#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ny9 s GLN 161 N 0.00 3.79 -1.30 -0.99 -0.21 -1.26 -4.92 119.66 114.77 1ny9 s GLN 161 Ca 0.00 0.80 -0.17 0.00 0.02 0.00 0.00 55.36 56.01 1ny9 s GLN 161 Cb 0.00 -3.89 0.03 0.00 1.00 0.00 0.00 33.01 30.14 1ny9 s GLN 161 CO 0.00 -1.29 1.94 0.54 -2.12 0.00 0.00 175.29 174.36 1ny9 n ARG 162 N 7.63 2.78 0.00 2.91 1.74 -1.26 -3.69 116.66 126.77 1ny9 n ARG 162 Ca 0.13 -2.86 0.00 0.00 -0.77 0.00 0.00 57.85 54.35 1ny9 n ARG 162 Cb 0.48 -3.41 0.00 0.00 -1.02 0.00 0.00 32.46 28.51 1ny9 n ARG 162 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 1ny9 n ILE 163 N 6.09 0.00 -0.03 0.55 3.06 -1.26 -4.90 119.36 122.87 1ny9 n ILE 163 Ca 0.50 0.00 -0.06 0.00 -2.50 0.00 0.00 62.75 60.69 1ny9 n ILE 163 Cb 0.43 0.10 -0.02 0.00 0.54 0.00 0.00 39.64 40.69 1ny9 n ILE 163 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1ny9 n GLN 164 N 0.00 0.12 -0.07 9.51 6.02 -1.24 -4.55 117.38 127.16 1ny9 n GLN 164 Ca 0.00 0.05 0.09 0.00 -0.01 0.00 0.00 57.00 57.13 1ny9 n GLN 164 Cb 0.00 -0.72 0.46 0.00 1.02 0.00 0.00 30.24 30.99 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 -0.19 0.44 -0.36 1.08 5.19 -1.93 -1.96 116.42 118.70 1ny9 h ASP 165 Ca -0.14 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1ny9 h ASP 165 Cb 1.13 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 1ny9 h ASP 165 CO -0.08 0.29 0.20 -0.33 -3.12 0.00 0.00 179.24 176.20 1ny9 h GLU 166 N 0.51 0.49 -0.94 3.56 5.08 -1.89 -1.41 114.58 119.97 1ny9 h GLU 166 Ca 0.24 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1ny9 h GLU 166 Cb 0.32 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1ny9 h GLU 166 CO -0.07 0.39 0.56 0.00 -1.00 0.00 0.00 179.01 178.89 1ny9 h ALA 167 N 1.07 1.21 -0.04 3.43 0.00 -1.62 -1.38 119.26 121.93 1ny9 h ALA 167 Ca 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ny9 h ALA 167 Cb 0.04 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 1ny9 h ALA 167 CO -0.02 0.67 -0.04 -0.44 0.00 0.00 0.00 179.25 179.42 1ny9 h ASP 168 N 1.30 0.05 -0.25 0.00 3.32 -0.70 -0.81 116.42 119.33 1ny9 h ASP 168 Ca 0.34 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.36 1ny9 h ASP 168 Cb -0.04 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 1ny9 h ASP 168 CO -0.06 0.10 0.09 -0.33 -1.72 0.00 0.00 179.24 177.31 1ny9 h GLU 169 N 0.05 0.46 -0.17 3.56 5.08 -0.24 -2.67 114.58 120.66 1ny9 h GLU 169 Ca 0.01 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1ny9 h GLU 169 Cb 0.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1ny9 h GLU 169 CO 0.01 0.42 -0.00 -0.07 -1.00 0.00 0.00 179.01 178.37 1ny9 h LEU 170 N 0.46 0.29 -0.11 1.33 -0.00 -1.10 0.36 115.31 116.55 1ny9 h LEU 170 Ca 0.11 -0.32 0.04 0.00 -0.00 0.00 0.00 57.88 57.72 1ny9 h LEU 170 Cb 0.17 -0.08 -0.06 0.00 -0.00 0.00 0.00 40.66 40.69 1ny9 h LEU 170 CO -0.01 0.54 -0.26 0.74 -0.00 0.00 0.00 178.44 179.46 1ny9 h THR 171 N 0.04 0.39 -0.97 0.22 2.02 -1.31 1.47 112.91 114.77 1ny9 h THR 171 Ca 0.05 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.30 1ny9 h THR 171 Cb 0.39 0.39 -0.07 0.00 -1.74 0.00 0.00 68.15 67.13 1ny9 h THR 171 CO 0.01 0.00 0.62 -0.09 0.37 0.00 