#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ny9 n GLN 161 N 0.00 2.77 -2.52 5.87 -0.00 -1.26 -4.97 117.38 117.27 1ny9 n GLN 161 Ca 0.00 -3.06 -0.43 0.00 -0.00 0.00 0.00 57.00 53.51 1ny9 n GLN 161 Cb 0.00 -2.05 -0.02 0.00 -0.00 0.00 0.00 30.24 28.17 1ny9 n GLN 161 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1ny9 s ARG 162 N -3.11 4.26 0.27 2.61 0.52 -1.26 -5.02 118.95 117.23 1ny9 s ARG 162 Ca 0.51 1.54 -0.10 0.00 -0.52 0.00 0.00 55.73 57.16 1ny9 s ARG 162 Cb 0.43 -3.69 -0.07 0.00 0.52 0.00 0.00 34.95 32.13 1ny9 s ARG 162 CO 0.09 -0.64 0.61 0.42 0.02 0.00 0.00 175.30 175.80 1ny9 s ILE 163 N 3.21 4.88 -0.01 1.52 -1.09 -1.26 -4.99 121.20 123.46 1ny9 s ILE 163 Ca 0.51 0.52 0.01 0.00 -2.23 0.00 0.00 60.65 59.45 1ny9 s ILE 163 Cb -0.19 -3.64 -0.01 0.00 -1.58 0.00 0.00 42.46 37.03 1ny9 s ILE 163 CO 0.12 -0.18 0.00 0.00 -1.23 0.00 0.00 174.94 173.66 1ny9 n GLN 164 N -0.42 3.12 -0.10 2.79 6.02 -1.26 -4.70 117.38 122.82 1ny9 n GLN 164 Ca 0.01 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.09 1ny9 n GLN 164 Cb 0.53 -1.02 0.44 0.00 1.02 0.00 0.00 30.24 31.22 1ny9 n GLN 164 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1ny9 h ASP 165 N 0.00 0.47 -0.22 1.08 5.19 -1.98 -2.17 116.42 118.79 1ny9 h ASP 165 Ca -0.02 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1ny9 h ASP 165 Cb 1.04 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.45 1ny9 h ASP 165 CO 0.00 0.30 0.12 -0.33 -3.12 0.00 0.00 179.24 176.21 1ny9 h GLU 166 N 0.54 0.31 -0.26 3.56 5.08 -2.00 0.20 114.58 122.01 1ny9 h GLU 166 Ca 0.27 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1ny9 h GLU 166 Cb 0.38 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1ny9 h GLU 166 CO -0.08 0.28 0.13 0.00 -1.00 0.00 0.00 179.01 178.34 1ny9 h ALA 167 N 1.01 0.33 -0.18 3.43 0.00 -1.76 -2.42 119.26 119.66 1ny9 h ALA 167 Ca 0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ny9 h ALA 167 Cb 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1ny9 h ALA 167 CO -0.01 -0.13 0.05 -0.44 0.00 0.00 0.00 179.25 178.72 1ny9 h ASP 168 N 0.29 0.23 -0.26 0.00 5.19 -1.04 -0.13 116.42 120.69 1ny9 h ASP 168 Ca 0.09 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.46 1ny9 h ASP 168 Cb 0.09 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.53 1ny9 h ASP 168 CO -0.01 0.23 0.10 -0.33 -3.12 0.00 0.00 179.24 176.12 1ny9 h GLU 169 N 0.25 0.46 -0.22 3.56 4.39 -0.11 -2.27 114.58 120.64 1ny9 h GLU 169 Ca 0.06 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 1ny9 h GLU 169 Cb 0.10 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1ny9 h GLU 169 CO -0.00 0.41 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.14 1ny9 h LEU 170 N 0.46 0.43 -0.06 1.33 3.38 -0.81 -0.37 115.31 119.67 1ny9 h LEU 170 Ca 0.11 -0.36 0.04 0.00 0.09 0.00 0.00 57.88 57.76 1ny9 h LEU 170 Cb 0.14 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 1ny9 h LEU 170 CO -0.01 0.68 -0.28 0.74 0.09 0.00 0.00 178.44 179.67 1ny9 h THR 171 N 0.16 0.37 -0.82 0.22 2.02 -1.01 2.29 112.91 116.14 1ny9 h THR 171 Ca 0.06 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.32 1ny9 h THR 171 Cb 0.49 0.37 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 1ny9 