96 117.38 122.25 3h7h n GLN 211 Ca 0.05 -1.51 -0.33 0.00 -0.01 0.00 0.00 57.00 55.20 3h7h n GLN 211 Cb 0.47 -1.39 0.08 0.00 1.02 0.00 0.00 30.24 30.42 3h7h n GLN 211 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3h7h s ILE 212 N -1.86 2.81 -0.15 5.09 -4.36 -1.26 -4.75 121.20 116.72 3h7h s ILE 212 Ca 0.22 0.35 0.13 0.00 -0.26 0.00 0.00 60.65 61.09 3h7h s ILE 212 Cb 0.17 -2.81 -0.18 0.00 1.25 0.00 0.00 42.46 40.88 3h7h s ILE 212 CO 0.32 -0.26 0.04 0.29 0.24 0.00 0.00 174.94 175.57 3h7h n LYS 213 N -2.93 1.50 -3.69 0.37 4.76 0.05 -5.01 118.16 113.22 3h7h n LYS 213 Ca 0.11 -0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.50 3h7h n LYS 213 Cb 0.52 -1.38 -0.02 0.00 -1.84 0.00 0.00 35.03 32.31 3h7h n LYS 213 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3h7h s SER 214 N -4.89 -0.23 -0.02 4.39 1.04 -1.24 -5.00 113.70 107.75 3h7h s SER 214 Ca -0.08 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.07 3h7h s SER 214 Cb 0.05 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.64 3h7h s SER 214 CO 0.61 -0.84 -0.08 -0.69 0.98 0.00 0.00 173.24 173.22 3h7h s VAL 215 N -3.26 0.68 -0.10 5.02 1.01 -1.26 -0.83 120.40 121.66 3h7h s VAL 215 Ca 0.10 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.82 3h7h s VAL 215 Cb -0.01 -0.62 -0.00 0.00 0.00 0.00 0.00 36.38 35.75 3h7h s VAL 215 CO -0.01 0.22 -0.23 -0.69 0.00 0.00 0.00 175.10 174.39 3h7h s VAL 216 N 0.25 2.13 -0.52 2.92 1.01 0.31 -4.99 120.40 121.50 3h7h s VAL 216 Ca -0.04 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.99 3h7h s VAL 216 Cb -0.08 -1.82 0.13 0.00 0.00 0.00 0.00 36.38 34.61 3h7h s VAL 216 CO 0.00 0.56 0.26 0.00 0.00 0.00 0.00 175.10 175.92 3h7h s ALA 217 N 0.37 3.28 0.68 5.51 0.00 -1.26 -1.52 121.76 128.81 3h7h s ALA 217 Ca -0.18 -3.26 -0.16 0.00 0.00 0.00 0.00 51.96 48.36 3h7h s ALA 217 Cb -0.18 -2.15 0.01 0.00 0.00 0.00 0.00 23.12 20.81 3h7h s ALA 217 CO 0.08 -2.02 1.20 -2.14 0.00 0.00 0.00 175.76 172.88 3h7h s PRO 218 N -0.29 2.45 0.23 0.00 0.02 -1.26 -4.91 135.00 131.23 3h7h s PRO 218 Ca 0.17 1.73 -0.08 0.00 0.02 0.00 0.00 61.00 62.85 3h7h s PRO 218 Cb -0.26 -1.87 0.37 0.00 0.02 0.00 0.00 34.50 32.76 3h7h s PRO 218 CO -0.00 -1.59 1.70 1.49 -0.33 0.00 0.00 177.00 178.26 3h7h h GLU 219 N 0.07 0.26 -0.42 5.54 4.57 -1.94 -2.95 114.58 119.70 3h7h h GLU 219 Ca -0.48 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 3h7h h GLU 219 Cb 1.29 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 3h7h h GLU 219 CO 0.52 0.17 0.00 0.72 -1.18 0.00 0.00 179.01 179.24 3h7h n HIS 220 N -5.14 0.56 -2.78 0.92 8.25 -1.26 -4.97 115.22 110.80 3h7h n HIS 220 Ca 0.11 -0.50 -0.40 0.00 -0.26 0.00 0.00 57.72 56.67 3h7h n HIS 220 Cb 0.38 