#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nl9 h ASP 173 N 0.00 0.68 -0.33 1.67 3.45 -2.05 0.09 116.42 119.93 2nl9 h ASP 173 Ca 0.00 -0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.42 2nl9 h ASP 173 Cb 0.00 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.59 2nl9 h ASP 173 CO 0.00 0.49 0.13 0.25 -1.57 0.00 0.00 179.24 178.54 2nl9 h LEU 174 N 0.80 0.45 -0.30 1.55 5.85 -2.04 0.12 115.31 121.74 2nl9 h LEU 174 Ca 0.22 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2nl9 h LEU 174 Cb -0.09 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2nl9 h LEU 174 CO -0.05 0.50 0.19 0.22 -0.34 0.00 0.00 178.44 178.97 2nl9 h TYR 175 N 0.38 0.39 -0.37 1.25 3.20 -1.88 -0.53 116.97 119.41 2nl9 h TYR 175 Ca 0.11 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 2nl9 h TYR 175 Cb 0.19 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 2nl9 h TYR 175 CO -0.00 0.27 0.14 -0.09 -1.64 0.00 0.00 178.16 176.85 2nl9 h ARG 176 N 0.39 0.56 -0.53 1.82 2.43 -0.69 0.10 114.38 118.47 2nl9 h ARG 176 Ca 0.11 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2nl9 h ARG 176 Cb -0.01 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 2nl9 h ARG 176 CO -0.02 0.55 0.35 0.37 -1.51 0.00 0.00 179.97 179.70 2nl9 h GLN 177 N 0.46 0.71 -0.48 0.20 4.15 -0.70 -0.56 115.11 118.88 2nl9 h GLN 177 Ca 0.12 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.43 2nl9 h GLN 177 Cb 0.20 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 2nl9 h GLN 177 CO -0.01 0.48 0.07 0.77 -1.93 0.00 0.00 178.83 178.21 2nl9 h SER 178 N 0.72 0.78 -0.55 -0.69 0.02 -0.73 -1.78 113.55 111.33 2nl9 h SER 178 Ca 0.19 -0.27 -0.06 0.00 -0.84 0.00 0.00 61.79 60.82 2nl9 h SER 178 Cb -0.06 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 2nl9 h SER 178 CO -0.04 0.85 0.13 0.25 -1.14 0.00 0.00 176.83 176.89 2nl9 h LEU 179 N 0.68 0.87 -0.06 5.07 5.85 -0.61 -0.77 115.31 126.33 2nl9 h LEU 179 Ca 0.15 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2nl9 h LEU 179 Cb 0.41 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2nl9 h LEU 179 CO 0.01 0.85 0.03 -0.08 -0.34 0.00 0.00 178.44 178.92 2nl9 h GLU 180 N 0.89 0.09 -0.17 1.25 4.81 -0.77 0.18 114.58 120.85 2nl9 h GLU 180 Ca 0.19 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2nl9 h GLU 180 Cb 0.33 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2nl9 h GLU 180 CO 0.00 0.17 0.07 0.82 -0.73 0.00 0.00 179.01 179.34 2nl9 h ILE 181 N -0.01 1.16 -0.34 2.32 2.04 -1.07 -0.97 117.51 120.63 2nl9 h ILE 181 Ca 0.02 -0.48 -0.13 0.00 1.00 0.00 0.00 64.86 65.26 2nl9 h ILE 181 Cb 0.11 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2nl9 h ILE 181 CO -0.00 0.15 -0.31 0.40 0.00 0.00 0.00 178.15 178.39 2nl9 h ILE 182 N 0.12 1.29 -0.43 -0.67 2.04 -1.11 -1.76 117.51 116.98 2nl9 h ILE 182 Ca 0.06 -1.48 -0.02 0.00 1.00 0.00 0.00 64.86 64.42 2nl9 h ILE 182 Cb 0.18 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 2nl9 h ILE 182 CO -0.00 0.48 0.21 0.28 0.00 0.00 0.00 178.15 179.12 2nl9 h SER 183 N 0.60 0.56 -0.32 1.72 0.02 -0.59 -0.48 113.55 115.06 2nl9 h SER 183 Ca 0.06 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 2nl9 h SER 183 Cb 0.89 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 2nl9 h SER 183 CO 0.08 0.53 0.15 0.03 -1.14 0.00 0.00 176.83 176.48 2nl9 h ARG 184 N 0.55 0.46 -0.15 3.45 3.08 -1.07 0.10 114.38 120.81 2nl9 h ARG 184 Ca 0.15 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 2nl9 h ARG 184 Cb 0.12 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2nl9 h ARG 184 CO -0.02 0.43 0.09 -0.92 -1.07 0.00 0.00 179.97 178.48 2nl9 h TYR 185 N 0.38 0.20 -0.52 3.04 3.20 -1.15 -0.03 116.97 122.09 2nl9 h TYR 185 Ca 0.11 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.99 2nl9 h TYR 185 Cb 0.12 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2nl9 h TYR 185 CO -0.02 0.17 0.33 -0.07 -1.64 0.00 0.00 178.16 176.94 2nl9 h LEU 186 N 0.18 0.56 -0.72 2.82 4.07 -0.90 -0.67 115.31 120.65 2nl9 h LEU 186 Ca 0.06 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.98 2nl9 h LEU 186 Cb 0.03 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 2nl9 h LEU 186 CO -0.01 0.40 0.34 -0.09 -1.08 0.00 0.00 178.44 178.00 2nl9 h ARG 187 N 0.67 1.03 -0.52 1.13 2.43 -0.69 0.17 114.38 118.60 2nl9 h ARG 187 Ca 0.20 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 2nl9 h ARG 187 Cb -0.04 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2nl9 h ARG 187 CO -0.06 0.81 0.18 0.93 -1.51 0.00 0.00 179.97 180.31 2nl9 h GLU 188 N 1.00 0.80 -0.47 0.20 5.08 -0.64 -0.82 114.58 119.72 2nl9 h GLU 188 Ca 0.25 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 2nl9 h GLU 188 Cb 0.12 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2nl9 h GLU 188 CO -0.03 0.73 0.10 1.96 -1.00 0.00 0.00 179.01 180.76 2nl9 h GLN 189 N 0.71 0.77 -0.00 2.33 1.08 -0.82 0.60 115.11 119.78 2nl9 h GLN 189 