#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxd n SER 165 N 0.00 2.02 0.00 1.61 7.64 -1.26 -1.82 113.62 121.81 1sxd n SER 165 Ca 0.00 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1sxd n SER 165 Cb 0.00 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 61.80 1sxd n SER 165 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1sxd n HIS 166 N 13.36 0.00 1.21 1.43 -0.00 -1.26 -4.71 115.22 125.25 1sxd n HIS 166 Ca 0.42 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 58.27 1sxd n HIS 166 Cb 0.38 -0.62 0.28 0.00 -0.00 0.00 0.00 29.99 30.03 1sxd n HIS 166 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1sxd n MET 167 N -2.00 2.01 -0.10 1.57 1.56 -0.76 -4.50 117.12 114.90 1sxd n MET 167 Ca 0.00 -1.49 -0.11 0.00 -0.27 0.00 0.00 57.70 55.83 1sxd n MET 167 Cb 0.00 -1.47 -0.05 0.00 2.15 0.00 0.00 33.22 33.85 1sxd n MET 167 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1sxd h ALA 168 N 4.53 -0.50 -0.26 -5.12 0.00 -1.78 0.27 119.26 116.40 1sxd h ALA 168 Ca 0.00 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1sxd h ALA 168 Cb 0.78 0.89 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1sxd h ALA 168 CO 0.00 -0.89 -0.24 0.00 0.00 0.00 0.00 179.25 178.11 1sxd h ALA 169 N 0.32 1.10 0.24 0.00 0.00 -1.91 -2.95 119.26 116.05 1sxd h ALA 169 Ca 0.12 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1sxd h ALA 169 Cb 0.60 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1sxd h ALA 169 CO -0.54 0.56 -0.12 1.25 0.00 0.00 0.00 179.25 180.40 1sxd h LEU 170 N 0.44 -0.28 -1.52 0.00 5.85 -1.39 -2.00 115.31 116.41 1sxd h LEU 170 Ca 0.07 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 1sxd h LEU 170 Cb 0.66 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1sxd h LEU 170 CO 0.05 0.18 0.26 1.05 -0.34 0.00 0.00 178.44 179.64 1sxd h GLU 171 N -0.83 0.58 0.23 1.25 4.11 -0.62 0.85 114.58 120.15 1sxd h GLU 171 Ca -0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.34 1sxd h GLU 171 Cb 0.51 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1sxd h GLU 171 CO 0.06 0.41 -0.11 0.78 0.07 0.00 0.00 179.01 180.22 1sxd h GLY 172 N 0.64 -0.32 1.11 1.06 0.00 -1.52 -2.61 103.07 101.43 1sxd h GLY 172 Ca 0.16 0.12 -0.16 0.00 0.00 0.00 0.00 47.33 47.45 1sxd h GLY 172 CO -0.03 -0.12 -0.40 -1.82 0.00 0.00 0.00 176.54 174.17 1sxd h TYR 173 N -0.48 1.08 -0.25 5.60 3.20 -0.70 -2.70 116.97 122.71 1sxd h TYR 173 Ca -0.03 -0.34 0.00 0.00 3.14 0.00 0.00 58.73 61.50 1sxd h TYR 173 Cb 0.36 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1sxd h TYR 173 CO -0.01 1.16 0.16 0.07 -1.64 0.00 0.00 178.16 177.90 1sxd h ARG 174 N 0.69 0.34 0.00 1.82 0.11 -0.94 0.55 114.38 116.94 1sxd h ARG 174 Ca 0.05 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 60.08 1sxd h ARG 174 Cb 1.00 -0.08 -0.00 0.00 1.11 0.00 0.00 29.97 32.00 1sxd h ARG 174 CO 0.10 0.23 -0.13 -0.22 0.10 0.00 0.00 179.97 180.04 1sxd h LYS 175 N 0.34 0.00 0.03 0.08 3.64 -1.14 -1.25 116.57 118.27 1sxd h LYS 175 Ca 0.09 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.36 1sxd h LYS 175 Cb -0.