h THR 171 CO 0.02 0.00 0.53 -0.09 0.37 0.00 0.00 175.52 176.35 1ny9 h ARG 172 N -0.39 0.79 -0.11 6.66 2.43 -1.41 1.55 114.38 123.90 1ny9 h ARG 172 Ca 0.08 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.16 1ny9 h ARG 172 Cb 0.50 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1ny9 h ARG 172 CO -0.28 0.52 -0.08 -0.09 -1.51 0.00 0.00 179.97 178.54 1ny9 h ARG 173 N 0.82 0.25 -0.17 0.20 1.12 0.13 0.58 114.38 117.30 1ny9 h ARG 173 Ca 0.37 -0.12 -0.02 0.00 -1.11 0.00 0.00 59.98 59.10 1ny9 h ARG 173 Cb 0.36 -0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.31 1ny9 h ARG 173 CO -0.14 0.63 0.04 0.74 -3.11 0.00 0.00 179.97 178.12 1ny9 h PHE 174 N -0.12 0.29 -0.96 2.20 0.04 0.50 -2.36 116.94 116.53 1ny9 h PHE 174 Ca 0.02 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1ny9 h PHE 174 Cb 0.56 -0.08 -0.05 0.00 2.20 0.00 0.00 35.95 38.58 1ny9 h PHE 174 CO 0.08 0.41 0.60 0.28 -0.60 0.00 0.00 178.31 179.08 1ny9 h VAL 175 N 0.08 1.26 -0.81 -0.55 2.07 0.22 0.13 116.25 118.65 1ny9 h VAL 175 Ca 0.05 -0.54 0.09 0.00 0.82 0.00 0.00 66.70 67.13 1ny9 h VAL 175 Cb 0.27 -0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 29.86 1ny9 h VAL 175 CO 0.00 0.27 0.53 0.00 0.02 0.00 0.00 177.57 178.39 1ny9 h ALA 176 N 1.33 1.74 -0.51 1.67 0.00 0.53 0.19 119.26 124.21 1ny9 h ALA 176 Ca 0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 1ny9 h ALA 176 Cb -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1ny9 h ALA 176 CO -0.07 0.10 0.16 -0.07 0.00 0.00 0.00 179.25 179.37 1ny9 h LEU 177 N 0.76 0.75 -0.79 0.00 3.38 -0.26 -1.79 115.31 117.35 1ny9 h LEU 177 Ca 0.37 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1ny9 h LEU 177 Cb 0.43 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1ny9 h LEU 177 CO -0.15 0.76 0.47 0.24 0.09 0.00 0.00 178.44 179.85 1ny9 h MET 178 N 0.70 0.81 -0.85 1.13 2.86 0.25 0.15 114.93 119.98 1ny9 h MET 178 Ca 0.16 -0.05 0.12 0.00 -2.06 0.00 0.00 59.70 57.88 1ny9 h MET 178 Cb 0.28 -0.18 -0.08 0.00 0.06 0.00 0.00 31.60 31.67 1ny9 h MET 178 CO -0.00 0.54 0.47 0.22 1.06 0.00 0.00 176.91 179.20 1ny9 h ASP 179 N 0.84 0.64 1.33 1.22 1.82 -0.15 1.10 116.42 123.21 1ny9 h ASP 179 Ca 0.36 0.07 0.00 0.00 -0.39 0.00 0.00 57.03 57.06 1ny9 h ASP 179 Cb 0.22 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.18 1ny9 h ASP 179 CO -0.19 0.33 0.00 0.00 -1.61 0.00 0.00 179.24 177.76 1ny9 h ALA 180 N 1.51 1.00 -3.13 -0.78 0.00 -0.72 -3.46 119.26 113.67 1ny9 h ALA 180 Ca 0.44 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.18 1ny9 h ALA 180 Cb 0.50 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.35 1ny9 h ALA 180 CO -0.30 0.00 -0.29 0.41 0.00 0.00 0.00 179.25 179.07 1ny9 n GLY 181 N 0.80 0.29 3.78 0.00 0.00 0.38 -4.99 105.19 105.45 1ny9 n GLY 181 Ca 0.04 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1ny9 n GLY 181 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ny9 s GLU 182 N -5.41 3.09 -0.04 1.61 0.41 -0.70 -4.97 118.70 112.69 1ny9 s GLU 182 Ca 0.21 1.38 -0.30 0.00 -0.41 0.00 0.00 54.97 55.85 1ny9 s GLU 182 Cb -0.09 -1.99 -0.04 0.00 -1.78 0.00 0.00 34.13 30.23 1ny9 s GLU 182 CO 0.31 -1.02 1.26 -1.25 -0.49 0.00 0.00 175.26 174.08 1ny9 s PRO 183 N -3.90 4.33 