Ca 0.17 -0.20 -0.19 0.00 -1.45 0.00 0.00 58.65 56.98 2nl9 h GLN 189 Cb 0.25 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2nl9 h GLN 189 CO -0.01 0.77 -0.85 0.00 -0.95 0.00 0.00 178.83 177.79 2nl9 h ALA 190 N 0.97 0.55 0.00 3.87 0.00 -0.73 -3.27 119.26 120.65 2nl9 h ALA 190 Ca 0.15 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2nl9 h ALA 190 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2nl9 h ALA 190 CO 0.01 0.90 -1.46 0.25 0.00 0.00 0.00 179.25 178.94 2nl9 n THR 191 N -3.68 0.02 0.00 0.00 -2.24 -0.33 -4.76 114.28 103.29 2nl9 n THR 191 Ca -0.03 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2nl9 n THR 191 Cb 0.79 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 2nl9 n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nl9 n GLY 192 N 1.37 1.62 0.00 3.38 0.00 0.20 -5.06 105.19 106.70 2nl9 n GLY 192 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2nl9 n GLY 192 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2nl9 n SER 193 N 2.39 0.00 0.00 1.61 3.41 -1.24 -4.79 113.62 115.00 2nl9 n SER 193 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2nl9 n SER 193 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2nl9 n SER 193 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nl9 n GLY 203 N 1.28 -1.06 0.23 5.00 0.00 -1.26 -4.13 105.19 105.26 2nl9 n GLY 203 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2nl9 n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nl9 h ALA 204 N -2.00 1.69 -0.21 4.61 0.00 -2.05 -0.35 119.26 120.95 2nl9 h ALA 204 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2nl9 h ALA 204 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2nl9 h ALA 204 CO 0.00 0.21 0.09 0.00 0.00 0.00 0.00 179.25 179.54 2nl9 h ALA 205 N 1.83 0.27 -0.87 0.00 0.00 -2.04 0.15 119.26 118.61 2nl9 h ALA 205 Ca -0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2nl9 h ALA 205 Cb 0.30 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2nl9 h ALA 205 CO 0.02 -0.15 0.49 0.78 0.00 0.00 0.00 179.25 180.39 2nl9 h GLY 206 N 0.18 1.30 0.98 0.00 0.00 -1.85 -0.81 103.07 102.87 2nl9 h GLY 206 Ca 0.07 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 2nl9 h GLY 206 CO -0.01 0.56 0.25 -0.09 0.00 0.00 0.00 176.54 177.25 2nl9 h ARG 207 N 1.21 0.73 -0.42 4.80 2.43 -0.81 0.11 114.38 122.43 2nl9 h ARG 207 Ca 0.31 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 59.27 2nl9 h ARG 207 Cb 0.02 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 2nl9 h ARG 207 CO -0.05 0.60 -0.18 0.00 -1.51 0.00 0.00 179.97 178.83 2nl9 h ARG 208 N 0.67 0.79 -0.47 0.20 3.08 -0.44 -0.12 114.38 118.09 2nl9 h ARG 208 Ca 0.17 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2nl9 h ARG 208 Cb 0.11 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2nl9 h ARG 208 CO -0.02 0.91 0.27 0.00 -1.07 0.00 0.00 179.97 180.06 2nl9 h ALA 209 N 1.10 0.61 -0.50 0.04 0.00 -0.88 -0.19 119.26 119.43 2nl9 h ALA 209 Ca 0.11 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2nl9 h ALA 209 Cb 0.68 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2nl9 h ALA 209 CO 0.05 0.12 -0.12 1.25 0.00 0.00 0.00 179.25 180.54 2nl9 h LEU 210 N 0.63 0.94 -0.70 0.00 5.85 -0.66 0.95 115.31 122.32 2nl9 h LEU 210 Ca 0.17 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 2nl9 h LEU 210 Cb 0.03 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 2nl9 h LEU 210 CO -0.03 1.07 0.33 -0.33 -0.34 0.00 0.00 178.44 179.13 2nl9 h GLU 211 N 0.83 1.01 -0.67 1.25 5.08 -0.80 0.12 114.58 121.40 2nl9 h GLU 211 Ca 0.13 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 2nl9 h GLU 211 Cb 0.67 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 2nl9 h GLU 211 CO 0.05 0.80 0.23 1.15 -1.00 0.00 0.00 179.01 180.24 2nl9 h THR 212 N 0.98 1.25 -0.50 1.13 2.02 -0.70 -2.34 112.91 114.74 2nl9 h THR 212 Ca 0.24 -0.84 -0.10 0.00 0.77 0.00 0.00 66.41 66.48 2nl9 h THR 212 Cb 0.13 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 2nl9 h THR 212 CO -0.03 0.33 -0.08 0.25 0.37 0.00 0.00 175.52 176.36 2nl9 h LEU 213 N 0.97 0.94 -0.34 2.58 5.85 -0.02 0.14 115.31 125.44 2nl9 h LEU 213 Ca 0.22 -0.34 0.05 0.00 0.84 0.00 0.00 57.88 58.65 2nl9 h LEU 213 Cb 0.27 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2nl9 h LEU 213 CO -0.01 1.06 0.06 0.03 -0.34 0.00 0.00 178.44 179.24 2nl9 h ARG 214 N 0.80 0.17 0.55 1.25 3.08 -0.65 0.79 114.38 120.36 2nl9 h ARG 214 Ca 0.13 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 2nl9 h ARG 214 Cb 0.63 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.65 2nl9 h ARG 214 CO 0.04 0.11 -0.26 -0.09 -1.07 0.00 0.00 179.97 178.70 2nl9 h ARG 215 N 0.17 -0.71 0.00 0.04 2.43 -0.83 -1.85 114.38 113.64 2nl9 h ARG 215 Ca 0.16 0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.24 2nl9 h ARG 215 Cb 0.18 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2nl9 h ARG 215 CO -0.21 -0.40 -0.74 -0.39 -1.51 0.00 0.00 179.97 176.71 2nl9 h VAL 216 N -1.03 0.99 -0.31 0.20 -1.51 -0.73 -0.34 116.25 113.52 2nl9 h VAL 216 Ca -0.08 -2.45 -0.01 0.00 -1.23 0.00 0.00 66.70 62.94 2nl9 h VAL 216 Cb 0.63 2.46 -0.01 0.00 -2.13 0.00 0.00 31.29 32.24 2nl9 h VAL 216 CO 0.12 0.57 0.16 1.23 -1.23 0.00 0.00 177.57 178.42 2nl9 h GLY 217 N 3.42 0.47 0.95 5.19 0.00 0.53 0.78 103.07 114.42 2nl9 h GLY 217 Ca -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 2nl9 h GLY 217 CO 0.08 0.22 0.15 -0.55 0.00 0.00 0.00 176.54 176.44 2nl9 h ASP 218 N 0.38 0.63 -0.36 0.19 5.19 -1.30 -3.21 116.42 117.94 2nl9 h ASP 218 Ca 0.11 -0.19 0.07 0.00 -0.62 0.00 0.00 57.03 56.40 2nl9 h ASP 218 Cb 0.09 -0.16 -0.06 0.00 0.18 0.00 0.00 39.33 39.37 2nl9 h ASP 218 CO -0.02 0.65 -0.05 1.23 -3.12 0.00 0.00 179.24 177.93 2nl9 h GLY 219 N 0.57 0.30 2.00 2.75 0.00 -0.71 -2.19 103.07 105.79 2nl9 h GLY 219 Ca 0.14 0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 2nl9 h GLY 219 CO -0.01 -0.12 -0.09 -0.24 0.00 0.00 0.00 176.54 176.09 2nl9 h VAL 220 N 0.04 0.32 0.00 4.60 3.04 -0.88 -0.65 116.25 122.72 2nl9 h VAL 220 Ca 0.18 -0.54 -0.11 0.00 -1.01 0.00 0.00 66.70 65.21 2nl9 h VAL 220 Cb 0.26 1.40 -0.02 0.00 -2.01 0.00 0.00 31.29 30.93 2nl9 h VAL 220 CO -0.34 0.08 -0.54 1.56 -1.01 0.00 0.00 177.57 177.32 2nl9 h GLN 221 N 0.00 0.00 -6.53 4.17 4.20 -1.40 -3.40 115.11 112.16 2nl9 h GLN 221 Ca -0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 2nl9 h GLN 221 Cb 0.40 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.21 2nl9 h GLN 221 CO 0.01 0.54 0.90 1.03 -0.67 0.00 0.00 178.83 180.65 2nl9 s ARG 222 N -3.71 4.22 0.00 1.46 0.52 -0.25 -0.61 118.95 120.58 2nl9 s ARG 222 Ca -0.01 2.30 0.00 0.00 -0.52 0.00 0.00 55.73 57.50 2nl9 s ARG 222 Cb 0.13 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 32.25 2nl9 s ARG 222 CO 0.75 -0.63 0.00 0.09 0.02 0.00 0.00 175.30 175.52 2nl9 n ASN 223 N 4.64 0.00 -0.92 0.23 3.02 -1.26 -4.81 115.26 116.16 2nl9 n ASN 223 Ca 0.14 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.77 2nl9 n ASN 223 Cb 0.40 0.00 0.25 0.00 -0.61 0.00 0.00 39.78 39.82 2nl9 n ASN 223 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2nl9 n HIS 224 N -2.00 0.93 -0.22 3.10 8.25 0.22 -4.63 115.22 120.87 2nl9 n HIS 224 Ca 0.00 -0.78 -0.06 0.00 -0.26 0.00 0.00 57.72 56.62 2nl9 n HIS 224 Cb 0.00 -0.26 0.04 0.00 1.12 0.00 0.00 29.99 30.89 2nl9 n HIS 224 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2nl9 h GLU 225 N 2.06 0.83 -0.49 -0.41 3.07 -1.76 0.14 114.58 118.02 2nl9 h GLU 225 Ca 0.00 -0.05 -0.07 0.00 -0.50 0.00 0.00 59.36 58.74 2nl9 h GLU 225 Cb 1.33 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 29.03 2nl9 h GLU 225 CO 0.19 0.55 0.02 1.15 -1.40 0.00 0.00 179.01 179.52 2nl9 h THR 226 N 0.85 1.26 -0.48 1.13 2.02 -1.90 -0.54 112.91 115.26 2nl9 h THR 226 Ca 0.23 -1.04 0.01 0.00 0.77 0.00 0.00 66.41 66.38 2nl9 h THR 226 Cb -0.10 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 2nl9 h THR 226 CO -0.05 0.36 0.31 0.00 0.37 0.00 0.00 175.52 176.51 2nl9 h ALA 227 N 0.94 0.61 -0.53 6.16 0.00 -1.77 -0.71 119.26 123.95 2nl9 h ALA 227 Ca 0.14 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2nl9 h ALA 227 Cb 0.49 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2nl9 h ALA 227 CO 0.02 0.03 0.17 0.74 0.00 0.00 0.00 179.25 180.21 2nl9 h PHE 228 N 0.62 0.86 -0.78 0.00 -1.00 -0.40 -2.50 116.94 113.74 2nl9 h PHE 228 Ca 0.18 -0.08 -0.02 0.00 2.81 0.00 0.00 57.97 60.85 2nl9 h PHE 228 Cb -0.05 -0.25 -0.04 0.00 3.61 0.00 0.00 35.95 39.23 2nl9 h PHE 228 CO -0.05 0.73 0.39 0.37 -1.61 0.00 0.00 178.31 178.14 2nl9 h GLN 229 N 0.74 1.11 -0.99 1.51 5.75 -0.86 0.12 115.11 122.48 2nl9 h GLN 229 Ca 0.17 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2nl9 h GLN 229 Cb 0.27 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.62 2nl9 h GLN 229 CO -0.01 0.85 0.00 0.41 -2.65 0.00 0.00 178.83 177.43 2nl9 n GLY 230 N -1.02 0.62 1.63 2.39 0.00 -0.29 -1.59 105.19 106.94 2nl9 n GLY 230 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2nl9 n GLY 230 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2nl9 n LEU 232 N 0.57 0.00 -0.14 0.99 7.94 0.03 -1.91 117.00 124.47 2nl9 n LEU 232 Ca 0.00 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.83 2nl9 n LEU 232 Cb 0.13 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.10 2nl9 n LEU 232 CO 0.00 0.00 1.05 0.03 -1.11 0.00 0.00 177.39 177.36 2nl9 h ARG 233 N 0.00 0.57 -0.00 1.96 3.08 -1.55 -1.76 114.38 116.68 2nl9 h ARG 233 Ca 0.00 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 2nl9 h ARG 233 Cb 0.00 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2nl9 h ARG 233 CO 0.00 0.38 -0.38 0.87 -1.07 0.00 0.00 179.97 179.76 2nl9 h LYS 234 N 0.59 0.01 -0.39 0.04 1.79 -1.66 -3.08 116.57 113.86 2nl9 h LYS 234 Ca 0.17 -0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.50 2nl9 h LYS 