0.00 175.52 176.43 1ny9 h ARG 172 N -0.34 1.05 -0.10 6.66 2.43 -1.42 1.34 114.38 124.01 1ny9 h ARG 172 Ca 0.09 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1ny9 h ARG 172 Cb 0.48 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1ny9 h ARG 172 CO -0.30 0.70 0.02 -0.09 -1.51 0.00 0.00 179.97 178.78 1ny9 h ARG 173 N 1.09 0.16 -0.23 0.20 9.65 0.14 0.47 114.38 125.86 1ny9 h ARG 173 Ca 0.43 -0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 59.24 1ny9 h ARG 173 Cb 0.24 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.80 1ny9 h ARG 173 CO -0.20 0.36 0.01 0.74 2.80 0.00 0.00 179.97 183.69 1ny9 h PHE 174 N -0.07 0.43 -0.90 2.20 -1.00 0.30 -2.56 116.94 115.33 1ny9 h PHE 174 Ca 0.03 -0.07 0.01 0.00 2.81 0.00 0.00 57.97 60.75 1ny9 h PHE 174 Cb 0.28 -0.11 -0.04 0.00 3.61 0.00 0.00 35.95 39.68 1ny9 h PHE 174 CO 0.02 0.56 0.59 0.28 -1.61 0.00 0.00 178.31 178.14 1ny9 h VAL 175 N 0.18 1.24 -0.75 -0.55 2.07 0.18 0.28 116.25 118.90 1ny9 h VAL 175 Ca 0.07 -0.45 0.09 0.00 0.82 0.00 0.00 66.70 67.23 1ny9 h VAL 175 Cb 0.38 -0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.01 1ny9 h VAL 175 CO 0.01 0.23 0.49 0.00 0.02 0.00 0.00 177.57 178.32 1ny9 h ALA 176 N 1.42 1.81 -0.37 1.67 0.00 0.28 0.10 119.26 124.17 1ny9 h ALA 176 Ca 0.33 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1ny9 h ALA 176 Cb -0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1ny9 h ALA 176 CO -0.07 0.04 0.13 -0.07 0.00 0.00 0.00 179.25 179.28 1ny9 h LEU 177 N 0.67 0.52 -0.80 0.00 3.38 -0.08 -2.06 115.31 116.94 1ny9 h LEU 177 Ca 0.34 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1ny9 h LEU 177 Cb 0.45 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 1ny9 h LEU 177 CO -0.12 0.56 0.47 0.24 0.09 0.00 0.00 178.44 179.68 1ny9 h MET 178 N 0.44 0.82 -0.90 1.13 2.86 -0.07 -0.60 114.93 118.61 1ny9 h MET 178 Ca 0.12 -0.05 0.12 0.00 -2.06 0.00 0.00 59.70 57.83 1ny9 h MET 178 Cb 0.22 -0.18 -0.08 0.00 0.06 0.00 0.00 31.60 31.61 1ny9 h MET 178 CO -0.01 0.54 0.52 0.22 1.06 0.00 0.00 176.91 179.24 1ny9 h ASP 179 N 0.84 0.72 1.32 1.22 3.58 -0.37 0.67 116.42 124.40 1ny9 h ASP 179 Ca 0.36 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.88 1ny9 h ASP 179 Cb 0.24 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1ny9 h ASP 179 CO -0.20 0.37 0.00 0.00 -2.88 0.00 0.00 179.24 176.53 1ny9 h ALA 180 N 1.52 1.00 -4.57 -0.78 0.00 -0.86 -3.46 119.26 112.11 1ny9 h ALA 180 Ca 0.46 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.99 1ny9 h ALA 180 Cb 0.51 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.38 1ny9 h ALA 180 CO -0.29 0.00 -0.58 0.41 0.00 0.00 0.00 179.25 178.79 1ny9 n GLY 181 N 0.81 -0.43 3.76 0.00 0.00 0.23 -4.96 105.19 104.61 1ny9 n GLY 181 Ca 0.04 0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1ny9 n GLY 181 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ny9 s GLU 182 N -5.80 1.68 -0.12 1.61 4.04 -1.18 -4.97 118.70 113.97 1ny9 s GLU 182 Ca 0.36 0.76 -0.30 0.00 0.04 0.00 0.00 54.97 55.84 1ny9 s GLU 182 Cb -0.16 -1.86 -0.02 0.00 0.02 0.00 0.00 34.13 32.11 1ny9 s GLU 182 CO 0.45 -1.93 1.19 -1.25 -1.84 0.00 0.00 175.26 171.87 1ny9 s