0.45 0.39 0.04 -1.26 -4.83 135.00 130.22 1ny9 s PRO 183 Ca 0.67 1.76 0.18 0.00 0.04 0.00 0.00 61.00 63.65 1ny9 s PRO 183 Cb -0.20 -3.57 0.96 0.00 0.04 0.00 0.00 34.50 31.73 1ny9 s PRO 183 CO 0.37 -0.49 1.47 0.00 0.04 0.00 0.00 177.00 178.38 1ny9 h ALA 184 N 7.59 1.29 -0.36 8.56 0.00 -1.92 2.31 119.26 136.73 1ny9 h ALA 184 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ny9 h ALA 184 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ny9 h ALA 184 CO 0.89 -0.29 0.00 -3.47 0.00 0.00 0.00 179.25 176.38 1ny9 n ASP 185 N -2.34 3.14 -4.71 0.00 -0.08 -1.26 -3.96 116.55 107.34 1ny9 n ASP 185 Ca -0.01 -2.33 -0.42 0.00 -1.51 0.00 0.00 54.79 50.52 1ny9 n ASP 185 Cb 0.39 -0.48 -0.03 0.00 2.34 0.00 0.00 41.12 43.33 1ny9 n ASP 185 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1ny9 s SER 186 N -0.65 6.85 0.31 1.67 0.15 0.78 -4.68 113.70 118.13 1ny9 s SER 186 Ca 0.30 2.28 0.08 0.00 0.70 0.00 0.00 55.95 59.31 1ny9 s SER 186 Cb 0.20 -2.58 0.89 0.00 -1.71 0.00 0.00 66.02 62.82 1ny9 s SER 186 CO 0.13 -0.64 1.67 -0.33 1.20 0.00 0.00 173.24 175.27 1ny9 h GLU 187 N 6.87 0.32 -0.11 5.44 4.39 -1.90 4.05 114.58 133.63 1ny9 h GLU 187 Ca -0.42 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.26 1ny9 h GLU 187 Cb 1.21 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1ny9 h GLU 187 CO 0.86 0.21 0.04 0.78 -1.16 0.00 0.00 179.01 179.74 1ny9 h GLY 188 N 0.33 0.18 0.68 -3.84 0.00 -1.95 2.49 103.07 100.97 1ny9 h GLY 188 Ca 0.64 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.86 1ny9 h GLY 188 CO -0.60 0.09 -0.14 0.00 0.00 0.00 0.00 176.54 175.90 1ny9 h ALA 189 N 0.88 -0.38 -0.80 3.60 0.00 0.95 0.69 119.26 124.20 1ny9 h ALA 189 Ca 0.04 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.78 1ny9 h ALA 189 Cb 0.18 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1ny9 h ALA 189 CO -0.00 -0.55 0.52 0.52 0.00 0.00 0.00 179.25 179.74 1ny9 h MET 190 N -0.70 1.03 -0.79 0.00 2.07 0.72 0.91 114.93 118.17 1ny9 h MET 190 Ca -0.04 -0.06 0.06 0.00 -2.07 0.00 0.00 59.70 57.59 1ny9 h MET 190 Cb 0.48 -0.23 -0.05 0.00 -1.87 0.00 0.00 31.60 29.93 1ny9 h MET 190 CO 0.06 0.68 0.52 0.22 1.07 0.00 0.00 176.91 179.46 1ny9 h ASP 191 N 1.06 0.78 -0.47 1.22 3.58 0.44 1.15 116.42 124.17 1ny9 h ASP 191 Ca 0.30 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.71 1ny9 h ASP 191 Cb -0.09 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.78 1ny9 h ASP 191 CO -0.08 0.51 0.14 0.00 -2.88 0.00 0.00 179.24 176.93 1ny9 h ALA 192 N 1.56 0.62 -0.49 -0.78 0.00 0.22 0.55 119.26 120.95 1ny9 h ALA 192 Ca 0.33 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1ny9 h ALA 192 Cb 0.18 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1ny9 h ALA 192 CO -0.11 0.28 0.18 0.00 0.00 0.00 0.00 179.25 179.61 1ny9 h ALA 193 N 1.00 0.60 -0.22 0.00 0.00 0.58 2.23 119.26 123.45 1ny9 h ALA 193 Ca 0.15 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1ny9 h ALA 193 Cb 0.28 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1ny9 h ALA 193 CO -0.00 -0.20 0.10 1.49 0.00 0.00 0.00 179.25 180.63 1ny9 h GLU 194 N 0.37 0.20 -0.37 0.00 4.57 0.23 0.13 114.58 119.71 1ny9 h GLU 194 Ca 0.23 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.39 