234 Cb -0.05 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 2nl9 h LYS 234 CO -0.05 0.39 -0.26 1.25 -1.08 0.00 0.00 179.45 179.70 2nl9 h LEU 235 N 0.01 0.91 -1.62 2.94 5.85 -1.70 -3.47 115.31 118.23 2nl9 h LEU 235 Ca -0.00 -0.43 -0.38 0.00 0.84 0.00 0.00 57.88 57.90 2nl9 h LEU 235 Cb 0.68 -0.25 0.11 0.00 0.37 0.00 0.00 40.66 41.56 2nl9 h LEU 235 CO 0.05 1.15 -0.79 -0.67 -0.34 0.00 0.00 178.44 177.84 2nl9 n ASP 236 N -4.17 -2.09 -4.73 1.25 2.03 -0.71 -4.88 116.55 103.25 2nl9 n ASP 236 Ca -0.02 -0.71 -0.42 0.00 0.52 0.00 0.00 54.79 54.16 2nl9 n ASP 236 Cb 0.47 -4.58 -0.03 0.00 -0.72 0.00 0.00 41.12 36.27 2nl9 n ASP 236 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2nl9 s ILE 237 N -3.49 2.89 -0.02 5.18 2.07 -1.26 -4.92 121.20 121.65 2nl9 s ILE 237 Ca 0.08 0.71 0.02 0.00 -1.41 0.00 0.00 60.65 60.05 2nl9 s ILE 237 Cb -0.04 -3.45 -0.25 0.00 0.13 0.00 0.00 42.46 38.85 2nl9 s ILE 237 CO 0.77 0.09 0.74 0.11 -1.91 0.00 0.00 174.94 174.75 2nl9 h LYS 238 N 5.72 0.15 -2.31 3.50 1.79 -1.90 -3.50 116.57 120.03 2nl9 h LYS 238 Ca -0.44 -0.26 0.23 0.00 -2.18 0.00 0.00 60.65 58.00 2nl9 h LYS 238 Cb 1.21 0.10 -0.05 0.00 -1.58 0.00 0.00 32.23 31.90 2nl9 h LYS 238 CO 0.81 0.92 0.68 0.54 -1.08 0.00 0.00 179.45 181.33 2nl9 s ASN 239 N -6.68 -0.02 0.61 0.86 2.20 -1.26 -5.03 114.94 105.62 2nl9 s ASN 239 Ca -0.09 -0.48 0.31 0.00 -0.94 0.00 0.00 52.86 51.66 2nl9 s ASN 239 Cb 0.07 0.37 1.77 0.00 -2.00 0.00 0.00 41.25 41.47 2nl9 s ASN 239 CO 0.83 -0.74 2.14 1.05 -2.94 0.00 0.00 177.10 177.44 2nl9 h GLU 240 N 2.00 0.00 -0.01 3.55 4.11 -1.95 -1.46 114.58 120.82 2nl9 h GLU 240 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.17 2nl9 h GLU 240 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2nl9 h GLU 240 CO 0.33 0.00 -0.79 -0.25 0.07 0.00 0.00 179.01 178.38 2nl9 n ASP 241 N -3.64 1.35 -3.81 3.06 10.43 -1.26 -4.20 116.55 118.47 2nl9 n ASP 241 Ca 0.00 -1.15 -0.42 0.00 2.57 0.00 0.00 54.79 55.79 2nl9 n ASP 241 Cb 0.27 0.78 0.00 0.00 1.84 0.00 0.00 41.12 44.00 2nl9 n ASP 241 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2nl9 n ASP 242 N -0.97 4.29 -0.52 -2.24 2.03 -0.55 -4.61 116.55 113.98 2nl9 n ASP 242 Ca 0.06 -2.93 0.09 0.00 0.52 0.00 0.00 54.79 52.53 2nl9 n ASP 242 Cb 0.38 -1.61 0.03 0.00 -0.72 0.00 0.00 41.12 39.20 2nl9 n ASP 242 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2nl9 n VAL 243 N 4.61 0.00 -0.15 5.18 0.24 -1.26 -4.60 118.33 122.34 2nl9 n VAL 243 Ca 0.48 -0.40 -0.10 0.00 -2.04 0.00 0.00 64.34 62.28 2nl9 n VAL 243 Cb 0.38 1.27 -0.01 0.00 -1.47 0.00 0.00 33.84 34.02 2nl9 n VAL 243 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2nl9 h LYS 244 N 2.57 0.78 -0.46 7.34 1.57 -2.00 -1.40 116.57 124.97 2nl9 h LYS 244 Ca 0.00 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.55 2nl9 h LYS 244 Cb 0.65 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 2nl9 h LYS 244 CO 0.00 0.83 0.29 1.03 -0.57 0.00 0.00 179.45 181.03 2nl9 h SER 245 N 0.62 0.48 -0.83 0.86 0.87 -1.96 -1.17 113.55 112.42 2nl9 h SER 245 Ca 0.13 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 2nl9 h SER 245 Cb 0.47 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.29 2nl9 h SER 245 CO 0.02 0.35 0.40 0.25 -0.53 0.00 0.00 176.83 177.31 2nl9 h LEU 246 N 0.58 1.09 -0.59 2.23 5.85 -1.78 -0.07 115.31 122.61 2nl9 h LEU 246 Ca 0.18 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2nl9 h LEU 246 Cb -0.02 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2nl9 h LEU 246 CO -0.06 0.92 0.37 0.28 -0.34 0.00 0.00 178.44 179.61 2nl9 h SER 247 N 1.18 0.69 -0.58 1.25 0.02 -0.88 -2.46 113.55 112.78 2nl9 h SER 247 Ca 0.28 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.20 2nl9 h SER 247 Cb 0.12 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 2nl9 h SER 247 CO -0.04 0.53 0.38 0.03 -1.14 0.00 0.00 176.83 176.59 2nl9 h ARG 248 N 0.80 0.76 0.00 3.45 3.08 -0.66 -0.34 114.38 121.46 2nl9 h ARG 248 Ca 0.21 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2nl9 h ARG 248 Cb -0.05 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.83 2nl9 h ARG 248 CO -0.04 0.50 0.00 0.28 -1.07 0.00 0.00 179.97 179.64 2nl9 n VAL 249 N -4.69 0.00 0.00 2.04 0.31 -0.09 -0.77 118.33 115.14 2nl9 n VAL 249 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2nl9 n VAL 249 Cb 0.02 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 2nl9 n VAL 249 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2nl9 n ILE 251 N 0.37 0.00 -0.22 2.52 2.08 -0.14 -0.79 119.36 123.18 2nl9 n ILE 251 Ca 0.00 0.00 -0.09 0.00 0.56 0.00 0.00 62.75 63.22 2nl9 n ILE 251 Cb 0.00 0.00 0.03 0.00 -0.75 0.00 0.00 39.64 38.92 2nl9 n ILE 251 CO 0.00 0.00 0.00 -0.74 0.56 0.00 0.00 176.55 176.37 2nl9 h HIS 252 N 0.00 1.19 -0.70 1.39 2.76 -1.19 -2.22 115.15 116.38 2nl9 h HIS 252 Ca 0.00 -0.19 0.13 0.00 -2.20 0.00 0.00 60.37 58.11 2nl9 h HIS 252 Cb 0.00 -0.32 -0.09 