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.42 3h7h n HIS 220 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3h7h s VAL 221 N -1.00 4.28 -0.09 1.59 1.01 -1.12 -5.05 120.40 120.03 3h7h s VAL 221 Ca 0.28 2.02 0.02 0.00 0.00 0.00 0.00 61.98 64.30 3h7h s VAL 221 Cb 0.15 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 32.24 3h7h s VAL 221 CO 0.19 0.43 -0.13 -0.54 0.00 0.00 0.00 175.10 175.05 3h7h s LYS 222 N -0.71 1.89 0.00 2.72 1.02 -1.26 -4.83 119.74 118.57 3h7h s LYS 222 Ca 0.42 -0.46 0.00 0.00 0.02 0.00 0.00 55.97 55.96 3h7h s LYS 222 Cb -0.24 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.45 3h7h s LYS 222 CO 0.30 -0.03 0.00 0.41 -0.92 0.00 0.00 175.35 175.11 3h7h n GLY 223 N 4.07 0.61 3.30 -3.33 0.00 -1.26 -5.03 105.19 103.55 3h7h n GLY 223 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 3h7h n GLY 223 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h7h s TYR 224 N -2.34 -0.22 0.32 1.61 2.02 -1.26 -0.84 117.35 116.64 3h7h s TYR 224 Ca 0.00 0.16 0.06 0.00 -0.37 0.00 0.00 57.07 56.92 3h7h s TYR 224 Cb 0.00 0.18 -0.06 0.00 -0.40 0.00 0.00 41.96 41.68 3h7h s TYR 224 CO 0.00 -0.55 -0.01 0.96 -1.57 0.00 0.00 175.55 174.38 3h7h s ILE 225 N -2.46 1.59 -0.11 2.71 -4.36 -0.29 -4.81 121.20 113.46 3h7h s ILE 225 Ca -0.05 -2.06 -0.00 0.00 -0.26 0.00 0.00 60.65 58.27 3h7h s ILE 225 Cb -0.01 -2.68 -0.02 0.00 1.25 0.00 0.00 42.46 41.00 3h7h s ILE 225 CO -0.02 -0.14 -0.10 -0.31 0.24 0.00 0.00 174.94 174.60 3h7h s TYR 226 N -3.03 2.86 -0.10 1.37 1.51 -0.58 -1.04 117.35 118.34 3h7h s TYR 226 Ca 0.33 -0.37 0.04 0.00 -1.01 0.00 0.00 57.07 56.06 3h7h s TYR 226 Cb 0.06 -1.81 0.00 0.00 -0.11 0.00 0.00 41.96 40.11 3h7h s TYR 226 CO 0.14 -0.01 -0.22 0.08 -1.11 0.00 0.00 175.55 174.43 3h7h s VAL 227 N -0.03 1.94 -0.18 0.71 1.01 0.75 -0.53 120.40 124.08 3h7h s VAL 227 Ca -0.02 -0.95 -0.17 0.00 0.00 0.00 0.00 61.98 60.85 3h7h s VAL 227 Cb -0.14 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 3h7h s VAL 227 CO 0.03 0.53 0.45 -0.70 0.00 0.00 0.00 175.10 175.42 3h7h s GLU 228 N 0.45 4.23 0.11 2.72 2.12 -0.01 -0.50 118.70 127.82 3h7h s GLU 228 Ca -0.17 0.33 -0.25 0.00 0.36 0.00 0.00 54.97 55.24 3h7h s GLU 228 Cb -0.17 -3.51 0.08 0.00 0.26 0.00 0.00 34.13 30.78 3h7h s GLU 228 CO 0.07 -0.01 0.66 0.00 -0.54 0.00 0.00 175.26 175.44 3h7h s ALA 229 N 1.19 -1.66 0.17 6.30 0.00 -0.32 -0.77 121.76 126.68 3h7h s ALA 229 Ca 0.22 0.66 -0.00 0.00 0.00 0.00 0.00 51.96 52.84 3h7h s ALA 229 Cb -0.15 0.71 0.03 0.00 0.00 0.00 0.00 23.12 23.71 3h7h s ALA 229 CO 0.09 -0.71 1.40 1.88 0.00 0.00 0.00 175.76 178.42 3h7h h TYR 230 N 2.10 0.45 -4.12 0.00 0.05 -1.85 -1.56 116.97 112.04 3h7h h TYR 230 Ca -0.31 -0.22 -0.50 0.00 0.05 0.00 