#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wb0 s VAL 178 N 0.00 5.32 0.32 1.39 1.01 -1.26 -5.08 120.40 122.10 2wb0 s VAL 178 Ca 0.00 -0.08 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 2wb0 s VAL 178 Cb 0.00 -3.42 -0.13 0.00 0.00 0.00 0.00 36.38 32.84 2wb0 s VAL 178 CO 0.00 0.43 1.26 -1.54 0.00 0.00 0.00 175.10 175.25 2wb0 n SER 179 N 1.34 2.53 -0.23 3.32 3.41 -1.26 -4.91 113.62 117.81 2wb0 n SER 179 Ca -0.14 1.19 0.04 0.00 -0.26 0.00 0.00 58.87 59.70 2wb0 n SER 179 Cb 0.53 -1.45 0.15 0.00 -0.26 0.00 0.00 64.21 63.18 2wb0 n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wb0 h ALA 180 N 2.69 0.78 -0.50 7.33 0.00 -1.89 -2.45 119.26 125.22 2wb0 h ALA 180 Ca -0.45 0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.75 2wb0 h ALA 180 Cb 1.29 0.31 -0.08 0.00 0.00 0.00 0.00 17.79 19.31 2wb0 h ALA 180 CO 0.64 -0.38 0.02 2.35 0.00 0.00 0.00 179.25 181.88 2wb0 h TRP 181 N 0.17 0.01 -0.38 0.00 7.01 -1.91 0.13 115.95 120.97 2wb0 h TRP 181 Ca 0.38 0.04 -0.07 0.00 2.11 0.00 0.00 58.89 61.35 2wb0 h TRP 181 Cb 0.65 0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.76 2wb0 h TRP 181 CO -0.34 -0.09 -0.05 0.93 -2.79 0.00 0.00 178.44 176.10 2wb0 h GLU 182 N 0.14 0.63 -0.15 2.65 5.08 -1.83 -0.00 114.58 121.09 2wb0 h GLU 182 Ca 0.25 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2wb0 h GLU 182 Cb 0.37 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2wb0 h GLU 182 CO -0.40 0.69 -0.01 -0.22 -1.00 0.00 0.00 179.01 178.07 2wb0 h LYS 183 N 0.59 0.27 -0.44 2.33 3.64 -0.82 -1.90 116.57 120.24 2wb0 h LYS 183 Ca 0.12 -0.09 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 2wb0 h LYS 183 Cb 0.44 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.16 2wb0 h LYS 183 CO 0.02 0.51 -0.11 0.78 -2.27 0.00 0.00 179.45 178.39 2wb0 h GLY 184 N 0.00 0.33 1.02 5.01 0.00 -0.65 -2.54 103.07 106.25 2wb0 h GLY 184 Ca 0.04 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.51 2wb0 h GLY 184 CO 0.01 -0.17 0.55 -0.33 0.00 0.00 0.00 176.54 176.61 2wb0 h MET 185 N 0.01 1.24 -0.05 4.80 2.86 -0.73 -1.04 114.93 122.01 2wb0 h MET 185 Ca 0.21 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2wb0 h MET 185 Cb 0.33 -0.26 -0.00 0.00 0.06 0.00 0.00 31.60 31.72 2wb0 h MET 185 CO -0.45 0.87 0.03 1.49 1.06 0.00 0.00 176.91 179.90 2wb0 h GLU 186 N 1.26 0.07 -0.79 1.72 4.81 -0.96 -0.57 114.58 120.12 2wb0 h GLU 186 Ca 0.33 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.57 2wb0 h GLU 186 Cb -0.06 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 2wb0 h GLU 186 CO -0.06 0.13 0.52 0.00 -0.73 0.00 0.00 179.01 178.86 2wb0 h ALA 187 N 0.94 1.02 -0.28 2.92 0.00 -1.21 0.15 119.26 122.80 2wb0 h ALA 187 Ca 0.02 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 2wb0 h ALA 187 Cb 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2wb0 h ALA 187 CO -0.00 0.38 -0.50 0.00 0.00 0.00 0.00 179.25 179.12 2wb0 h