0.00 1.55 0.00 0.00 27.41 28.56 2nl9 h HIS 252 CO 0.00 1.02 0.26 0.28 -1.30 0.00 0.00 177.93 178.19 2nl9 h VAL 253 N 1.01 0.68 -0.00 5.26 2.07 -1.22 -0.57 116.25 123.48 2nl9 h VAL 253 Ca 0.19 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.57 2nl9 h VAL 253 Cb 0.52 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2nl9 h VAL 253 CO 0.03 0.07 -0.00 0.49 0.02 0.00 0.00 177.57 178.18 2nl9 n PHE 254 N -5.02 0.00 1.03 1.57 3.72 -0.90 -4.15 117.46 113.71 2nl9 n PHE 254 Ca 0.12 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.64 2nl9 n PHE 254 Cb 0.37 -0.10 0.57 0.00 -0.94 0.00 0.00 39.48 39.38 2nl9 n PHE 254 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2nl9 n SER 255 N -1.08 0.00 0.00 4.37 3.41 -0.22 -1.18 113.62 118.92 2nl9 n SER 255 Ca 0.21 0.12 0.16 0.00 -0.26 0.00 0.00 58.87 59.09 2nl9 n SER 255 Cb 0.16 -0.35 0.91 0.00 -0.26 0.00 0.00 64.21 64.66 2nl9 n SER 255 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2nl9 n ASP 256 N -1.35 0.00 0.00 4.04 5.75 -1.26 -4.92 116.55 118.81 2nl9 n ASP 256 Ca 0.10 -0.83 0.00 0.00 -0.01 0.00 0.00 54.79 54.05 2nl9 n ASP 256 Cb 0.22 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 2nl9 n ASP 256 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2nl9 n GLY 257 N 1.04 0.73 3.83 6.12 0.00 -0.32 -5.04 105.19 111.54 2nl9 n GLY 257 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 2nl9 n GLY 257 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nl9 s VAL 258 N -2.70 5.34 -0.05 1.61 1.01 -1.26 -5.08 120.40 119.28 2nl9 s VAL 258 Ca 0.00 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.14 2nl9 s VAL 258 Cb 0.00 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 33.06 2nl9 s VAL 258 CO 0.00 0.58 -0.04 -0.89 0.00 0.00 0.00 175.10 174.75 2nl9 s THR 259 N -0.75 0.54 0.25 3.92 2.01 -1.26 -4.74 115.64 115.61 2nl9 s THR 259 Ca 0.13 -0.10 -0.15 0.00 0.31 0.00 0.00 61.69 61.88 2nl9 s THR 259 Cb -0.12 -0.58 0.00 0.00 0.01 0.00 0.00 72.50 71.82 2nl9 s THR 259 CO 0.03 0.24 0.54 0.54 -0.69 0.00 0.00 174.62 175.28 2nl9 s ASN 260 N 1.08 -0.14 0.27 3.53 2.20 -1.26 -5.05 114.94 115.57 2nl9 s ASN 260 Ca -0.09 -0.83 0.13 0.00 -0.94 0.00 0.00 52.86 51.13 2nl9 s ASN 260 Cb -0.14 0.62 0.31 0.00 -2.00 0.00 0.00 41.25 40.04 2nl9 s ASN 260 CO -0.01 -1.19 1.56 -0.50 -2.94 0.00 0.00 177.10 174.02 2nl9 h TRP 261 N 2.19 0.00 -0.75 1.54 4.06 -1.99 -2.21 115.95 118.79 2nl9 h TRP 261 Ca -0.24 0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.72 2nl9 h TRP 261 Cb 1.25 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.37 2nl9 h TRP 261 CO 0.40 0.61 0.49 0.78 -3.56 0.00 0.00 178.44 177.16 2nl9 h GLY 262 N 2.33 1.06 0.91 1.49 0.00 -1.99 0.14 103.07 107.01 2nl9 h GLY 262 Ca -0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 2nl9 h GLY 262 CO 0.08 0.36 0.11 3.21 0.00 0.00 0.00 176.54 180.30 2nl9 h ARG 263 N 0.99 0.48 -0.25 4.80 3.08 -1.92 -1.44 114.38 120.12 2nl9 h ARG 263 Ca 0.28 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 2nl9 h ARG 263 Cb -0.08 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2nl9 h ARG 263 CO -0.07 0.52 0.12 0.82 -1.07 0.00 0.00 179.97 180.28 2nl9 h ILE 264 N 0.35 1.15 -0.10 2.04 2.04 -1.03 -0.71 117.51 121.25 2nl9 h ILE 264 Ca 0.10 -0.42 -0.07 0.00 1.00 0.00 0.00 64.86 65.47 2nl9 h ILE 264 Cb 0.23 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2nl9 h ILE 264 CO -0.00 0.15 -0.25 1.62 0.00 0.00 0.00 178.15 179.67 2nl9 h VAL 265 N 0.27 1.22 -0.62 1.67 3.04 -0.68 -1.35 116.25 119.80 2nl9 h VAL 265 Ca 0.09 -1.03 -0.07 0.00 -1.01 0.00 0.00 66.70 64.68 2nl9 h VAL 265 Cb 0.12 1.42 -0.02 0.00 -2.01 0.00 0.00 31.29 30.80 2nl9 h VAL 265 CO -0.01 0.31 0.13 0.74 -1.01 0.00 0.00 177.57 177.73 2nl9 h THR 266 N 0.15 1.26 -0.56 3.17 2.02 -0.74 0.20 112.91 118.40 2nl9 h THR 266 Ca 0.03 -0.95 -0.03 0.00 0.77 0.00 0.00 66.41 66.22 2nl9 h THR 266 Cb 0.52 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2nl9 h THR 266 CO 0.04 0.36 0.22 -0.07 0.37 0.00 0.00 175.52 176.43 2nl9 h LEU 267 N 0.91 0.78 -0.44 2.58 3.38 -0.70 0.57 115.31 122.39 2nl9 h LEU 267 Ca 0.19 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2nl9 h LEU 267 Cb 0.38 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2nl9 h LEU 267 CO 0.01 0.74 -0.05 0.40 0.09 0.00 0.00 178.44 179.62 2nl9 h ILE 268 N 0.77 1.27 -0.66 1.22 2.04 -0.97 0.47 117.51 121.66 2nl9 h ILE 268 Ca 0.19 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.90 2nl9 h ILE 268 Cb 0.21 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 2nl9 h ILE 268 CO -0.01 0.39 0.36 -1.28 0.00 0.00 0.00 178.15 177.61 2nl9 h SER 269 N 0.65 0.82 -0.76 1.72 0.87 -0.43 0.49 113.55 116.92 2nl9 h SER 269 Ca 0.12 -0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.53 2nl9 h SER 269 Cb 0.57 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.29 2nl9 h SER 269 CO 0.03 0.68 0.25 0.15 -0.53 0.00 0.00 176.83 