1ny9 h GLU 194 Cb 0.23 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1ny9 h GLU 194 CO -0.23 0.14 0.21 0.22 -1.18 0.00 0.00 179.01 178.17 1ny9 h ASP 195 N 0.21 0.46 -0.09 1.04 1.82 0.17 -0.47 116.42 119.56 1ny9 h ASP 195 Ca 0.09 -0.08 0.03 0.00 -0.39 0.00 0.00 57.03 56.69 1ny9 h ASP 195 Cb 0.04 -0.12 -0.06 0.00 0.68 0.00 0.00 39.33 39.87 1ny9 h ASP 195 CO -0.08 0.40 -0.49 -0.74 -1.61 0.00 0.00 179.24 176.72 1ny9 h HIS 196 N 0.47 -1.44 -0.89 0.28 2.76 0.45 -0.61 115.15 116.17 1ny9 h HIS 196 Ca 0.13 0.05 0.11 0.00 -2.20 0.00 0.00 60.37 58.46 1ny9 h HIS 196 Cb 0.04 0.64 -0.08 0.00 1.55 0.00 0.00 27.41 29.57 1ny9 h HIS 196 CO -0.03 -0.53 0.52 -0.09 -1.30 0.00 0.00 177.93 176.51 1ny9 h ARG 197 N -0.58 0.83 -0.29 5.26 2.43 -0.53 -2.02 114.38 119.47 1ny9 h ARG 197 Ca 0.04 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1ny9 h ARG 197 Cb 0.68 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 1ny9 h ARG 197 CO -0.40 0.55 0.12 0.37 -1.51 0.00 0.00 179.97 179.10 1ny9 h GLN 198 N 0.85 0.25 -0.56 0.20 4.15 0.39 -0.94 115.11 119.46 1ny9 h GLN 198 Ca 0.43 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.75 1ny9 h GLN 198 Cb 0.42 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.03 1ny9 h GLN 198 CO -0.26 0.17 -0.02 0.78 -1.93 0.00 0.00 178.83 177.57 1ny9 h GLY 199 N 0.26 1.06 0.79 2.39 0.00 -0.72 -0.98 103.07 105.87 1ny9 h GLY 199 Ca 0.13 -0.77 -0.04 0.00 0.00 0.00 0.00 47.33 46.65 1ny9 h GLY 199 CO -0.11 0.71 -0.36 -2.22 0.00 0.00 0.00 176.54 174.55 1ny9 h ILE 200 N 0.89 0.06 -0.73 2.60 2.04 -1.01 -2.83 117.51 118.54 1ny9 h ILE 200 Ca 0.16 -0.24 0.13 0.00 1.00 0.00 0.00 64.86 65.91 1ny9 h ILE 200 Cb 0.55 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 36.66 1ny9 h ILE 200 CO 0.03 0.01 0.48 0.00 0.00 0.00 0.00 178.15 178.67 1ny9 h ALA 201 N -1.18 2.04 0.00 1.87 0.00 -1.20 0.14 119.26 120.93 1ny9 h ALA 201 Ca -0.10 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1ny9 h ALA 201 Cb 0.78 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ny9 h ALA 201 CO 0.17 -0.22 -0.10 -0.09 0.00 0.00 0.00 179.25 179.01 1ny9 h ARG 202 N 0.46 0.00 0.00 0.00 2.43 -1.01 -1.78 114.38 114.48 1ny9 h ARG 202 Ca 0.35 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1ny9 h ARG 202 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1ny9 h ARG 202 CO -0.11 0.10 0.00 -1.71 -1.51 0.00 0.00 179.97 176.73 1ny9 n ASN 203 N -3.62 0.00 0.00 -3.80 5.15 0.50 -4.78 115.26 108.71 1ny9 n ASN 203 Ca -0.02 0.36 0.00 0.00 -0.60 0.00 0.00 54.58 54.32 1ny9 n ASN 203 Cb 0.22 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.10 1ny9 n ASN 203 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ny9 n HIS 204 N -1.37 0.00 -3.11 1.20 1.44 -0.67 -5.13 115.22 107.59 1ny9 n HIS 204 Ca 0.00 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.73 1ny9 n HIS 204 Cb 0.01 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.11 1ny9 n HIS 204 CO 0.00 0.00 0.00 -0.47 -2.81 0.00 0.00 176.34 173.06 1ny9 s TYR 205 N 1.72 -1.42 0.00 -1.40 6.14 -1.25 -5.01 117.35 116.12 1ny9 s TYR 205 Ca 0.00 0.36 0.00 0.00 0.64 0.00 0.00 57.07 58.07 1ny9 s TYR 205 Cb 0.00 0.26 0.00 0.00 0.42 0.00 0.00 41.96 42.64 1ny9 s TYR 205 