0.00 58.73 57.75 3h7h h TYR 230 Cb 1.28 -0.06 -0.26 0.00 1.01 0.00 0.00 36.73 38.70 3h7h h TYR 230 CO 0.25 1.00 -0.81 0.15 -1.05 0.00 0.00 178.16 177.69 3h7h s LYS 231 N -3.43 1.13 0.33 4.88 1.02 -1.26 -4.74 119.74 117.68 3h7h s LYS 231 Ca -0.05 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.24 3h7h s LYS 231 Cb 0.10 -1.16 0.69 0.00 -0.52 0.00 0.00 37.83 36.95 3h7h s LYS 231 CO 0.84 0.30 1.90 0.37 -0.92 0.00 0.00 175.35 177.83 3h7h h GLN 232 N 5.12 0.81 -0.57 1.68 4.15 -2.00 -2.00 115.11 122.30 3h7h h GLN 232 Ca -0.39 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.00 3h7h h GLN 232 Cb 1.17 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 28.65 3h7h h GLN 232 CO 0.45 0.53 0.38 0.00 -1.93 0.00 0.00 178.83 178.26 3h7h h THR 233 N 0.83 1.13 -0.74 2.39 1.03 -1.99 -0.72 112.91 114.83 3h7h h THR 233 Ca 0.41 -0.26 -0.01 0.00 -0.01 0.00 0.00 66.41 66.54 3h7h h THR 233 Cb 0.45 0.32 -0.04 0.00 -1.07 0.00 0.00 68.15 67.82 3h7h h THR 233 CO -0.17 0.14 0.42 0.45 -0.01 0.00 0.00 175.52 176.34 3h7h h HIS 234 N 0.75 1.00 0.11 0.00 3.86 -1.78 -0.28 115.15 118.82 3h7h h HIS 234 Ca 0.21 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 3h7h h HIS 234 Cb -0.05 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.09 3h7h h HIS 234 CO -0.00 0.69 -0.05 0.28 0.86 0.00 0.00 177.93 179.70 3h7h h VAL 235 N 1.04 1.00 -0.48 2.45 2.07 -1.13 -1.96 116.25 119.23 3h7h h VAL 235 Ca 0.26 -0.42 0.08 0.00 0.82 0.00 0.00 66.70 67.44 3h7h h VAL 235 Cb 0.01 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 3h7h h VAL 235 CO -0.04 0.10 0.11 0.50 0.02 0.00 0.00 177.57 178.26 3h7h h LYS 236 N -0.35 0.25 -0.57 1.57 3.64 -1.15 -1.08 116.57 118.88 3h7h h LYS 236 Ca -0.02 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3h7h h LYS 236 Cb 0.29 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 3h7h h LYS 236 CO 0.03 0.16 0.20 1.96 -2.27 0.00 0.00 179.45 179.53 3h7h h GLN 237 N 0.25 0.84 -0.29 1.90 4.20 -1.00 -2.28 115.11 118.73 3h7h h GLN 237 Ca 0.24 -0.14 -0.15 0.00 0.06 0.00 0.00 58.65 58.66 3h7h h GLN 237 Cb 0.30 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 3h7h h GLN 237 CO -0.30 0.71 -0.44 0.00 -0.67 0.00 0.00 178.83 178.12 3h7h h ALA 238 N 1.40 0.68 -0.01 3.87 0.00 -0.50 -3.23 119.26 121.48 3h7h h ALA 238 Ca 0.19 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3h7h h ALA 238 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h7h h ALA 238 CO -0.01 0.67 -0.22 0.44 0.00 0.00 0.00 179.25 180.12 3h7h n ILE 239 N -4.02 0.00 -1.69 0.00 -5.35 -0.50 -4.87 119.36 102.93 3h7h n ILE 239 Ca -0.02 -0.14 -0.44 0.00 -0.27 0.00 0.00 62.75 61.88 3h7h n ILE 239 Cb 0.56 0.37 -0.03 0.00 -1.74 0.00 0.00 39.64 38.80 3h7h n ILE 