177.41 2nl9 h PHE 270 N 0.90 1.21 -0.62 2.24 3.57 -0.70 -0.61 116.94 122.93 2nl9 h PHE 270 Ca 0.23 -0.12 0.09 0.00 3.53 0.00 0.00 57.97 61.71 2nl9 h PHE 270 Cb 0.04 -0.35 -0.07 0.00 2.79 0.00 0.00 35.95 38.36 2nl9 h PHE 270 CO -0.01 0.94 0.25 0.78 -2.23 0.00 0.00 178.31 178.04 2nl9 h GLY 271 N 1.13 0.87 1.10 2.40 0.00 0.02 0.66 103.07 109.24 2nl9 h GLY 271 Ca 0.25 -0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.38 2nl9 h GLY 271 CO -0.01 -0.00 0.21 0.00 0.00 0.00 0.00 176.54 176.74 2nl9 h ALA 272 N 1.41 1.01 -0.64 3.60 0.00 -0.48 0.13 119.26 124.28 2nl9 h ALA 272 Ca 0.31 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2nl9 h ALA 272 Cb 0.36 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2nl9 h ALA 272 CO -0.29 0.66 0.40 0.35 0.00 0.00 0.00 179.25 180.36 2nl9 h PHE 273 N 1.08 0.84 -0.47 0.00 3.57 -0.09 0.54 116.94 122.40 2nl9 h PHE 273 Ca 0.23 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.64 2nl9 h PHE 273 Cb 0.33 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 2nl9 h PHE 273 CO 0.03 0.56 -0.08 0.28 -2.23 0.00 0.00 178.31 176.86 2nl9 h VAL 274 N 0.87 1.27 -0.80 1.41 2.07 -0.55 -2.09 116.25 118.43 2nl9 h VAL 274 Ca 0.23 -1.20 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 2nl9 h VAL 274 Cb -0.04 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2nl9 h VAL 274 CO -0.05 0.41 0.37 0.00 0.02 0.00 0.00 177.57 178.32 2nl9 h ALA 275 N 0.89 1.04 -0.69 1.67 0.00 -0.32 -0.53 119.26 121.32 2nl9 h ALA 275 Ca 0.12 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2nl9 h ALA 275 Cb 0.62 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2nl9 h ALA 275 CO 0.04 0.62 0.34 -0.22 0.00 0.00 0.00 179.25 180.03 2nl9 h LYS 276 N 1.15 0.98 -0.40 0.00 3.64 -0.77 -1.66 116.57 119.51 2nl9 h LYS 276 Ca 0.27 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2nl9 h LYS 276 Cb 0.15 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2nl9 h LYS 276 CO -0.03 0.76 0.24 1.25 -2.27 0.00 0.00 179.45 179.40 2nl9 h HIS 277 N 0.95 0.46 -0.93 1.91 2.76 -0.80 -1.43 115.15 118.07 2nl9 h HIS 277 Ca 0.24 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.43 2nl9 h HIS 277 Cb 0.10 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 28.86 2nl9 h HIS 277 CO 0.00 0.27 0.62 -0.07 -1.30 0.00 0.00 177.93 177.45 2nl9 h LEU 278 N 0.49 1.06 -0.61 0.26 3.38 -0.69 -1.92 115.31 117.28 2nl9 h LEU 278 Ca 0.15 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 2nl9 h LEU 278 Cb -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 2nl9 h LEU 278 CO -0.06 0.76 -0.30 0.11 0.09 0.00 0.00 178.44 179.04 2nl9 h LYS 279 N 1.25 0.77 -0.86 1.13 1.57 -1.23 -1.04 116.57 118.15 2nl9 h LYS 279 Ca 0.34 -0.35 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2nl9 h LYS 279 Cb -0.13 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.12 2nl9 h LYS 279 CO -0.08 0.97 0.57 1.15 -0.57 0.00 0.00 179.45 181.49 2nl9 h THR 280 N 0.65 1.14 0.21 -0.16 2.02 -0.70 -2.12 112.91 113.96 2nl9 h THR 280 Ca 0.07 -0.37 -0.28 0.00 0.77 0.00 0.00 66.41 66.60 2nl9 h THR 280 Cb 0.83 -0.03 0.03 0.00 -1.74 0.00 0.00 68.15 67.24 2nl9 h THR 280 CO 0.07 0.20 -1.27 0.16 0.37 0.00 0.00 175.52 175.05 2nl9 h ILE 281 N 1.08 1.33 -2.99 3.11 -0.00 -1.28 -3.43 117.51 115.33 2nl9 h ILE 281 Ca 0.34 -2.62 -0.49 0.00 -0.00 0.00 0.00 64.86 62.09 2nl9 h ILE 281 Cb 0.03 3.07 -0.41 0.00 -0.00 0.00 0.00 36.82 39.51 2nl9 h ILE 281 CO -0.10 0.78 -0.76 0.21 -0.00 0.00 0.00 178.15 178.27 2nl9 s ASN 282 N -7.33 2.85 0.19 2.16 3.84 -0.40 -5.01 114.94 111.22 2nl9 s ASN 282 Ca -0.12 -0.89 0.16 0.00 0.21 0.00 0.00 52.86 52.22 2nl9 s ASN 282 Cb 0.03 -0.33 0.77 0.00 -0.55 0.00 0.00 41.25 41.18 2nl9 s ASN 282 CO 0.89 -0.38 1.49 0.00 -2.79 0.00 0.00 177.10 176.32 2nl9 n GLN 283 N 5.24 0.10 0.00 0.43 1.13 -0.81 -0.82 117.38 122.65 2nl9 n GLN 283 Ca -0.07 0.50 0.14 0.00 -1.94 0.00 0.00 57.00 55.63 2nl9 n GLN 283 Cb 0.46 -1.77 0.59 0.00 0.11 0.00 0.00 30.24 29.64 2nl9 n GLN 283 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2nl9 n GLU 284 N -1.97 1.35 -1.95 -1.09 -0.58 -1.26 -4.91 120.64 110.23 2nl9 n GLU 284 Ca 0.00 -0.66 -0.41 0.00 -0.42 0.00 0.00 57.16 55.67 2nl9 n GLU 284 Cb 0.09 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.46 2nl9 n GLU 284 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2nl9 s SER 285 N -2.10 6.56 -0.06 1.62 0.01 0.00 -5.01 113.70 114.72 2nl9 s SER 285 Ca 0.37 2.82 -0.08 0.00 1.31 0.00 0.00 55.95 60.38 2nl9 s SER 285 Cb 0.21 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 2nl9 s SER 285 CO 0.38 -0.73 0.22 0.00 0.41 0.00 0.00 173.24 173.52 2nl9 n ILE 287 N 1.64 0.00 -0.08 0.00 -6.64 -1.26 -4.46 119.36 108.56 2nl9 n ILE 287 Ca -0.16 -0.06 -0.10 0.00 -1.77 0.00 0.00 62.75 60.66 2nl9 n ILE 287 Cb 0.54 0.18 -0.03 0.00 -1.44 0.00 0.00 39.64 38.89 2nl9 n ILE 287 CO 0.00 0.00 0.00 -0.08 -1.77 0.00 0.00 176.55 174.70 2nl9 h