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1sxd h LYS 175 CO -0.02 0.13 -0.60 1.49 -2.27 0.00 0.00 179.45 178.19 1sxd h GLU 176 N 0.00 0.06 -0.32 1.90 4.57 -0.50 -3.33 114.58 116.97 1sxd h GLU 176 Ca -0.00 -0.10 0.07 0.00 -1.18 0.00 0.00 59.36 58.15 1sxd h GLU 176 Cb 0.47 0.04 -0.08 0.00 -0.16 0.00 0.00 28.75 29.01 1sxd h GLU 176 CO 0.02 1.05 -0.30 1.96 -1.18 0.00 0.00 179.01 180.56 1sxd h GLN 177 N -0.86 -0.26 0.00 1.92 4.20 0.17 -1.39 115.11 118.89 1sxd h GLN 177 Ca -0.15 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 1sxd h GLN 177 Cb 1.24 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.07 1sxd h GLN 177 CO -0.04 -0.17 -0.11 1.05 -0.67 0.00 0.00 178.83 178.89 1sxd h GLU 178 N -0.27 0.00 0.00 1.46 4.11 -1.42 0.74 114.58 119.19 1sxd h GLU 178 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.58 1sxd h GLU 178 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1sxd h GLU 178 CO -0.47 0.11 0.00 -0.09 0.07 0.00 0.00 179.01 178.63 1sxd h ARG 179 N 0.00 0.00 0.00 1.06 2.43 -1.38 -3.33 114.38 113.16 1sxd h ARG 179 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1sxd h ARG 179 Cb 0.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1sxd h ARG 179 CO 0.01 0.00 -0.32 1.28 -1.51 0.00 0.00 179.97 179.44 1sxd n LEU 180 N -2.71 0.00 0.00 3.80 4.77 0.34 -5.00 117.00 118.20 1sxd n LEU 180 Ca 0.03 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1sxd n LEU 180 Cb 0.37 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1sxd n LEU 180 CO 0.28 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1sxd n GLY 181 N 1.32 0.65 3.69 -0.72 0.00 0.23 -5.03 105.19 105.33 1sxd n GLY 181 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1sxd n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sxd s ILE 182 N -2.59 2.66 0.60 -0.61 1.01 -0.58 -4.97 121.20 116.73 1sxd s ILE 182 Ca 0.00 0.09 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 1sxd s ILE 182 Cb 0.00 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 1sxd s ILE 182 CO 0.00 -0.00 1.06 -2.16 0.00 0.00 0.00 174.94 173.84 1sxd s PRO 183 N 2.99 3.27 0.15 2.79 0.04 -1.26 -4.54 135.00 138.43 1sxd s PRO 183 Ca 0.81 1.20 -0.02 0.00 0.04 0.00 0.00 61.00 63.03 1sxd s PRO 183 Cb -0.45 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.04 1sxd s PRO 183 CO 0.37 -0.85 1.36 1.88 0.04 0.00 0.00 177.00 179.80 1sxd h TYR 184 N 0.34 0.51 -3.31 0.56 -1.99 -1.91 -3.44 116.97 107.73 1sxd h TYR 184 Ca -0.47 -0.26 -0.57 0.00 2.00 0.00 0.00 58.73 59.44 1sxd h TYR 184 Cb 1.22 -0.06 -0.05 0.00 2.00 0.00 0.00 36.73 39.84 1sxd h TYR 184 CO 0.59 1.06 0.00 0.34 -0.00 0.00 0.00 178.16 180.15 1sxd s ASP 185 N -7.01 7.02 0.38 3.88 2.15 -1.26 -3.83 116.67 117.99 1sxd s ASP 185 Ca -0.05 1.21 0.10 0.00 0.43 0.00 0.00 52.55 54.24 1sxd s ASP 185 Cb 0.10 -2.38 0.74 0.00 -0.30 0.00 0.00 42.92 41.08 1sxd s ASP 185 CO 0.85 0.12 1.88 1.55 -0.17 0.00 0.00 175.17 179.40 1sxd h PRO 186 N 5.46 0.18 0.00 4.34 0.13 -1.91 -3.05 132.00 137.15 1sxd h PRO 186 Ca -0.46 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 1sxd h PRO 186 Cb 1.20 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1sxd h PRO 186 CO 0.69 0.39 -0.16 0.97 -0.23 0.00 0.00 178.00 179.66 1sxd h ILE 187 N 0.17 0.47 -0.36 -3.56 2.10 -1.94 -2.10 117.51 112.29 1sxd h ILE 187 Ca 0.03 -0.85 0.00 0.00 1.08 0.00 0.00 64.86 65.12 1sxd h ILE 187 Cb 0.47 1.60 0.00 0.00 -1.09 0.00 0.00 36.82 37.80 1sxd h ILE 187 CO 0.03 0.16 0.00 1.41 -1.08 0.00 0.00 178.15 178.67 1sxd n HIS 188 N -3.41 0.46 -1.99 2.19 8.25 -1.15 -1.58 115.22 117.99 1sxd n HIS 188 Ca -0.00 -0.23 -0.37 0.00 -0.26 0.00 0.00 57.72 56.85 1sxd n HIS 188 Cb 0.35 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.49 1sxd n HIS 188 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1sxd s TRP 189 N -1.54 2.49 0.24 4.41 0.51 -0.79 -4.82 118.94 119.44 1sxd s TRP 189 Ca 0.38 1.46 -0.01 0.00 -2.12 0.00 0.00 56.10 55.80 1sxd s TRP 189 Cb 0.22 -3.59 -0.04 0.00 -0.81 0.00 0.00 33.47 29.24 1sxd s TRP 189 CO 0.30 -2.30 0.45 0.45 -0.51 0.00 0.00 176.95 175.34 1sxd s SER 190 N -1.25 6.39 0.29 2.95 0.15 -1.26 0.22 113.70 121.19 1sxd s SER 190 Ca 0.71 0.47 0.04 0.00 0.70 0.00 0.00 55.95 57.87 1sxd s SER 190 Cb -0.34 -2.04 0.76 0.00 -1.71 0.00 0.00 66.02 62.69 1sxd s SER 190 CO 0.40 -0.11 1.66 0.74 1.20 0.00 0.00 173.24 177.13 1sxd h THR 191 N 1.40 0.34 0.24 6.45 2.02 -1.91 0.40 112.91 121.85 1sxd h THR 191 Ca -0.48 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 1sxd h THR 191 Cb 1.19 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1sxd h THR 191 CO 0.67 0.05 -0.11 0.44 0.37 0.00 0.00 175.52 176.93 1sxd h ASP 192 N 0.25 -0.27 -0.07 4.18 5.19 -1.95 -2.65 116.42 121.11 1sxd h ASP 192 Ca 0.58 -0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.90 1sxd h ASP 192 Cb 1.17 0.07 -0.01 0.00 0.18 0.00 0.00 39.33 40.74 1sxd h ASP 192 CO -0.63 -0.15 -0.10 1.56 -3.12 0.00 0.00 179.24 176.80 1sxd h GLN 193 N -0.37 0.36 -0.71 3.56 4.20 -1.10 0.94 115.11 121.98 1sxd h GLN 193 Ca -0.03 -0.09 0.10 0.00 0.06 0.00 0.00 58.65 58.69 1sxd h GLN 193 Cb 0.28 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 27.94 1sxd h GLN 193 CO 0.05 0.47 0.34 0.28 -0.67 0.00 0.00 178.83 179.31 1sxd h VAL 194 N 0.34 0.81 -0.01 -0.54 2.07 -0.16 -0.95 116.25 117.82 1sxd h VAL 194 Ca 0.07 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1sxd h VAL 194 Cb 0.39 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1sxd h VAL 194 CO 0.02 0.10 -0.53 0.18 0.02 0.00 0.00 177.57 177.37 1sxd n LEU 195 N -4.89 1.36 -0.10 2.57 4.77 -0.63 -2.12 117.00 117.95 1sxd n LEU 195 Ca 0.11 -0.48 -0.10 0.00 -0.03 0.00 0.00 56.01 55.52 1sxd n LEU 195 Cb 0.30 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1sxd n LEU 195 CO 0.24 0.27 0.84 0.45 -1.33 0.00 0.00 177.39 177.86 1sxd h HIS 196 N 1.30 0.52 0.65 -1.77 3.86 0.14 -1.88 115.15 117.97 1sxd h HIS 196 Ca 0.00 -0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 1sxd h HIS 196 Cb 0.60 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.92 1sxd h HIS 196 CO 0.00 0.55 -0.41 2.35 0.86 0.00 0.00 177.93 181.27 1sxd h TRP 197 N 0.34 -1.11 -0.91 2.45 7.01 -1.20 -0.74 115.95 121.81 1sxd h TRP 197 Ca 0.10 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.16 1sxd h TRP 197 Cb 0.29 0.40 -0.06 0.00 -2.10 0.00 0.00 29.16 27.68 1sxd h TRP 197 CO 0.01 -0.61 0.59 0.28 -2.79 0.00 0.00 178.44 175.92 1sxd