PRO 183 N -5.03 4.31 0.37 -4.83 0.04 -1.26 -4.84 135.00 123.76 1ny9 s PRO 183 Ca 0.62 1.61 0.14 0.00 0.04 0.00 0.00 61.00 63.41 1ny9 s PRO 183 Cb -0.16 -3.64 0.79 0.00 0.04 0.00 0.00 34.50 31.53 1ny9 s PRO 183 CO 0.56 -0.54 1.35 0.00 0.04 0.00 0.00 177.00 178.40 1ny9 h ALA 184 N 7.68 1.24 -0.37 8.56 0.00 -1.94 2.39 119.26 136.82 1ny9 h ALA 184 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ny9 h ALA 184 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1ny9 h ALA 184 CO 0.92 -0.24 0.00 -3.47 0.00 0.00 0.00 179.25 176.46 1ny9 n ASP 185 N -2.15 3.09 -4.71 0.00 -0.08 -1.26 -3.97 116.55 107.45 1ny9 n ASP 185 Ca -0.01 -2.31 -0.42 0.00 -1.51 0.00 0.00 54.79 50.54 1ny9 n ASP 185 Cb 0.36 -0.47 -0.03 0.00 2.34 0.00 0.00 41.12 43.32 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 -0.68 6.87 0.29 1.67 0.15 0.80 -4.69 113.70 118.11 1ny9 s SER 186 Ca 0.30 2.26 0.03 0.00 0.70 0.00 0.00 55.95 59.24 1ny9 s SER 186 Cb 0.20 -2.58 0.74 0.00 -1.71 0.00 0.00 66.02 62.67 1ny9 s SER 186 CO 0.13 -0.63 1.66 -0.33 1.20 0.00 0.00 173.24 175.26 1ny9 h GLU 187 N 6.93 0.24 -0.26 5.44 3.07 -1.90 4.02 114.58 132.11 1ny9 h GLU 187 Ca -0.42 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.41 1ny9 h GLU 187 Cb 1.21 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.05 1ny9 h GLU 187 CO 0.86 0.16 0.08 0.78 -1.40 0.00 0.00 179.01 179.49 1ny9 h GLY 188 N 0.25 0.44 0.70 -3.84 0.00 -1.95 2.69 103.07 101.35 1ny9 h GLY 188 Ca 0.57 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.62 1ny9 h GLY 188 CO -0.63 0.24 -0.14 0.00 0.00 0.00 0.00 176.54 176.02 1ny9 h ALA 189 N 0.90 -0.38 -0.81 3.60 0.00 0.39 0.11 119.26 123.07 1ny9 h ALA 189 Ca 0.08 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1ny9 h ALA 189 Cb 0.25 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1ny9 h ALA 189 CO -0.00 -0.56 0.53 0.52 0.00 0.00 0.00 179.25 179.74 1ny9 h MET 190 N -0.69 1.04 -0.61 0.00 2.07 0.73 0.58 114.93 118.06 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 -0.04 0.00 -1.87 0.00 0.00 31.60 29.94 1ny9 h MET 190 CO 0.06 0.69 0.40 0.22 1.07 0.00 0.00 176.91 179.35 1ny9 h ASP 191 N 1.07 0.52 -0.60 1.22 3.58 0.49 0.85 116.42 123.55 1ny9 h ASP 191 Ca 0.31 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.72 1ny9 h ASP 191 Cb -0.08 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 1ny9 h ASP 191 CO -0.08 0.34 0.22 0.00 -2.88 0.00 0.00 179.24 176.84 1ny9 h ALA 192 N 1.67 0.78 -0.64 -0.78 0.00 0.27 0.31 119.26 120.87 1ny9 h ALA 192 Ca 0.26 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1ny9 h ALA 192 Cb 0.27 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1ny9 h ALA 192 CO -0.08 0.42 0.31 0.00 0.00 0.00 0.00 179.25 179.90 1ny9 h ALA 193 N 1.08 0.86 -0.35 0.00 0.00 0.39 2.23 119.26 123.46 1ny9 h ALA 193 Ca 0.20 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1ny9 h ALA 193 Cb 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1ny9 h ALA 193 CO -0.01 -0.08 0.17 1.49 0.00 0.00 0.00 179.25 180.82 1ny9 h GLU 194 N 0.55 0.35 -0.18 0.00 4.57 0.14 0.18 114.58 120.18 1ny9 h GLU 194 Ca 0.31 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.46 1ny9 