GLU 288 N 0.60 0.37 -0.77 6.28 4.57 -1.94 0.29 114.58 123.99 2nl9 h GLU 288 Ca 0.00 -0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.21 2nl9 h GLU 288 Cb 0.47 -0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 28.92 2nl9 h GLU 288 CO 0.00 0.32 0.45 -1.35 -1.18 0.00 0.00 179.01 177.24 2nl9 h PRO 289 N 0.33 0.78 -0.21 0.92 0.11 -1.79 0.20 132.00 132.34 2nl9 h PRO 289 Ca 0.10 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.16 2nl9 h PRO 289 Cb 0.05 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 2nl9 h PRO 289 CO -0.02 0.51 0.12 1.25 -0.21 0.00 0.00 178.00 179.66 2nl9 h LEU 290 N 0.80 0.25 -0.79 2.35 5.85 -1.60 -0.14 115.31 122.04 2nl9 h LEU 290 Ca 0.35 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 2nl9 h LEU 290 Cb 0.24 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2nl9 h LEU 290 CO -0.20 0.25 0.32 0.00 -0.34 0.00 0.00 178.44 178.47 2nl9 h ALA 291 N 1.01 1.02 -0.69 1.25 0.00 -0.43 -0.95 119.26 120.48 2nl9 h ALA 291 Ca 0.07 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2nl9 h ALA 291 Cb 0.05 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2nl9 h ALA 291 CO -0.01 0.64 0.21 0.93 0.00 0.00 0.00 179.25 181.01 2nl9 h GLU 292 N 1.14 1.07 -0.51 0.00 5.08 -0.43 0.38 114.58 121.32 2nl9 h GLU 292 Ca 0.26 -0.23 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 2nl9 h GLU 292 Cb 0.20 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2nl9 h GLU 292 CO -0.02 0.92 0.08 0.66 -1.00 0.00 0.00 179.01 179.64 2nl9 h SER 293 N 1.03 0.81 -0.31 1.42 4.64 -0.36 0.15 113.55 120.93 2nl9 h SER 293 Ca 0.22 -0.26 -0.05 0.00 -0.47 0.00 0.00 61.79 61.23 2nl9 h SER 293 Cb 0.30 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 2nl9 h SER 293 CO -0.01 0.87 0.00 0.40 -0.87 0.00 0.00 176.83 177.22 2nl9 h ILE 294 N 0.72 1.26 -0.67 0.95 2.04 -1.01 -2.10 117.51 118.69 2nl9 h ILE 294 Ca 0.15 -0.94 -0.08 0.00 1.00 0.00 0.00 64.86 65.00 2nl9 h ILE 294 Cb 0.41 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2nl9 h ILE 294 CO 0.01 0.30 0.11 0.74 0.00 0.00 0.00 178.15 179.32 2nl9 h THR 295 N 0.35 1.26 -0.04 -0.27 2.02 -0.73 -1.76 112.91 113.73 2nl9 h THR 295 Ca 0.09 -1.04 0.01 0.00 0.77 0.00 0.00 66.41 66.24 2nl9 h THR 295 Cb 0.43 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2nl9 h THR 295 CO 0.02 0.39 0.00 0.44 0.37 0.00 0.00 175.52 176.74 2nl9 h ASP 296 N 1.04 -0.01 -0.25 4.18 3.32 -0.56 0.36 116.42 124.50 2nl9 h ASP 296 Ca 0.21 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.31 2nl9 h ASP 296 Cb 0.44 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.96 2nl9 h ASP 296 CO 0.01 0.00 -0.02 0.58 -1.72 0.00 0.00 179.24 178.10 2nl9 h VAL 297 N 0.02 0.80 0.34 -1.35 2.07 -1.19 0.26 116.25 117.21 2nl9 h VAL 297 Ca 0.02 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2nl9 h VAL 297 Cb 0.02 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2nl9 h VAL 297 CO -0.03 0.01 -0.17 0.25 0.02 0.00 0.00 177.57 177.66 2nl9 h LEU 298 N 0.06 -0.39 0.01 2.57 5.85 -0.99 -1.26 115.31 121.16 2nl9 h LEU 298 Ca 0.12 -0.11 -0.22 0.00 0.84 0.00 0.00 57.88 58.51 2nl9 h LEU 298 Cb 0.16 0.10 0.02 0.00 0.37 0.00 0.00 40.66 41.31 2nl9 h LEU 298 CO -0.22 -0.11 -0.87 0.58 -0.34 0.00 0.00 178.44 177.49 2nl9 h VAL 299 N -0.68 1.35 -0.06 1.05 2.07 -0.24 -1.34 116.25 118.40 2nl9 h VAL 299 Ca -0.05 -2.20 -0.03 0.00 0.82 0.00 0.00 66.70 65.25 2nl9 h VAL 299 Cb 0.48 2.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.76 2nl9 h VAL 299 CO 0.08 0.66 -0.09 -0.09 0.02 0.00 0.00 177.57 178.15 2nl9 h ARG 300 N 0.16 0.16 0.00 1.57 2.43 -1.03 -0.99 114.38 116.68 2nl9 h ARG 300 Ca -0.11 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 2nl9 h ARG 300 Cb 1.55 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.11 2nl9 h ARG 300 CO 0.17 0.65 -0.28 1.79 -1.51 0.00 0.00 179.97 180.79 2nl9 h THR 301 N -0.32 0.00 -0.03 0.20 1.35 -1.31 -3.27 112.91 109.53 2nl9 h THR 301 Ca 0.01 -1.00 -0.01 0.00 -0.55 0.00 0.00 66.41 64.86 2nl9 h THR 301 Cb 0.63 1.86 -0.01 0.00 -1.73 0.00 0.00 68.15 68.91 2nl9 h THR 301 CO 0.02 0.00 -0.30 0.29 -0.25 0.00 0.00 175.52 175.28 2nl9 n LYS 302 N -2.98 1.54 -0.06 4.72 4.76 -0.50 -4.88 118.16 120.76 2nl9 n LYS 302 Ca 0.03 -3.06 -0.14 0.00 -2.87 0.00 0.00 58.31 52.27 2nl9 n LYS 302 Cb 0.53 -1.60 -0.09 0.00 -1.84 0.00 0.00 35.03 32.04 2nl9 n LYS 302 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 2nl9 h ARG 303 N 0.70 -0.47 -0.14 1.97 9.65 -1.23 0.98 114.38 125.84 2nl9 h ARG 303 Ca 0.01 0.03 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 2nl9 h ARG 303 Cb 1.05 0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.73 2nl9 h ARG 303 CO 0.03 -0.32 -0.43 -0.44 2.80 0.00 0.00 179.97 181.62 2nl9 h ASP 304 N -0.49 0.35 -0.99 -3.80 3.32 -1.89 0.62 116.42 113.54 2nl9 h ASP 304 Ca 0.06 -0.16 0.03 0.00 0.02 0.00 0.00 57.03 56.99 2nl9 h ASP 304 Cb 0.64 