h VAL 198 N -1.00 1.05 -0.05 2.65 2.07 -1.49 0.52 116.25 120.01 1sxd h VAL 198 Ca -0.09 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 1sxd h VAL 198 Cb 0.80 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1sxd h VAL 198 CO 0.08 0.19 -0.11 0.58 0.02 0.00 0.00 177.57 178.32 1sxd h VAL 199 N 1.01 1.43 -0.26 2.57 2.07 -1.34 -0.10 116.25 121.64 1sxd h VAL 199 Ca 0.39 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 1sxd h VAL 199 Cb 0.22 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 1sxd h VAL 199 CO -0.15 0.40 0.10 -0.25 0.02 0.00 0.00 177.57 177.69 1sxd h TRP 200 N -0.35 0.40 0.00 1.57 7.01 -0.75 -1.84 115.95 121.98 1sxd h TRP 200 Ca 0.00 -0.03 -0.11 0.00 2.11 0.00 0.00 58.89 60.86 1sxd h TRP 200 Cb 0.70 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.63 1sxd h TRP 200 CO 0.12 0.41 -0.51 0.28 -2.79 0.00 0.00 178.44 175.95 1sxd h VAL 201 N 0.27 1.09 0.00 2.65 2.07 -0.03 -1.20 116.25 121.10 1sxd h VAL 201 Ca 0.09 -1.95 -0.03 0.00 0.82 0.00 0.00 66.70 65.62 1sxd h VAL 201 Cb 0.18 2.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1sxd h VAL 201 CO -0.01 0.50 -0.17 0.00 0.02 0.00 0.00 177.57 177.92 1sxd h MET 202 N 0.00 0.00 0.08 1.57 -0.00 -0.90 -3.23 114.93 112.46 1sxd h MET 202 Ca -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.69 1sxd h MET 202 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.70 1sxd h MET 202 CO 0.07 0.17 -0.04 -0.22 -0.00 0.00 0.00 176.91 176.88 1sxd h LYS 203 N 0.00 -0.11 -0.20 -0.10 3.64 -0.35 0.94 116.57 120.39 1sxd h LYS 203 Ca -0.00 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1sxd h LYS 203 Cb 0.67 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.44 1sxd h LYS 203 CO 0.02 0.27 -0.33 1.49 -2.27 0.00 0.00 179.45 178.63 1sxd h GLU 204 N -0.51 -0.35 -0.64 1.90 4.22 -1.46 -0.95 114.58 116.78 1sxd h GLU 204 Ca -0.01 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.45 1sxd h GLU 204 Cb 0.43 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1sxd h GLU 204 CO 0.02 -0.24 0.00 1.19 -2.18 0.00 0.00 179.01 177.80 1sxd n PHE 205 N -5.41 1.22 -3.72 0.92 3.72 -1.25 -4.91 117.46 108.02 1sxd n PHE 205 Ca -0.02 -0.46 -0.23 0.00 -0.05 0.00 0.00 57.45 56.68 1sxd n PHE 205 Cb 0.33 -0.26 0.04 0.00 -0.94 0.00 0.00 39.48 38.66 1sxd n PHE 205 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1sxd n SER 206 N 0.66 -2.60 -1.82 4.37 7.64 -0.36 -4.88 113.62 116.63 1sxd n SER 206 Ca 0.19 -0.77 -0.13 0.00 1.01 0.00 0.00 58.87 59.17 1sxd n SER 206 Cb 0.76 -4.20 0.22 0.00 -1.01 0.00 0.00 64.21 59.98 1sxd n SER 206 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1sxd n MET 207 N -4.42 2.52 -0.59 1.43 2.81 0.32 -4.89 117.12 114.30 1sxd n MET 207 Ca -0.19 -3.07 -0.44 0.00 -1.81 0.00 0.00 57.70 52.19 1sxd n MET 207 Cb 0.63 -2.08 -0.11 0.00 -0.71 0.00 0.00 33.22 30.95 1sxd n MET 207 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1sxd n THR 208 N -0.88 0.21 -1.60 2.03 5.66 -1.13 -3.02 114.28 115.54 1sxd n THR 208 Ca 0.47 -0.18 -0.02 0.00 -3.05 0.00 0.00 64.05 61.26 1sxd n THR 208 Cb 1.40 -2.04 -0.02 0.00 -1.55 0.00 0.00 70.33 68.13 1sxd n THR 208 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1sxd