239 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 3h7h n GLU 240 N -0.59 2.27 -0.31 6.28 0.00 -0.88 -1.71 120.64 125.70 3h7h n GLU 240 Ca 0.13 0.81 0.00 0.00 0.00 0.00 0.00 57.16 58.10 3h7h n GLU 240 Cb 0.34 -2.55 0.00 0.00 0.00 0.00 0.00 31.44 29.23 3h7h n GLU 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h7h n GLY 241 N 2.84 2.09 3.48 8.31 0.00 -1.26 -4.98 105.19 115.67 3h7h n GLY 241 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 3h7h n GLY 241 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h7h s VAL 242 N -3.21 4.46 0.23 1.61 1.01 -0.69 -4.93 120.40 118.87 3h7h s VAL 242 Ca 0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.75 3h7h s VAL 242 Cb 0.00 -4.56 0.19 0.00 0.00 0.00 0.00 36.38 32.02 3h7h s VAL 242 CO 0.00 -1.20 1.72 1.23 0.00 0.00 0.00 175.10 176.84 3h7h h GLY 243 N 10.87 0.95 2.00 4.51 0.00 -1.94 -1.02 103.07 118.45 3h7h h GLY 243 Ca -0.28 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3h7h h GLY 243 CO 1.11 -0.11 0.00 3.43 0.00 0.00 0.00 176.54 180.97 3h7h h ASN 244 N 0.35 0.00 -0.52 0.19 2.35 -1.97 -2.37 115.58 113.61 3h7h h ASN 244 Ca 0.36 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.11 3h7h h ASN 244 Cb 0.55 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.92 3h7h h ASN 244 CO -0.41 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.55 3h7h n LEU 245 N -3.03 3.39 -0.06 1.61 4.77 -0.39 -0.93 117.00 122.36 3h7h n LEU 245 Ca -0.03 -1.98 0.07 0.00 -0.03 0.00 0.00 56.01 54.05 3h7h n LEU 245 Cb 0.09 -0.35 0.44 0.00 -2.33 0.00 0.00 43.42 41.27 3h7h n LEU 245 CO 0.20 0.84 1.18 0.08 -1.33 0.00 0.00 177.39 178.36 3h7h h ARG 246 N 3.10 0.52 0.00 3.23 0.11 -1.35 0.49 114.38 120.48 3h7h h ARG 246 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 3h7h h ARG 246 Cb 0.85 -0.12 0.00 0.00 1.11 0.00 0.00 29.97 31.81 3h7h h ARG 246 CO 0.00 0.34 0.00 1.28 0.10 0.00 0.00 179.97 181.69 3h7h n LEU 247 N -4.47 0.00 -0.96 0.08 4.77 -1.26 -2.77 117.00 112.39 3h7h n LEU 247 Ca 0.07 0.23 0.08 0.00 -0.03 0.00 0.00 56.01 56.37 3h7h n LEU 247 Cb 0.20 -0.23 0.23 0.00 -2.33 0.00 0.00 43.42 41.29 3h7h n LEU 247 CO 0.34 -0.00 0.70 0.61 -1.33 0.00 0.00 177.39 177.71 3h7h n GLY 248 N 1.21 2.68 0.20 -0.72 0.00 0.14 -4.70 105.19 103.99 3h7h n GLY 248 Ca 0.16 -0.57 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 3h7h n GLY 248 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3h7h h TYR 249 N 3.01 0.94 0.00 1.61 3.20 -1.31 -3.33 116.97 121.09 3h7h h TYR 249 Ca 0.00 -0.48 -0.16 0.00 3.14 0.00 0.00 58.73 61.23 3h7h h TYR 249 Cb 0.86 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 3h7h h TYR 249 CO 0.35 1.31 -0.91 -1.49 -1.64 0.00 0.00 178.16 175.78 3h7h h TRP 250 