h GLU 194 Cb 0.30 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1ny9 h GLU 194 CO -0.24 0.23 0.10 0.22 -1.18 0.00 0.00 179.01 178.13 1ny9 h ASP 195 N 0.36 0.23 -0.10 1.04 1.82 0.22 -0.10 116.42 119.89 1ny9 h ASP 195 Ca 0.15 -0.09 0.03 0.00 -0.39 0.00 0.00 57.03 56.73 1ny9 h ASP 195 Cb 0.06 -0.06 -0.06 0.00 0.68 0.00 0.00 39.33 39.95 1ny9 h ASP 195 CO -0.11 0.25 -0.50 -0.74 -1.61 0.00 0.00 179.24 176.54 1ny9 h HIS 196 N 0.19 -1.45 -0.86 0.28 2.76 0.44 0.10 115.15 116.61 1ny9 h HIS 196 Ca 0.06 0.05 0.11 0.00 -2.20 0.00 0.00 60.37 58.39 1ny9 h HIS 196 Cb 0.07 0.65 -0.08 0.00 1.55 0.00 0.00 27.41 29.61 1ny9 h HIS 196 CO -0.04 -0.53 0.49 -0.09 -1.30 0.00 0.00 177.93 176.46 1ny9 h ARG 197 N -0.58 0.78 -0.92 5.26 2.43 -0.51 -0.44 114.38 120.40 1ny9 h ARG 197 Ca 0.04 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1ny9 h ARG 197 Cb 0.68 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 1ny9 h ARG 197 CO -0.40 0.51 0.60 0.37 -1.51 0.00 0.00 179.97 179.54 1ny9 h GLN 198 N 0.80 1.14 -0.48 0.20 4.15 0.91 -0.58 115.11 121.25 1ny9 h GLN 198 Ca 0.42 -0.07 -0.12 0.00 0.77 0.00 0.00 58.65 59.66 1ny9 h GLN 198 Cb 0.42 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 1ny9 h GLN 198 CO -0.27 0.75 -0.16 0.78 -1.93 0.00 0.00 178.83 178.01 1ny9 h GLY 199 N 1.17 1.03 0.80 2.39 0.00 0.76 -0.55 103.07 108.67 1ny9 h GLY 199 Ca 0.36 -0.88 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 1ny9 h GLY 199 CO -0.10 0.80 -0.29 -2.22 0.00 0.00 0.00 176.54 174.73 1ny9 h ILE 200 N 0.80 0.30 -0.74 2.60 2.04 -0.75 -2.81 117.51 118.95 1ny9 h ILE 200 Ca 0.11 -0.29 0.15 0.00 1.00 0.00 0.00 64.86 65.84 1ny9 h ILE 200 Cb 0.73 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1ny9 h ILE 200 CO 0.06 0.03 0.50 0.00 0.00 0.00 0.00 178.15 178.73 1ny9 h ALA 201 N -0.76 2.13 -0.45 1.87 0.00 -1.14 0.31 119.26 121.23 1ny9 h ALA 201 Ca -0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1ny9 h ALA 201 Cb 0.67 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ny9 h ALA 201 CO 0.13 -0.33 0.20 -0.09 0.00 0.00 0.00 179.25 179.16 1ny9 h ARG 202 N 0.39 0.66 0.19 0.00 9.65 -0.84 -1.95 114.38 122.48 1ny9 h ARG 202 Ca 0.36 -0.11 -0.27 0.00 -1.10 0.00 0.00 59.98 58.86 1ny9 h ARG 202 Cb 0.85 -0.11 0.03 0.00 -1.39 0.00 0.00 29.97 29.35 1ny9 h ARG 202 CO -0.11 0.59 -1.24 -0.91 2.80 0.00 0.00 179.97 181.09 1ny9 h ASN 203 N 0.58 0.63 -4.09 -3.80 2.35 -1.14 -3.40 115.58 106.72 1ny9 h ASN 203 Ca 0.15 -0.93 -0.65 0.00 -0.55 0.00 0.00 56.30 54.32 1ny9 h ASN 203 Cb 0.16 -0.21 -0.40 0.00 0.05 0.00 0.00 38.32 37.92 1ny9 h ASN 203 CO -0.02 1.59 -0.55 -1.00 -1.65 0.00 0.00 177.43 175.80 1ny9 s HIS 204 N -2.52 3.32 0.99 1.19 3.76 0.10 -5.10 115.29 117.03 1ny9 s HIS 204 Ca -0.13 -3.12 -0.13 0.00 -0.15 0.00 0.00 55.06 51.53 1ny9 s HIS 204 Cb 0.03 -2.89 0.16 0.00 1.11 0.00 0.00 32.58 30.99 1ny9 s HIS 204 CO 0.87 -0.72 0.30 0.66 -0.85 0.00 0.00 174.74 175.00 1ny9 n TYR 205 N 2.94 -2.31 -2.72 1.40 4.01 -0.74 -4.06 117.16 115.67 1ny9 n TYR 205 Ca 0.09 0.01 -0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1ny9 n TYR 205 Cb 0.34 -1.39 -0.00 0.00 -0.31 0.00 0.00 39.34 37.98 1ny9 n TYR 