n ASP 209 N 8.98 -0.28 -4.80 1.09 2.03 -1.26 -5.13 116.55 117.18 1sxd n ASP 209 Ca 0.47 -0.64 -0.28 0.00 0.52 0.00 0.00 54.79 54.86 1sxd n ASP 209 Cb 0.42 0.08 -0.06 0.00 -0.72 0.00 0.00 41.12 40.85 1sxd n ASP 209 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1sxd s ILE 210 N 0.00 4.60 -0.53 5.18 -5.25 -1.17 -5.04 121.20 119.00 1sxd s ILE 210 Ca 0.00 -0.91 -0.27 0.00 -0.99 0.00 0.00 60.65 58.48 1sxd s ILE 210 Cb 0.00 -3.30 -0.01 0.00 2.95 0.00 0.00 42.46 42.10 1sxd s ILE 210 CO 0.00 -0.01 1.76 -1.81 -1.79 0.00 0.00 174.94 173.09 1sxd s ASP 211 N -2.83 5.59 0.07 4.36 1.11 -1.26 -4.82 116.67 118.90 1sxd s ASP 211 Ca 0.31 0.58 -0.06 0.00 0.18 0.00 0.00 52.55 53.56 1sxd s ASP 211 Cb -0.11 -2.53 -0.29 0.00 1.07 0.00 0.00 42.92 41.06 1sxd s ASP 211 CO 0.23 -2.08 1.13 -0.07 1.18 0.00 0.00 175.17 175.57 1sxd h LEU 212 N 15.09 0.48 -1.46 1.23 3.38 -1.96 -3.34 115.31 128.72 1sxd h LEU 212 Ca -0.28 -0.51 -0.02 0.00 0.09 0.00 0.00 57.88 57.16 1sxd h LEU 212 Cb 1.15 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1sxd h LEU 212 CO 1.16 1.40 0.17 0.71 0.09 0.00 0.00 178.44 181.96 1sxd h THR 213 N 0.09 1.14 0.00 0.22 1.35 -1.99 -1.19 112.91 112.53 1sxd h THR 213 Ca -0.15 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1sxd h THR 213 Cb 1.99 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 1sxd h THR 213 CO 0.21 0.16 0.00 0.71 -0.25 0.00 0.00 175.52 176.36 1sxd h THR 214 N 0.53 0.00 -0.46 6.82 1.35 -1.92 -3.07 112.91 116.16 1sxd h THR 214 Ca 0.13 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 1sxd h THR 214 Cb 0.09 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1sxd h THR 214 CO -0.02 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.43 1sxd n LEU 215 N -2.93 4.51 -3.40 3.87 4.77 -0.51 -4.71 117.00 118.61 1sxd n LEU 215 Ca 0.04 -2.72 -0.39 0.00 -0.03 0.00 0.00 56.01 52.90 1sxd n LEU 215 Cb 0.48 -0.55 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1sxd n LEU 215 CO 0.32 0.71 3.23 -3.20 -1.33 0.00 0.00 177.39 177.12 1sxd n ASN 216 N 0.35 7.61 -3.77 -1.43 2.85 -0.85 -4.73 115.26 115.29 1sxd n ASN 216 Ca 0.23 -2.62 -0.18 0.00 -0.11 0.00 0.00 54.58 51.89 1sxd n ASN 216 Cb 0.92 -1.57 -0.09 0.00 1.24 0.00 0.00 39.78 40.28 1sxd n ASN 216 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 1sxd s ILE 217 N 2.44 0.15 0.65 -1.44 -4.36 -1.26 -5.08 121.20 112.29 1sxd s ILE 217 Ca 0.64 -2.00 -0.04 0.00 -0.26 0.00 0.00 60.65 59.00 1sxd s ILE 217 Cb 0.17 -2.49 0.05 0.00 1.25 0.00 0.00 42.46 41.44 1sxd s ILE 217 CO -0.06 0.00 0.92 -0.44 0.24 0.00 0.00 174.94 175.60 1sxd s SER 218 N -3.36 4.99 0.20 4.36 0.01 -1.26 -4.02 113.70 114.62 1sxd s SER 218 Ca 0.37 0.27 -0.11 0.00 1.31 0.00 0.00 55.95 57.80 1sxd s SER 218 Cb 0.04 -1.01 0.17 0.00 0.21 0.00 0.00 66.02 65.43 1sxd s SER 218 CO 0.21 -1.43 1.84 1.23 0.41 0.00 0.00 173.24 175.50 1sxd h GLY 219 N -0.34 0.94 2.00 3.44 0.00 -0.42 0.07 103.07 108.76 1sxd h GLY 219 Ca -0.43 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 46.58 1sxd h GLY 219 CO 0.57 0.25 -0.07 -0.09 0.00 0.00 0.00 176.54 177.20 1sxd h ARG 220 N 0.79 0.00 0.04 4.80 9.65 -1.49 0.79 114.38 