CO 0.00 -0.93 0.00 -0.25 0.64 0.00 0.00 175.55 175.01 1ny9 n ASP 206 N 4.49 1.52 -2.43 4.32 9.92 -1.26 -5.17 116.55 127.94 1ny9 n ASP 206 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 1ny9 n ASP 206 Cb 0.58 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.06 1ny9 n ASP 206 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ny9 n GLY 208 N 5.00 -1.22 0.32 0.00 0.00 -1.26 -4.76 105.19 103.28 1ny9 n GLY 208 Ca 0.00 0.31 0.08 0.00 0.00 0.00 0.00 46.02 46.41 1ny9 n GLY 208 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1ny9 h TYR 209 N 0.00 0.87 0.17 1.61 0.05 -1.97 0.45 116.97 118.15 1ny9 h TYR 209 Ca 0.00 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 1ny9 h TYR 209 Cb 0.00 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 37.49 1ny9 h TYR 209 CO 0.00 0.23 -0.08 0.93 -1.05 0.00 0.00 178.16 178.18 1ny9 h GLU 210 N 0.69 -0.22 -0.12 4.88 5.08 -1.99 0.26 114.58 123.17 1ny9 h GLU 210 Ca 0.49 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.83 1ny9 h GLU 210 Cb 0.68 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1ny9 h GLU 210 CO -0.35 0.06 -0.08 1.98 -1.00 0.00 0.00 179.01 179.61 1ny9 h MET 211 N -0.49 0.17 -0.17 2.33 4.05 -1.74 -0.29 114.93 118.80 1ny9 h MET 211 Ca -0.02 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.31 1ny9 h MET 211 Cb 0.38 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.15 1ny9 h MET 211 CO 0.04 0.27 -0.12 1.25 0.23 0.00 0.00 176.91 178.57 1ny9 h HIS 212 N 0.17 0.44 -0.32 1.39 6.17 0.25 -2.86 115.15 120.39 1ny9 h HIS 212 Ca 0.04 -0.12 -0.02 0.00 0.71 0.00 0.00 60.37 60.98 1ny9 h HIS 212 Cb 0.26 -0.10 -0.02 0.00 2.52 0.00 0.00 27.41 30.07 1ny9 h HIS 212 CO 0.00 0.72 0.12 1.15 0.71 0.00 0.00 177.93 180.63 1ny9 h THR 213 N 0.03 1.13 -0.71 6.26 2.02 0.22 -1.98 112.91 119.89 1ny9 h THR 213 Ca 0.03 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 1ny9 h THR 213 Cb 0.63 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 1ny9 h THR 213 CO 0.03 0.16 0.38 0.00 0.37 0.00 0.00 175.52 176.47 1ny9 h LEU 215 N 0.98 0.82 -1.23 0.00 4.07 -1.20 -2.40 115.31 116.34 1ny9 h LEU 215 Ca 0.25 -0.22 0.21 0.00 0.08 0.00 0.00 57.88 58.20 1ny9 h LEU 215 Cb 0.03 -0.22 -0.09 0.00 1.08 0.00 0.00 40.66 41.46 1ny9 h LEU 215 CO -0.04 0.91 0.62 1.23 -1.08 0.00 0.00 178.44 180.08 1ny9 h GLY 216 N 0.98 1.39 0.97 0.83 0.00 -1.19 -0.15 103.07 105.90 1ny9 h GLY 216 Ca 0.14 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 1ny9 h GLY 216 CO 0.03 -0.06 -0.31 0.83 0.00 0.00 0.00 176.54 177.03 1ny9 h GLU 217 N 0.58 -0.80 -0.10 4.80 5.08 -1.38 -2.28 114.58 120.49 1ny9 h GLU 217 Ca 0.55 0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.97 1ny9 h GLU 217 Cb 1.11 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 1ny9 h GLU 217 CO -0.30 -0.53 0.06 0.52 -1.00 0.00 0.00 179.01 177.76 1ny9 h MET 218 N -0.83 0.09 0.00 2.33 2.86 -1.13 3.93 114.93 122.19 1ny9 h MET 218 Ca -0.08 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1ny9 h MET 218 Cb 0.64 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1ny9 h MET 218 CO 0.12 0.06 0.00 0.66 1.06 0.00 0.00 176.91 178.81 1ny9 n TYR 219 N -4.52 0.00 0.00 -0.22 4.02 -0.23 -2.97 117.16 113.24 1ny9 n TYR 219 