N 0.40 0.00 -3.57 -3.82 -0.00 -1.84 -3.46 115.95 103.67 3h7h h TRP 250 Ca -0.09 0.00 -0.29 0.00 -0.00 0.00 0.00 58.89 58.51 3h7h h TRP 250 Cb 1.56 0.00 -0.33 0.00 -0.00 0.00 0.00 29.16 30.40 3h7h h TRP 250 CO 0.09 0.69 -0.73 -0.80 -0.00 0.00 0.00 178.44 177.69 3h7h s ASN 251 N -6.36 0.06 -0.01 -3.49 0.01 -1.25 -5.13 114.94 98.76 3h7h s ASN 251 Ca 0.01 0.03 0.06 0.00 -0.71 0.00 0.00 52.86 52.25 3h7h s ASN 251 Cb 0.08 -0.06 -0.01 0.00 0.41 0.00 0.00 41.25 41.67 3h7h s ASN 251 CO 0.78 -0.10 -0.18 -1.10 -1.51 0.00 0.00 177.10 174.99 3h7h s GLN 252 N 0.84 1.47 -0.14 -0.60 1.11 -1.26 -4.77 119.66 116.32 3h7h s GLN 252 Ca -0.07 -0.65 -0.06 0.00 0.01 0.00 0.00 55.36 54.60 3h7h s GLN 252 Cb -0.10 -1.42 -0.04 0.00 -1.01 0.00 0.00 33.01 30.44 3h7h s GLN 252 CO -0.02 0.39 0.07 -0.65 0.01 0.00 0.00 175.29 175.08 3h7h s GLN 253 N -0.41 3.54 0.22 2.91 -0.21 -1.14 -4.90 119.66 119.67 3h7h s GLN 253 Ca 0.07 -0.30 -0.30 0.00 0.02 0.00 0.00 55.36 54.85 3h7h s GLN 253 Cb -0.07 -3.09 -0.08 0.00 1.00 0.00 0.00 33.01 30.77 3h7h s GLN 253 CO -0.01 0.54 1.08 1.41 -2.12 0.00 0.00 175.29 176.20 3h7h s MET 254 N -0.39 4.64 -0.03 2.91 -2.45 -1.26 -0.55 119.30 122.17 3h7h s MET 254 Ca 0.09 1.72 -0.30 0.00 -1.25 0.00 0.00 55.69 55.96 3h7h s MET 254 Cb -0.12 -3.25 -0.04 0.00 1.25 0.00 0.00 34.83 32.68 3h7h s MET 254 CO 0.02 0.17 1.20 0.08 1.05 0.00 0.00 175.02 177.54 3h7h s VAL 255 N -0.66 4.21 0.31 10.11 1.01 0.22 -4.91 120.40 130.69 3h7h s VAL 255 Ca 0.47 1.55 -0.29 0.00 0.00 0.00 0.00 61.98 63.71 3h7h s VAL 255 Cb -0.30 -3.99 -0.13 0.00 0.00 0.00 0.00 36.38 31.96 3h7h s VAL 255 CO 0.37 0.02 1.31 -2.65 0.00 0.00 0.00 175.10 174.15 3h7h n PRO 256 N 4.93 2.07 -0.32 2.72 -0.02 -1.26 -4.68 135.00 138.43 3h7h n PRO 256 Ca 0.11 0.73 0.05 0.00 -2.02 0.00 0.00 63.50 62.36 3h7h n PRO 256 Cb 0.46 -2.32 0.20 0.00 -0.02 0.00 0.00 33.50 31.83 3h7h n PRO 256 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3h7h h ILE 257 N 2.65 0.91 0.00 4.25 2.04 -1.97 -0.40 117.51 124.98 3h7h h ILE 257 Ca -0.45 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.11 3h7h h ILE 257 Cb 1.28 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 3h7h h ILE 257 CO 0.66 0.16 0.00 0.11 0.00 0.00 0.00 178.15 179.08 3h7h h LYS 258 N 0.88 0.00 -0.33 2.37 1.57 -2.04 -2.13 116.57 116.88 3h7h h LYS 258 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 3h7h h LYS 258 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3h7h h LYS 258 CO -0.26 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.01 3h7h n GLU 259 N -2.88 2.47 -0.01 3.15 1.02 -0.17 -4.62 120.64 119.61 3h7h n GLU 259 Ca -0.02 -2.23 -0.01 0.00 -0.02 0.00 0.00 57.16 54.88 3h7h n GLU 259 Cb 0.10 -1.50 0.26 0.00 -0.02 0.00 0.00 31.44 30.28 3h7h n GLU 259 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 3h7h h MET 260 N 4.48 0.54 0.00 3.49 2.86 -1.33 -2.27 114.93 122.70 3h7h h MET 260 Ca 0.00 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.47 3h7h h MET 260 Cb 0.99 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 3h7h h MET 260 CO 0.00 0.61 -0.18 1.79 1.06 0.00 0.00 176.91 180.19 3h7h h THR 261 N 0.50 0.35 0.00 2.22 1.35 -1.83 -2.93 112.91 112.58 3h7h h THR 261 Ca 0.10 -1.22 -0.03 0.00 -0.55 0.00 0.00 66.41 64.71 3h7h h THR 261 Cb 0.42 1.94 -0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3h7h h THR 261 CO 0.02 0.17 -0.14 0.44 -0.25 0.00 0.00 175.52 175.77 3h7h h ASP 262 N 0.00 0.00 -0.43 5.36 3.32 -1.72 -1.51 116.42 121.44 3h7h h ASP 262 Ca -0.00 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 3h7h h ASP 262 Cb 0.93 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 3h7h h ASP 262 CO 0.02 0.14 0.29 0.58 -1.72 0.00 0.00 179.24 178.55 3h7h h VAL 263 N 0.00 0.93 -0.38 -1.35 2.07 -1.50 -2.60 116.25 113.42 3h7h h VAL 263 Ca -0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3h7h h VAL 263 Cb 0.25 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3h7h h VAL 263 CO 0.02 0.05 0.00 0.18 0.02 0.00 0.00 177.57 177.84 3h7h n LEU 264 N -4.47 3.07 -4.75 2.57 4.77 -0.61 -4.76 117.00 112.82 3h7h n LEU 264 Ca 0.06 -1.76 -0.41 0.00 -0.03 0.00 0.00 56.01 53.87 3h7h n LEU 264 Cb 0.29 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.09 3h7h n LEU 264 CO 0.35 0.73 0.80 -0.75 -1.33 0.00 0.00 177.39 177.18 3h7h s LYS 265 N -1.07 4.61 -0.07 3.23 2.20 -0.94 -5.05 119.74 122.64 3h7h s LYS 265 Ca 0.29 1.75 0.02 0.00 -0.36 0.00 0.00 55.97 57.67 3h7h s LYS 265 Cb 0.16 -3.24 0.02 0.00 -1.51 0.00 0.00 37.83 33.25 3h7h s LYS 265 CO 0.22 0.12 -0.11 0.08 -0.36 0.00 0.00 175.35 175.29 3h7h s VAL 266 N -0.57 1.12 -0.10 4.02 1.01 -1.26 -5.00 120.40 119.62 3h7h s VAL 266 Ca 0.48 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 62.03 3h7h s VAL 266 Cb -0.30 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 3h7h s VAL 266 CO 0.37 0.36 -0.17 0.68 0.00 0.00 0.00 175.10 176.34 3h7h s VAL 267 N 0.83 2.72 -0.19 2.92 -7.23 -1.26 -5.11 120.40 113.08 3h7h s VAL 267 Ca -0.11 -0.80 0.01 0.00 -1.81 0.00 0.00 61.98 59.26 3h7h s VAL 267 Cb -0.15 -2.09 0.04 0.00 0.56 0.00 0.00 36.38 34.74 3h7h s VAL 267 CO 0.02 0.55 -0.12 -0.54 -0.31 0.00 0.00 175.10 174.69 3h7h s LYS 268 N 0.05 2.22 0.00 4.82 -0.14 -1.26 -5.23 119.74 120.20 3h7h s LYS 268 Ca -0.07 -0.82 0.31 0.00 -1.36 0.00 0.00 55.97 54.03 3h7h s LYS 268 Cb -0.15 -2.40 1.84 0.00 -1.68 0.00 0.00 37.83 35.44 3h7h s LYS 268 CO 0.05 -0.37 2.17 0.39 -0.76 0.00 0.00 175.35 176.83