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 40.04 2nl9 h ASP 304 CO -0.49 0.74 0.65 -0.25 -1.72 0.00 0.00 179.24 178.17 2nl9 h TRP 305 N 0.28 1.22 -0.08 4.55 7.01 -1.70 -0.62 115.95 126.60 2nl9 h TRP 305 Ca 0.02 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.00 2nl9 h TRP 305 Cb 0.87 -0.41 0.00 0.00 -2.10 0.00 0.00 29.16 27.52 2nl9 h TRP 305 CO 0.02 0.72 -0.16 -0.07 -2.79 0.00 0.00 178.44 176.16 2nl9 h LEU 306 N 1.27 0.28 -0.94 0.65 3.38 -0.23 -3.28 115.31 116.43 2nl9 h LEU 306 Ca 0.39 -0.56 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2nl9 h LEU 306 Cb -0.03 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2nl9 h LEU 306 CO -0.11 0.79 0.37 0.58 0.09 0.00 0.00 178.44 180.15 2nl9 h VAL 307 N -0.21 1.25 0.00 1.22 2.07 -0.54 0.25 116.25 120.28 2nl9 h VAL 307 Ca 0.00 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 2nl9 h VAL 307 Cb 0.74 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2nl9 h VAL 307 CO 0.04 0.30 -0.12 0.50 0.02 0.00 0.00 177.57 178.31 2nl9 h LYS 308 N 1.11 0.00 -0.46 1.57 3.64 -1.18 -0.97 116.57 120.29 2nl9 h LYS 308 Ca 0.27 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.56 2nl9 h LYS 308 Cb 0.12 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.89 2nl9 h LYS 308 CO -0.03 0.12 0.07 0.00 -2.27 0.00 0.00 179.45 177.33 2nl9 n GLN 309 N -3.92 3.33 -3.65 1.90 10.64 -0.65 -4.92 117.38 120.11 2nl9 n GLN 309 Ca -0.02 -3.01 -0.23 0.00 -1.83 0.00 0.00 57.00 51.90 2nl9 n GLN 309 Cb 0.21 -2.02 0.06 0.00 -0.86 0.00 0.00 30.24 27.63 2nl9 n GLN 309 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2nl9 n ARG 310 N -0.31 -6.50 0.00 2.61 1.74 -0.37 -2.96 116.66 110.87 2nl9 n ARG 310 Ca 0.30 0.74 0.00 0.00 -0.77 0.00 0.00 57.85 58.12 2nl9 n ARG 310 Cb 1.10 -5.66 0.00 0.00 -1.02 0.00 0.00 32.46 26.89 2nl9 n ARG 310 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nl9 n GLY 311 N -1.63 4.20 0.09 -0.13 0.00 0.78 -1.67 105.19 106.82 2nl9 n GLY 311 Ca -0.12 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.10 2nl9 n GLY 311 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2nl9 n TRP 312 N 14.00 0.54 -0.31 1.61 7.02 -1.26 -1.51 117.44 137.53 2nl9 n TRP 312 Ca 0.00 0.22 -0.02 0.00 -1.02 0.00 0.00 57.50 56.69 2nl9 n TRP 312 Cb 0.00 -0.86 0.15 0.00 -2.42 0.00 0.00 31.31 28.18 2nl9 n TRP 312 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 2nl9 h ASP 313 N 0.00 1.05 -0.91 -0.99 3.58 -1.51 0.94 116.42 118.59 2nl9 h ASP 313 Ca 0.00 -0.04 0.03 0.00 0.42 0.00 0.00 57.03 57.43 2nl9 h ASP 313 Cb 0.28 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 41.01 2nl9 h ASP 313 CO 0.00 0.78 0.60 1.23 -2.88 0.00 0.00 179.24 178.97 2nl9 h GLY 314 N 1.23 1.32 0.81 -0.78 0.00 -1.16 -0.80 103.07 103.69 2nl9 h GLY 314 Ca 0.33 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2nl9 h GLY 314 CO -0.07 0.41 -0.08 -2.75 0.00 0.00 0.00 176.54 174.05 2nl9 h PHE 315 N 1.17 -0.22 -0.73 5.60 3.57 -1.44 -0.90 116.94 123.99 2nl9 h PHE 315 Ca 0.35 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.93 2nl9 h PHE 315 Cb -0.04 0.07 -0.07 0.00 2.79 0.00 0.00 35.95 38.71 2nl9 h PHE 315 CO -0.01 0.02 0.40 0.28 -2.23 0.00 0.00 178.31 176.76 2nl9 h VAL 316 N -0.43 0.92 0.05 1.41 2.07 -0.60 -2.29 116.25 117.37 2nl9 h VAL 316 Ca -0.02 -0.24 -0.25 0.00 0.82 0.00 0.00 66.70 67.01 2nl9 h VAL 316 Cb 0.33 0.16 0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2nl9 h VAL 316 CO 0.04 0.13 -1.06 -0.33 0.02 0.00 0.00 177.57 176.36 2nl9 h GLU 317 N 0.69 0.38 -0.89 1.57 4.39 -1.13 -1.97 114.58 117.62 2nl9 h GLU 317 Ca 0.34 -0.48 0.01 0.00 0.34 0.00 0.00 59.36 59.57 2nl9 h GLU 317 Cb 0.29 0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.05 2nl9 h GLU 317 CO -0.23 1.16 0.59 0.35 -1.16 0.00 0.00 179.01 179.73 2nl9 h PHE 318 N 0.18 1.12 -0.62 4.33 3.57 -0.85 -2.40 116.94 122.27 2nl9 h PHE 318 Ca -0.11 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2nl9 h PHE 318 Cb 1.73 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 40.09 2nl9 h PHE 318 CO 0.07 0.70 0.00 1.19 -2.23 0.00 0.00 178.31 178.04 2nl9 n PHE 319 N -4.40 1.31 -2.25 0.41 3.01 -0.89 -4.97 117.46 109.69 2nl9 n PHE 319 Ca 0.10 -0.60 -0.42 0.00 1.01 0.00 0.00 57.45 57.54 2nl9 n PHE 319 Cb 0.02 -0.20 -0.03 0.00 -0.01 0.00 0.00 39.48 39.27 2nl9 n PHE 319 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2nl9 s HIS 320 N -1.71 3.22 -0.02 1.38 2.46 -0.75 -5.03 115.29 114.85 2nl9 s HIS 320 Ca 0.49 1.02 0.06 0.00 0.47 0.00 0.00 55.06 57.10 2nl9 s HIS 320 Cb 0.30 -3.61 -0.03 0.00 -0.13 0.00 0.00 32.58 29.12 2nl9 s HIS 320 CO 0.25 -2.09 -0.19 0.14 -2.47 0.00 0.00 174.74 170.37 2nl9 s VAL 321 N 1.35 2.67 -3.00 0.89 -7.23 -1.26 -5.04 120.40 108.79 2nl9 s VAL 321 Ca 0.63 -0.96 0.24 0.00 -1.81 0.00 0.00 61.98 60.08 2nl9 s VAL 321 Cb -0.34 -2.03 0.19 0.00 0.56 0.00 0.00 36.38 34.76 2nl9 s VAL 321 CO 0.29 0.53 1.26 -0.62 -0.31 0.00 0.00 175.10 176.25