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 1ny9 n TYR 219 Cb 0.11 -0.44 0.00 0.00 -0.02 0.00 0.00 39.34 39.00 1ny9 n TYR 219 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 176.86 177.40 1ny9 n VAL 220 N -1.44 0.00 0.73 -0.72 3.14 0.45 -4.50 118.33 115.98 1ny9 n VAL 220 Ca 0.01 0.00 0.12 0.00 -2.96 0.00 0.00 64.34 61.51 1ny9 n VAL 220 Cb 0.03 0.00 0.49 0.00 -1.06 0.00 0.00 33.84 33.30 1ny9 n VAL 220 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1ny9 n SER 221 N -1.31 0.35 -3.81 6.55 2.88 1.27 -4.45 113.62 115.10 1ny9 n SER 221 Ca 0.00 0.55 -0.30 0.00 -1.33 0.00 0.00 58.87 57.79 1ny9 n SER 221 Cb 0.00 -0.63 -0.14 0.00 -0.75 0.00 0.00 64.21 62.69 1ny9 n SER 221 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1ny9 s ASP 222 N -3.65 3.95 0.45 -3.46 1.11 -1.22 -4.93 116.67 108.92 1ny9 s ASP 222 Ca 0.11 -2.69 0.14 0.00 0.18 0.00 0.00 52.55 50.28 1ny9 s ASP 222 Cb 0.14 -1.26 0.75 0.00 1.07 0.00 0.00 42.92 43.62 1ny9 s ASP 222 CO 0.49 -0.27 1.33 -0.33 1.18 0.00 0.00 175.17 177.58 1ny9 h GLU 223 N 6.75 0.00 0.01 8.23 4.39 -1.84 0.17 114.58 132.29 1ny9 h GLU 223 Ca -0.04 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1ny9 h GLU 223 Cb 0.92 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 1ny9 h GLU 223 CO 0.56 0.00 -0.01 0.00 -1.16 0.00 0.00 179.01 178.40 1ny9 h ARG 224 N 0.00 -0.02 0.01 2.33 3.08 -1.92 -2.58 114.38 115.28 1ny9 h ARG 224 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1ny9 h ARG 224 Cb 0.93 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.98 1ny9 h ARG 224 CO 0.00 0.42 -0.15 0.74 -1.07 0.00 0.00 179.97 179.90 1ny9 h PHE 225 N -0.45 0.04 -0.71 3.04 -1.00 -0.96 -3.26 116.94 113.64 1ny9 h PHE 225 Ca -0.00 -0.03 0.13 0.00 2.81 0.00 0.00 57.97 60.88 1ny9 h PHE 225 Cb 0.44 -0.00 -0.13 0.00 3.61 0.00 0.00 35.95 39.87 1ny9 h PHE 225 CO 0.08 1.06 -0.30 1.15 -1.61 0.00 0.00 178.31 178.69 1ny9 h THR 226 N -0.95 0.17 -0.92 -1.55 2.02 -1.12 0.26 112.91 110.82 1ny9 h THR 226 Ca -0.04 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.28 1ny9 h THR 226 Cb 1.07 0.17 -0.09 0.00 -1.74 0.00 0.00 68.15 67.56 1ny9 h THR 226 CO -0.00 0.00 0.53 0.03 0.37 0.00 0.00 175.52 176.45 1ny9 h ARG 227 N -0.09 0.76 -0.02 6.66 3.08 -1.59 -0.45 114.38 122.74 1ny9 h ARG 227 Ca 0.29 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.24 1ny9 h ARG 227 Cb 0.56 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1ny9 h ARG 227 CO -0.76 0.50 -0.19 -0.91 -1.07 0.00 0.00 179.97 177.54 1ny9 h ASN 228 N 0.79 0.20 0.72 7.04 -0.26 -0.60 -2.29 115.58 121.18 1ny9 h ASN 228 Ca 0.48 -0.72 -0.04 0.00 -0.56 0.00 0.00 56.30 55.47 1ny9 h ASN 228 Cb 0.60 -0.06 0.01 0.00 -1.06 0.00 0.00 38.32 37.80 1ny9 h ASN 228 CO -0.32 0.89 -0.35 0.40 -1.06 0.00 0.00 177.43 176.99 1ny9 h ILE 229 N -0.47 0.00 0.00 2.81 2.04 -0.78 -2.90 117.51 118.21 1ny9 h ILE 229 Ca -0.02 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1ny9 h ILE 229 Cb 0.90 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1ny9 h ILE 229 CO 0.04 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.52 1ny9 n ASP 230 N -4.65 0.11 0.10 1.72 2.03 -0.20 -2.77 116.55 112.88 1ny9 n ASP 230 Ca -0.12 0.54 0.13 0.00 0.52 0.00 