205 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1ny9 n ASP 206 N -1.10 -7.47 -3.75 7.72 8.00 -1.26 -4.93 116.55 113.75 1ny9 n ASP 206 Ca 0.06 1.42 -0.14 0.00 0.71 0.00 0.00 54.79 56.84 1ny9 n ASP 206 Cb 0.35 -5.28 -0.15 0.00 -0.02 0.00 0.00 41.12 36.02 1ny9 n ASP 206 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ny9 s GLY 208 N 1.16 1.53 0.48 0.00 0.00 -1.26 -4.99 107.32 104.25 1ny9 s GLY 208 Ca -0.09 -1.36 0.24 0.00 0.00 0.00 0.00 44.72 43.51 1ny9 s GLY 208 CO -0.06 -1.29 1.89 -0.97 0.00 0.00 0.00 173.10 172.68 1ny9 h TYR 209 N 4.25 0.25 0.00 1.90 0.05 -2.00 0.26 116.97 121.68 1ny9 h TYR 209 Ca -0.49 0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.30 1ny9 h TYR 209 Cb 1.16 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.82 1ny9 h TYR 209 CO 0.55 0.07 -0.00 0.93 -1.05 0.00 0.00 178.16 178.66 1ny9 h GLU 210 N 0.19 -0.00 -0.23 4.88 4.39 -1.99 0.39 114.58 122.22 1ny9 h GLU 210 Ca 0.41 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.11 1ny9 h GLU 210 Cb 1.32 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 1ny9 h GLU 210 CO -0.08 0.24 0.12 1.98 -1.16 0.00 0.00 179.01 180.11 1ny9 h MET 211 N -0.25 0.31 -0.63 2.33 4.05 -0.99 0.18 114.93 119.93 1ny9 h MET 211 Ca -0.00 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.32 1ny9 h MET 211 Cb 0.25 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 1ny9 h MET 211 CO 0.00 0.24 0.12 1.25 0.23 0.00 0.00 176.91 178.74 1ny9 h HIS 212 N 0.31 1.08 -0.30 1.39 6.17 -0.28 -1.59 115.15 121.93 1ny9 h HIS 212 Ca 0.08 -0.13 -0.03 0.00 0.71 0.00 0.00 60.37 61.00 1ny9 h HIS 212 Cb 0.02 -0.30 -0.02 0.00 2.52 0.00 0.00 27.41 29.64 1ny9 h HIS 212 CO 0.00 0.90 0.07 1.15 0.71 0.00 0.00 177.93 180.76 1ny9 h THR 213 N 0.96 1.15 -0.68 6.26 2.02 0.15 -2.29 112.91 120.48 1ny9 h THR 213 Ca 0.20 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 1ny9 h THR 213 Cb 0.40 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 1ny9 h THR 213 CO 0.01 0.19 0.39 0.00 0.37 0.00 0.00 175.52 176.48 1ny9 h LEU 215 N 0.95 0.71 -1.17 0.00 4.07 -1.30 -1.33 115.31 117.24 1ny9 h LEU 215 Ca 0.24 -0.07 0.16 0.00 0.08 0.00 0.00 57.88 58.29 1ny9 h LEU 215 Cb -0.01 -0.18 -0.08 0.00 1.08 0.00 0.00 40.66 41.47 1ny9 h LEU 215 CO -0.04 0.61 0.60 1.23 -1.08 0.00 0.00 178.44 179.76 1ny9 h GLY 216 N 0.89 1.44 1.01 0.83 0.00 -1.14 -1.45 103.07 104.65 1ny9 h GLY 216 Ca 0.19 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 1ny9 h GLY 216 CO -0.02 0.05 -0.29 0.83 0.00 0.00 0.00 176.54 177.10 1ny9 h GLU 217 N 0.75 -0.78 -0.16 4.80 5.08 -1.19 -2.50 114.58 120.57 1ny9 h GLU 217 Ca 0.50 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.93 1ny9 h GLU 217 Cb 0.79 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1ny9 h GLU 217 CO -0.27 -0.52 0.11 0.52 -1.00 0.00 0.00 179.01 177.85 1ny9 h MET 218 N -0.82 0.15 0.00 2.33 2.86 -1.35 3.90 114.93 122.01 1ny9 h MET 218 Ca -0.08 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1ny9 h MET 218 Cb 0.62 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1ny9 h MET 218 CO 0.14 0.10 0.00 0.66 1.06 0.00 0.00 176.91 178.87 1ny9 n TYR 219 N -4.51 0.00 0.00 -0.22 4.02 -0.62 -2.98 117.16 112.85 1ny9 n TYR 219 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1ny9 n TYR 219 Cb 0.13 -0.22 0.00 0.00 -0.02 0.00 0.00 39.34 39.23 1ny9 n TYR 219 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 1ny9 n VAL 220 N -1.22 0.00 0.20 -0.72 0.24 0.74 -4.67 118.33 112.90 1ny9 n VAL 220 Ca 0.00 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.39 1ny9 n VAL 220 Cb 0.00 0.00 0.23 0.00 -1.47 0.00 0.00 33.84 32.60 1ny9 n VAL 220 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1ny9 h SER 221 N 0.00 0.00 -3.76 -1.34 0.02 0.72 -3.40 113.55 105.80 1ny9 h SER 221 Ca 0.00 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 60.33 1ny9 h SER 221 Cb 0.00 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.13 1ny9 h SER 221 CO 0.00 0.21 -0.67 -1.81 -1.14 0.00 0.00 176.83 173.41 1ny9 s ASP 222 N -6.24 4.03 0.34 3.07 1.11 -1.16 -4.94 116.67 112.89 1ny9 s ASP 222 Ca 0.04 -3.02 0.11 0.00 0.18 0.00 0.00 52.55 49.85 1ny9 s ASP 222 Cb 0.07 -1.37 0.57 0.00 1.07 0.00 0.00 42.92 43.27 1ny9 s ASP 222 CO 0.68 -0.22 1.19 -0.33 1.18 0.00 0.00 175.17 177.67 1ny9 h GLU 223 N 6.35 0.00 0.08 8.23 5.08 -1.81 0.58 114.58 133.09 1ny9 h GLU 223 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ny9 h GLU 223 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1ny9 h GLU 223 CO 0.61 0.00 -0.04 0.00 -1.00 0.00 0.00 179.01 178.58 1ny9 h ARG 224 N 0.00 -0.10 0.03 2.33 3.08 -1.92 -2.23 114.38 115.57 1ny9 h ARG 224 Ca 0.00 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1ny9 h ARG 224 Cb 0.82 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.90 1ny9 h ARG 224 CO 0.00 0.29 -0.01 0.74 -1.07 0.00 0.00 179.97 179.92 1ny9 h PHE 225 N -0.51 -0.03 -0.72 3.04 -1.00 -1.17 -3.27 116.94 113.27 1ny9 h PHE 225 Ca -0.01 -0.00 0.14 0.00 2.81 0.00 0.00 57.97 60.91 1ny9 h PHE 225 Cb 0.44 0.01 -0.14 0.00 3.61 0.00 0.00 35.95 39.87 1ny9 h PHE 225 CO 0.06 0.68 -0.23 1.15 -1.61 0.00 0.00 178.31 178.36 1ny9 h THR 226 N -0.83 0.23 -0.94 -1.55 2.02 -1.52 -0.11 112.91 110.21 1ny9 h THR 226 Ca -0.00 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.32 1ny9 h THR 226 Cb 0.72 0.23 -0.09 0.00 -1.74 0.00 0.00 68.15 67.27 1ny9 h THR 226 CO 0.01 0.00 0.55 0.03 0.37 0.00 0.00 175.52 176.48 1ny9 h ARG 227 N -0.04 0.78 -0.03 6.66 3.08 -1.49 -0.14 114.38 123.20 1ny9 h ARG 227 Ca 0.33 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.26 1ny9 h ARG 227 Cb 0.55 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1ny9 h ARG 227 CO -0.76 0.52 -0.27 -2.95 -1.07 0.00 0.00 179.97 175.44 1ny9 h ASN 228 N 0.81 0.30 0.79 7.04 7.08 -1.09 -2.50 115.58 128.00 1ny9 h ASN 228 Ca 0.50 -0.70 -0.04 0.00 -3.08 0.00 0.00 56.30 52.98 1ny9 h ASN 228 Cb 0.62 -0.09 0.01 0.00 -2.08 0.00 0.00 38.32 36.78 1ny9 h ASN 228 CO -0.32 0.95 -0.38 0.40 -2.08 0.00 0.00 177.43 176.00 1ny9 h ILE 229 N -0.33 0.00 0.00 6.14 2.04 -1.10 -2.92 117.51 121.34 1ny9 h ILE 229 Ca -0.02 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1ny9 h ILE 229 Cb 0.96 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1ny9 h ILE 229 CO 0.06 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.54 1ny9 n ASP 230 N -4.88 0.40 0.05 1.72 2.03 -0.09 -2.67 116.55 113.10 1ny9 n ASP 230 Ca -0.13 0.64 0.11 0.00 0.52 0.00 0.00 54.79 55.93 1ny9 n ASP 230 Cb 0.42 -0.71 0.56 0.00 -0.72 0.00 0.00 41.12 40.67 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 2.16 2.05 -0.00 -1.67 0.00 -1.24 0.51 119.26 121.07 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 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ny9 h ALA 231 CO 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 179.25 179.11 1ny9 n ALA 232 N -2.54 2.61 -3.46 0.00 0.00 -1.09 -4.79 120.51 111.24 1ny9 n ALA 232 Ca 0.05 -0.19 0.03 0.00 0.00 0.00 0.00 53.44 53.33 1ny9 n ALA 232 Cb 0.28 -1.48 -0.05 0.00 0.00 0.00 0.00 19.45 18.20 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 -2.27 0.02 0.18 0.00 -0.14 0.17 -5.11 119.74 112.58 1ny9 s LYS 233 Ca 0.38 0.03 -0.30 0.00 -1.36 0.00 0.00 55.97 54.72 1ny9 s LYS 233 Cb 0.21 0.01 -0.08 0.00 -1.68 0.00 0.00 37.83 36.29 1ny9 s LYS 233 CO 0.42 -0.00 1.17 -1.25 -0.76 0.00 0.00 175.35 174.92 1ny9 s PRO 234 N 1.41 4.52 0.00 -1.68 0.04 -1.23 -3.30 135.00 134.75 1ny9 s PRO 234 Ca -0.05 1.82 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1ny9 s PRO 234 Cb -0.01 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1ny9 s PRO 234 CO -0.12 -0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.28 1ny9 n GLY 235 N 2.20 2.83 0.36 0.56 0.00 -1.26 -4.86 105.19 105.02 1ny9 n GLY 235 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.13 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 0.78 0.29 0.99 8.10 -1.88 -1.55 115.31 122.04 1ny9 h LEU 236 Ca 0.00 0.02 -0.00 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 0.46 -0.24 0.00 -4.11 0.00 0.00 178.44 174.55 1ny9 h ALA 237 N 1.56 -0.53 -0.91 0.17 0.00 -1.89 0.61 119.26 118.27 1ny9 h ALA 237 Ca 0.40 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.28 1ny9 h ALA 237 Cb 0.40 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 1ny9 h ALA 237 CO -0.17 -0.82 0.57 0.00 0.00 0.00 0.00 179.25 178.84 1ny9 h ALA 238 N 0.10 1.25 -0.09 0.00 0.00 -1.67 0.12 119.26 118.96 1ny9 h ALA 238 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ny9 h ALA 238 Cb 0.48 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ny9 h ALA 238 CO -0.02 0.34 0.03 -0.92 0.00 0.00 0.00 179.25 178.68 1ny9 h TYR 239 N 1.05 0.15 -0.55 0.00 5.03 -0.84 -1.85 116.97 119.96 1ny9 h TYR 239 Ca 0.39 -0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.75 1ny9 h TYR 239 Cb 0.16 -0.04 -0.05 0.00 1.55 0.00 0.00 36.73 38.34 1ny9 h TYR 239 CO -0.02 0.31 0.26 0.52 -1.32 0.00 0.00 178.16 177.90 1ny9 h MET 240 N -0.04 0.48 -0.60 1.82 2.86 -0.29 0.19 114.93 119.34 1ny9 h MET 240 Ca 0.03 -0.03 0.12 0.00 -2.06 0.00 0.00 59.70 57.76 1ny9 h MET 240 Cb 0.23 -0.11 -0.10 0.00 0.06 0.00 0.00 31.60 31.68 1ny9 h MET 240 CO -0.00 0.31 -0.02 -0.09 1.06 0.00 0.00 176.91 178.18 1ny9 h ARG 241 N 0.49 0.10 -0.94 1.72 1.12 -0.67 0.47 114.38 116.67 1ny9 h ARG 241 Ca 0.25 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 59.12 1ny9 h ARG 241 Cb 0.21 -0.02 -0.05 0.00 -0.01 0.00 0.00 29.97 30.10 1ny9 h ARG 241 CO -0.20 0.07 0.59 -0.44 -3.11 0.00 0.00 179.97 