128.96 1sxd h ARG 220 Ca 0.26 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 59.05 1sxd h ARG 220 Cb 0.03 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1sxd h ARG 220 CO -0.11 0.07 -0.39 0.93 2.80 0.00 0.00 179.97 183.28 1sxd h GLU 221 N 0.00 0.19 0.03 0.20 4.39 -1.58 -3.10 114.58 114.71 1sxd h GLU 221 Ca -0.00 -0.26 0.03 0.00 0.34 0.00 0.00 59.36 59.47 1sxd h GLU 221 Cb 0.13 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.82 1sxd h GLU 221 CO 0.01 1.05 -0.24 1.25 -1.16 0.00 0.00 179.01 179.92 1sxd h LEU 222 N -0.55 -0.69 -0.93 1.33 7.12 -0.26 -2.57 115.31 118.76 1sxd h LEU 222 Ca -0.06 0.09 0.00 0.00 0.13 0.00 0.00 57.88 58.04 1sxd h LEU 222 Cb 1.22 0.28 0.00 0.00 -0.53 0.00 0.00 40.66 41.63 1sxd h LEU 222 CO 0.07 -0.31 0.00 0.00 -0.13 0.00 0.00 178.44 178.07 1sxd n SER 224 N -2.68 0.38 -4.80 0.00 7.64 -0.98 -4.83 113.62 108.35 1sxd n SER 224 Ca 0.02 0.02 -0.38 0.00 1.01 0.00 0.00 58.87 59.54 1sxd n SER 224 Cb 0.30 -0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.44 1sxd n SER 224 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1sxd s LEU 225 N -3.14 4.39 0.78 -3.43 0.05 -1.11 -5.07 118.68 111.15 1sxd s LEU 225 Ca 0.11 0.81 -0.10 0.00 0.05 0.00 0.00 54.13 55.00 1sxd s LEU 225 Cb 0.17 -2.52 0.06 0.00 -2.05 0.00 0.00 46.19 41.86 1sxd s LEU 225 CO 0.65 0.24 1.09 0.20 -0.55 0.00 0.00 176.35 177.98 1sxd s ASN 226 N -0.49 4.40 0.53 1.48 0.01 -1.26 -4.83 114.94 114.78 1sxd s ASN 226 Ca 0.22 1.84 0.35 0.00 -0.71 0.00 0.00 52.86 54.56 1sxd s ASN 226 Cb -0.15 -2.52 1.52 0.00 0.41 0.00 0.00 41.25 40.51 1sxd s ASN 226 CO 0.10 -2.10 1.79 -0.61 -1.51 0.00 0.00 177.10 174.77 1sxd h GLN 227 N -1.18 0.03 0.10 -0.60 5.75 -1.98 -0.69 115.11 116.56 1sxd h GLN 227 Ca -0.44 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.06 1sxd h GLN 227 Cb 1.23 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.78 1sxd h GLN 227 CO 0.51 0.02 -0.05 1.49 -2.65 0.00 0.00 178.83 178.15 1sxd h GLU 228 N 0.04 -0.14 -0.04 1.69 4.81 -1.96 0.51 114.58 119.49 1sxd h GLU 228 Ca 0.58 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.83 1sxd h GLU 228 Cb 2.24 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 31.65 1sxd h GLU 228 CO -0.04 0.17 0.03 0.22 -0.73 0.00 0.00 179.01 178.66 1sxd h ASP 229 N -0.45 0.02 -0.03 1.04 3.58 -1.48 -0.64 116.42 118.47 1sxd h ASP 229 Ca -0.01 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.36 1sxd h ASP 229 Cb 0.37 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.42 1sxd h ASP 229 CO 0.02 0.02 -0.27 0.15 -2.88 0.00 0.00 179.24 176.28 1sxd h PHE 230 N 0.03 0.33 0.00 0.28 3.57 -1.04 -2.93 116.94 117.18 1sxd h PHE 230 Ca 0.02 -0.16 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1sxd h PHE 230 Cb 0.04 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1sxd h PHE 230 CO -0.00 0.91 0.00 1.19 -2.23 0.00 0.00 178.31 178.18 1sxd n PHE 231 N -4.49 0.00 -0.09 0.41 3.01 0.18 0.76 117.46 117.24 1sxd n PHE 231 Ca -0.09 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.14 1sxd n PHE 231 Cb 0.48 -0.27 -0.12 0.00 -0.01 0.00 0.00 39.48 39.57 1sxd n PHE 231 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1sxd