0.00 54.79 55.86 1ny9 n ASP 230 Cb 0.38 -0.56 0.63 0.00 -0.72 0.00 0.00 41.12 40.86 1ny9 n ASP 230 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ny9 h ALA 231 N 2.24 2.18 -0.00 -1.67 0.00 -1.19 0.13 119.26 120.95 1ny9 h ALA 231 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ny9 h ALA 231 Cb 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ny9 h ALA 231 CO 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 179.25 178.97 1ny9 n ALA 232 N -2.57 2.43 -3.65 0.00 0.00 -1.12 -4.84 120.51 110.76 1ny9 n ALA 232 Ca 0.04 -0.13 0.01 0.00 0.00 0.00 0.00 53.44 53.36 1ny9 n ALA 232 Cb 0.33 -1.46 -0.06 0.00 0.00 0.00 0.00 19.45 18.25 1ny9 n ALA 232 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ny9 s LYS 233 N -2.82 0.03 0.18 0.00 1.02 0.47 -5.11 119.74 113.50 1ny9 s LYS 233 Ca 0.20 0.05 -0.30 0.00 0.02 0.00 0.00 55.97 55.94 1ny9 s LYS 233 Cb 0.19 0.01 -0.08 0.00 -0.52 0.00 0.00 37.83 37.44 1ny9 s LYS 233 CO 0.51 -0.01 1.18 -1.25 -0.92 0.00 0.00 175.35 174.86 1ny9 s PRO 234 N 0.66 4.51 0.00 -1.68 0.04 -1.25 -3.37 135.00 133.92 1ny9 s PRO 234 Ca -0.02 1.84 0.00 0.00 0.04 0.00 0.00 61.00 62.85 1ny9 s PRO 234 Cb -0.03 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.26 1ny9 s PRO 234 CO -0.12 -0.06 0.00 0.41 0.04 0.00 0.00 177.00 177.27 1ny9 n GLY 235 N 2.19 2.67 0.33 0.56 0.00 -1.26 -4.84 105.19 104.83 1ny9 n GLY 235 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.08 1ny9 n GLY 235 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1ny9 h LEU 236 N 0.00 0.83 0.38 0.99 8.10 -1.90 0.42 115.31 124.14 1ny9 h LEU 236 Ca 0.00 0.03 -0.01 0.00 0.11 0.00 0.00 57.88 58.01 1ny9 h LEU 236 Cb 0.00 -0.14 -0.01 0.00 -0.44 0.00 0.00 40.66 40.06 1ny9 h LEU 236 CO 0.00 0.51 -0.30 0.00 -4.11 0.00 0.00 178.44 174.54 1ny9 h ALA 237 N 1.44 -0.68 -0.98 0.17 0.00 -1.89 0.13 119.26 117.46 1ny9 h ALA 237 Ca 0.40 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.26 1ny9 h ALA 237 Cb 0.25 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 1ny9 h ALA 237 CO -0.20 -0.91 0.63 0.00 0.00 0.00 0.00 179.25 178.78 1ny9 h ALA 238 N -0.15 1.43 -0.30 0.00 0.00 -1.66 -0.76 119.26 117.82 1ny9 h ALA 238 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1ny9 h ALA 238 Cb 0.58 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1ny9 h ALA 238 CO -0.00 0.42 0.09 -0.92 0.00 0.00 0.00 179.25 178.83 1ny9 h TYR 239 N 1.14 0.50 -0.54 0.00 5.03 -0.41 -2.60 116.97 120.08 1ny9 h TYR 239 Ca 0.42 -0.05 0.06 0.00 2.58 0.00 0.00 58.73 61.73 1ny9 h TYR 239 Cb 0.17 -0.14 -0.05 0.00 1.55 0.00 0.00 36.73 38.26 1ny9 h TYR 239 CO -0.00 0.52 0.26 0.52 -1.32 0.00 0.00 178.16 178.14 1ny9 h MET 240 N 0.33 0.48 -0.79 1.82 2.86 0.32 -0.29 114.93 119.67 1ny9 h MET 240 Ca 0.10 -0.03 0.17 0.00 -2.06 0.00 0.00 59.70 57.88 1ny9 h MET 240 Cb 0.26 -0.11 -0.11 0.00 0.06 0.00 0.00 31.60 31.70 1ny9 h MET 240 CO -0.00 0.32 0.27 -0.09 1.06 0.00 0.00 176.91 178.47 1ny9 h ARG 241 N 0.49 0.35 -0.86 1.72 1.12 -0.84 0.66 114.38 117.02 1ny9 h ARG 241 Ca 0.25 -0.02 0.01 0.00 -1.11 0.00 0.00 59.98 59.11 1ny9 h ARG 241 Cb 0.19 -0.08 -0.04 0.00 -0.01 0.00 0.00 29.97 30.03 1ny9 h ARG 241 CO -0.19 0.23 0.57 -0.44 -3.11 0.00 0.00 179.97 177.03 1ny9 