176.87 1ny9 h ASP 242 N 0.10 1.10 -0.47 -3.80 5.19 -0.08 -2.61 116.42 115.85 1ny9 h ASP 242 Ca 0.31 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1ny9 h ASP 242 Cb 0.49 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.70 1ny9 h ASP 242 CO -0.52 0.83 0.30 0.00 -3.12 0.00 0.00 179.24 176.72 1ny9 h ALA 243 N 1.37 0.59 0.33 3.45 0.00 0.26 -2.69 119.26 122.57 1ny9 h ALA 243 Ca 0.34 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1ny9 h ALA 243 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1ny9 h ALA 243 CO -0.07 0.06 -0.22 0.82 0.00 0.00 0.00 179.25 179.84 1ny9 h ILE 244 N 0.63 0.54 -0.28 0.00 1.08 -0.37 -2.71 117.51 116.39 1ny9 h ILE 244 Ca 0.17 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.64 1ny9 h ILE 244 Cb -0.05 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.23 1ny9 h ILE 244 CO -0.03 0.00 0.17 0.25 -0.69 0.00 0.00 178.15 177.85 1ny9 h LEU 245 N -0.54 0.34 -0.05 1.44 5.85 -1.50 -1.20 115.31 119.66 1ny9 h LEU 245 Ca -0.03 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.65 1ny9 h LEU 245 Cb 0.45 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1ny9 h LEU 245 CO 0.02 0.29 -0.02 0.00 -0.34 0.00 0.00 178.44 178.40 1ny9 h ALA 246 N 1.06 0.03 -0.46 1.25 0.00 -1.44 0.56 119.26 120.26 1ny9 h ALA 246 Ca 0.10 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1ny9 h ALA 246 Cb 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ny9 h ALA 246 CO -0.02 -0.50 0.27 -0.97 0.00 0.00 0.00 179.25 178.03 1ny9 h ASN 247 N -0.01 0.43 -0.17 0.00 -1.24 -1.42 -1.73 115.58 111.44 1ny9 h ASN 247 Ca 0.02 0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.03 1ny9 h ASN 247 Cb 0.05 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 1ny9 h ASN 247 CO -0.05 0.31 0.08 0.00 -1.29 0.00 0.00 177.43 176.48 1ny9 h ALA 248 N 1.21 0.22 -0.50 1.57 0.00 -0.69 -2.81 119.26 118.26 1ny9 h ALA 248 Ca 0.19 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1ny9 h ALA 248 Cb 0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1ny9 h ALA 248 CO -0.09 -0.22 0.25 0.28 0.00 0.00 0.00 179.25 179.48 1ny9 h VAL 249 N 0.15 0.96 0.00 0.00 2.07 0.46 2.38 116.25 122.27 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 0.12 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 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 -1.20 -3.16 114.38 112.19 1ny9 h ARG 250 Ca 0.22 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.26 1ny9 h ARG 250 Cb 0.13 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.20 1ny9 h ARG 250 CO -0.15 0.00 -0.93 0.72 0.10 0.00 0.00 179.97 179.71 1ny9 n HIS 251 N -3.00 0.40 -3.10 4.08 8.25 0.27 -5.05 115.22 117.07 1ny9 n HIS 251 Ca -0.01 0.17 -0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1ny9 n HIS 251 Cb 0.15 -0.66 -0.00 0.00 1.12 0.00 0.00 29.99 30.60 1ny9 n HIS 251 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1ny9 n THR 252 N -4.50 -3.86 1.98 1.59 -1.04 0.78 -5.09 114.28 104.13 1ny9 n THR 252 Ca -0.15 0.75 0.16 0.00 -2.04 0.00 0.00 64.05 62.77 1ny9 n THR 252 Cb 0.45 -3.73 0.93 0.00 -1.82 0.00 0.00 70.33 66.17 1ny9 n THR 252 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62