n GLN 232 N -1.27 0.63 0.11 -1.08 1.13 -0.36 -2.86 117.38 113.70 1sxd n GLN 232 Ca 0.09 0.34 0.06 0.00 -1.94 0.00 0.00 57.00 55.55 1sxd n GLN 232 Cb 0.14 -1.63 0.52 0.00 0.11 0.00 0.00 30.24 29.38 1sxd n GLN 232 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1sxd h ARG 233 N -0.56 0.29 -0.27 -1.09 3.08 -1.11 -3.42 114.38 111.30 1sxd h ARG 233 Ca -0.50 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 59.68 1sxd h ARG 233 Cb 1.67 -0.07 -0.18 0.00 0.08 0.00 0.00 29.97 31.48 1sxd h ARG 233 CO -0.17 0.20 -0.10 0.54 -1.07 0.00 0.00 179.97 179.36 1sxd s VAL 234 N -5.30 -0.27 -0.44 2.04 0.11 0.23 -4.82 120.40 111.95 1sxd s VAL 234 Ca -0.07 0.00 0.25 0.00 -2.93 0.00 0.00 61.98 59.23 1sxd s VAL 234 Cb 0.17 -0.09 0.33 0.00 -1.53 0.00 0.00 36.38 35.26 1sxd s VAL 234 CO 0.71 0.00 1.68 -0.65 -3.33 0.00 0.00 175.10 173.51 1sxd h PRO 235 N 6.13 0.00 -1.04 1.54 0.11 -1.66 -3.29 132.00 133.80 1sxd h PRO 235 Ca -0.05 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 65.69 1sxd h PRO 235 Cb 1.21 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 32.11 1sxd h PRO 235 CO -0.07 0.00 0.47 2.89 -0.21 0.00 0.00 178.00 181.08 1sxd n ARG 236 N -2.93 1.90 -0.54 1.05 -4.01 -1.26 -4.29 116.66 106.58 1sxd n ARG 236 Ca 0.04 -2.10 0.04 0.00 -1.04 0.00 0.00 57.85 54.79 1sxd n ARG 236 Cb 0.48 -1.82 0.20 0.00 -3.04 0.00 0.00 32.46 28.28 1sxd n ARG 236 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1sxd n GLY 237 N -0.58 4.77 0.36 2.89 0.00 -1.25 -4.73 105.19 106.65 1sxd n GLY 237 Ca 0.42 -1.19 0.09 0.00 0.00 0.00 0.00 46.02 45.34 1sxd n GLY 237 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1sxd h GLU 238 N 0.97 0.86 -0.01 1.61 4.11 -1.90 -1.34 114.58 118.88 1sxd h GLU 238 Ca 0.08 -0.05 -0.09 0.00 0.07 0.00 0.00 59.36 59.38 1sxd h GLU 238 Cb 1.34 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1sxd h GLU 238 CO 0.19 0.57 -0.39 0.97 0.07 0.00 0.00 179.01 180.42 1sxd h ILE 239 N 0.89 1.29 0.69 -1.06 -0.00 -1.96 -2.66 117.51 114.69 1sxd h ILE 239 Ca 0.51 -1.37 -0.03 0.00 -0.00 0.00 0.00 64.86 63.96 1sxd h ILE 239 Cb 0.63 1.72 0.01 0.00 -0.00 0.00 0.00 36.82 39.18 1sxd h ILE 239 CO -0.28 0.39 -0.33 -0.07 -0.00 0.00 0.00 178.15 177.86 1sxd h LEU 240 N 0.02 -0.78 -1.54 2.19 3.38 -1.60 -2.82 115.31 114.16 1sxd h LEU 240 Ca -0.00 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.05 1sxd h LEU 240 Cb 0.71 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 1sxd h LEU 240 CO 0.05 -0.54 0.39 -0.50 0.09 0.00 0.00 178.44 177.93 1sxd h TRP 241 N -0.95 0.57 -0.37 1.13 4.06 -1.42 -0.73 115.95 118.25 1sxd h TRP 241 Ca -0.09 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.87 1sxd h TRP 241 Cb 0.72 -0.19 -0.02 0.00 -1.00 0.00 0.00 29.16 28.67 1sxd h TRP 241 CO -0.02 0.31 0.24 1.03 -3.56 0.00 0.00 178.44 176.43 1sxd h SER 242 N 0.57 0.43 0.36 -3.49 0.87 -1.35 0.42 113.55 111.36 1sxd h SER 242 Ca 0.26 -0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.72 1sxd h SER 242 Cb 0.29 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1sxd h SER 242 CO -0.08 0.33 -0.35 -0.74 -0.53 0.00 0.00 176.83 175.47 1sxd h HIS 243 N 0.49 0.00 -0.14 2.24 -0.00 -1.03 -2.62 115.15 114.09 1sxd h HIS 243 Ca 0.13 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.39 1sxd h HIS 243 Cb -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.37 1sxd h HIS 243 CO -0.05 0.35 -0.37 1.25 -0.00 0.00 0.00 177.93 179.11 1sxd h LEU 244 N 0.00 0.57 -1.27 0.26 5.85 0.16 0.18 115.31 121.06 1sxd h LEU 244 Ca -0.00 -0.58 0.06 0.00 0.84 0.00 0.00 57.88 58.20 1sxd h LEU 244 Cb 0.62 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 1sxd h LEU 244 CO 0.04 1.06 0.53 -0.33 -0.34 0.00 0.00 178.44 179.40 1sxd h GLU 245 N 0.12 0.86 -0.03 1.25 5.08 -0.12 -1.20 114.58 120.54 1sxd h GLU 245 Ca -0.01 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 1sxd h GLU 245 Cb 0.99 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 1sxd h GLU 245 CO 0.08 0.57 -0.65 1.25 -1.00 0.00 0.00 179.01 179.26 1sxd h LEU 246 N 0.88 0.15 0.62 1.33 5.85 -1.18 -1.20 115.31 121.75 1sxd h LEU 246 Ca 0.35 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.95 1sxd h LEU 246 Cb 0.23 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 1sxd h LEU 246 CO -0.12 0.75 -0.35 -0.07 -0.34 0.00 0.00 178.44 178.31 1sxd h LEU 247 N 0.09 -0.88 0.00 2.25 3.38 0.49 -1.53 115.31 119.12 1sxd h LEU 247 Ca -0.01 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1sxd h LEU 247 Cb 1.16 0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1sxd h LEU 247 CO 0.09 -0.57 0.00 -2.11 0.09 0.00 0.00 178.44 175.95 1sxd n ARG 248 N -5.50 0.55 0.01 1.13 1.85 -0.63 -2.15 116.66 111.92 1sxd n ARG 248 Ca -0.13 0.03 -0.10 0.00 -1.00 0.00 0.00 57.85 56.65 1sxd n ARG 248 Cb 0.39 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.16 1sxd n ARG 248 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 1sxd h LYS 249 N 0.00 0.05 -1.90 2.89 1.79 -0.78 -3.35 116.57 115.28 1sxd h LYS 249 Ca 0.00 -0.09 -0.56 0.00 -2.18 0.00 0.00 60.65 57.83 1sxd h LYS 249 Cb 0.10 0.03 -0.42 0.00 -1.58 0.00 0.00 32.23 30.37 1sxd h LYS 249 CO 0.00 0.72 -0.79 0.66 -1.08 0.00 0.00 179.45 178.96 1sxd n TYR 250 N -3.19 3.11 0.46 -1.35 4.01 -0.61 -4.76 117.16 114.83 1sxd n TYR 250 Ca -0.14 -3.60 0.06 0.00 -0.16 0.00 0.00 57.90 54.06 1sxd n TYR 250 Cb 1.03 -0.34 0.27 0.00 -0.31 0.00 0.00 39.34 39.98 1sxd n TYR 250 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1sxd n VAL 251 N -0.24 1.02 0.32 -0.72 0.24 -0.96 -1.00 118.33 117.00 1sxd n VAL 251 Ca 0.31 0.26 0.15 0.00 -2.04 0.00 0.00 64.34 63.02 1sxd n VAL 251 Cb 0.55 -1.05 0.66 0.00 -1.47 0.00 0.00 33.84 32.52 1sxd n VAL 251 CO 0.00 0.00 0.00 0.17 -2.14 0.00 0.00 176.83 174.86 1sxd h LEU 252 N 0.00 0.00 -0.46 1.34 -0.00 -1.87 -1.76 115.31 112.56 1sxd h LEU 252 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 1sxd h LEU 252 Cb 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.81 1sxd h LEU 252 CO 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 178.44 178.60 1sxd h ALA 253 N 2.10 0.60 0.00 0.17 0.00 -1.43 -3.54 119.26 117.16 1sxd h ALA 253 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1sxd h ALA 253 Cb 0.36 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1sxd h ALA 253 CO 0.00 0.23 0.00 0.45 0.00 0.00 0.00 179.25 179.93