h ASP 242 N 0.36 0.98 -0.33 -3.80 3.32 -0.71 -2.47 116.42 113.77 1ny9 h ASP 242 Ca 0.45 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.48 1ny9 h ASP 242 Cb 0.78 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1ny9 h ASP 242 CO -0.48 0.70 0.20 0.00 -1.72 0.00 0.00 179.24 177.93 1ny9 h ALA 243 N 1.47 0.42 0.55 3.45 0.00 0.97 -2.86 119.26 123.25 1ny9 h ALA 243 Ca 0.32 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1ny9 h ALA 243 Cb -0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1ny9 h ALA 243 CO -0.07 -0.08 -0.32 0.82 0.00 0.00 0.00 179.25 179.60 1ny9 h ILE 244 N 0.42 0.34 -0.68 0.00 2.04 -0.71 -2.92 117.51 116.00 1ny9 h ILE 244 Ca 0.12 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 1ny9 h ILE 244 Cb 0.02 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 1ny9 h ILE 244 CO -0.02 0.00 0.40 -0.07 0.00 0.00 0.00 178.15 178.46 1ny9 h LEU 245 N -0.82 0.83 -0.04 1.44 4.07 -1.57 -0.81 115.31 118.40 1ny9 h LEU 245 Ca -0.07 -0.07 0.02 0.00 0.08 0.00 0.00 57.88 57.84 1ny9 h LEU 245 Cb 0.66 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.18 1ny9 h LEU 245 CO 0.08 0.65 -0.06 0.00 -1.08 0.00 0.00 178.44 178.03 1ny9 h ALA 246 N 1.21 -0.03 -0.34 1.53 0.00 -1.47 1.31 119.26 121.48 1ny9 h ALA 246 Ca 0.24 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1ny9 h ALA 246 Cb -0.01 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1ny9 h ALA 246 CO -0.04 -0.54 0.21 -0.97 0.00 0.00 0.00 179.25 177.90 1ny9 h ASN 247 N -0.09 0.34 -0.18 0.00 -1.24 -1.37 -1.60 115.58 111.44 1ny9 h ASN 247 Ca 0.04 -0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.04 1ny9 h ASN 247 Cb 0.14 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 1ny9 h ASN 247 CO -0.09 0.25 0.08 0.00 -1.29 0.00 0.00 177.43 176.38 1ny9 h ALA 248 N 1.14 0.24 -0.50 1.57 0.00 -0.52 -2.83 119.26 118.37 1ny9 h ALA 248 Ca 0.13 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ny9 h ALA 248 Cb -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1ny9 h ALA 248 CO -0.05 -0.18 0.25 0.28 0.00 0.00 0.00 179.25 179.55 1ny9 h VAL 249 N 0.15 0.95 0.00 0.00 2.07 0.20 0.35 116.25 119.97 1ny9 h VAL 249 Ca 0.06 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1ny9 h VAL 249 Cb 0.15 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1ny9 h VAL 249 CO -0.01 0.09 0.00 0.08 0.02 0.00 0.00 177.57 177.75 1ny9 h ARG 250 N 0.49 0.00 0.00 1.57 0.11 -1.19 0.13 114.38 115.49 1ny9 h ARG 250 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 1ny9 h ARG 250 Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 1ny9 h ARG 250 CO -0.16 0.00 -0.89 0.72 0.10 0.00 0.00 179.97 179.74 1ny9 n HIS 251 N -2.88 0.03 -2.88 4.08 8.25 0.31 -4.82 115.22 117.29 1ny9 n HIS 251 Ca -0.01 0.01 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 1ny9 n HIS 251 Cb 0.15 -0.13 -0.04 0.00 1.12 0.00 0.00 29.99 31.08 1ny9 n HIS 251 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ny9 s THR 252 N -3.04 4.88 -2.00 1.59 2.01 0.96 -5.08 115.64 114.96 1ny9 s THR 252 Ca 0.08 1.65 0.23 0.00 0.31 0.00 0.00 61.69 63.96 1ny9 s THR 252 Cb 0.16 -4.14 0.67 0.00 0.01 0.00 0.00 72.50 69.20 1ny9 s THR 252 CO 0.82 0.03 1.77 -0.81 -0.69 0.00 0.00 174.62 175.73