ALA 188 N 1.31 0.43 -0.42 0.00 0.00 -1.04 -1.56 119.26 117.98 2wb0 h ALA 188 Ca 0.30 -0.50 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2wb0 h ALA 188 Cb -0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2wb0 h ALA 188 CO -0.08 0.61 -0.15 -0.09 0.00 0.00 0.00 179.25 179.55 2wb0 h ARG 189 N 0.59 0.77 -0.14 0.00 9.65 -0.76 -0.20 114.38 124.29 2wb0 h ARG 189 Ca 0.02 -0.27 0.04 0.00 -1.10 0.00 0.00 59.98 58.66 2wb0 h ARG 189 Cb 1.11 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.60 2wb0 h ARG 189 CO 0.11 0.87 -0.09 0.00 2.80 0.00 0.00 179.97 183.67 2wb0 h ALA 190 N 1.15 0.03 -0.39 2.80 0.00 -0.50 0.37 119.26 122.72 2wb0 h ALA 190 Ca 0.11 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.14 2wb0 h ALA 190 Cb 0.63 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 2wb0 h ALA 190 CO 0.04 -0.53 0.10 -0.07 0.00 0.00 0.00 179.25 178.79 2wb0 h LEU 191 N -0.09 0.05 -0.83 0.00 4.07 -1.10 -0.74 115.31 116.68 2wb0 h LEU 191 Ca 0.09 0.06 -0.12 0.00 0.08 0.00 0.00 57.88 57.98 2wb0 h LEU 191 Cb 0.21 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.01 2wb0 h LEU 191 CO -0.20 0.06 -0.56 0.24 -1.08 0.00 0.00 178.44 176.90 2wb0 h MET 192 N 0.23 0.07 0.20 1.13 2.86 -0.43 -1.25 114.93 117.74 2wb0 h MET 192 Ca 0.19 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2wb0 h MET 192 Cb 0.21 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2wb0 h MET 192 CO -0.23 0.62 -0.09 -0.44 1.06 0.00 0.00 176.91 177.82 2wb0 h ASP 193 N 0.06 -0.22 -0.93 1.22 3.32 -0.03 -0.92 116.42 118.91 2wb0 h ASP 193 Ca -0.00 -0.30 0.12 0.00 0.02 0.00 0.00 57.03 56.86 2wb0 h ASP 193 Cb 1.01 0.06 -0.07 0.00 0.22 0.00 0.00 39.33 40.54 2wb0 h ASP 193 CO 0.08 0.24 0.60 0.50 -1.72 0.00 0.00 179.24 178.94 2wb0 h LYS 194 N -0.76 0.86 -0.64 3.56 3.64 -0.97 -1.00 116.57 121.26 2wb0 h LYS 194 Ca -0.03 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2wb0 h LYS 194 Cb 0.51 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2wb0 h LYS 194 CO 0.04 0.57 0.00 0.66 -2.27 0.00 0.00 179.45 178.45 2wb0 n TYR 195 N -4.57 1.32 -3.79 1.91 4.01 -0.49 -4.96 117.16 110.60 2wb0 n TYR 195 Ca 0.17 -0.53 -0.25 0.00 -0.16 0.00 0.00 57.90 57.13 2wb0 n TYR 195 Cb 0.36 -0.23 0.03 0.00 -0.31 0.00 0.00 39.34 39.20 2wb0 n TYR 195 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2wb0 n HIS 196 N 0.97 -2.07 -2.39 -0.72 8.25 -0.38 -4.88 115.22 113.99 2wb0 n HIS 196 Ca 0.23 0.87 -0.37 0.00 -0.26 0.00 0.00 57.72 58.18 2wb0 n HIS 196 Cb 0.80 -4.23 -0.03 0.00 1.12 0.00 0.00 29.99 27.66 2wb0 n HIS 196 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2wb0 s VAL 197 N -3.53 3.37 0.20 1.59 -7.23 -0.39 -4.95 120.40 109.46 2wb0 s VAL 197 Ca 0.27 1.09 -0.23 0.00 -1.81 0.00 0.00 61.98 61.30 2wb0 s VAL 197 Cb -0.13 -3.58 -0.14 0.00 0.56 0.00 0.00 36.38 33.08 2wb0 s VAL 197 CO 0.82 0.04 0.38 -0.67 -0.31 0.00 0.00 175.10 175.36 2wb0 n ASP 198 N -0.09 -1.30 -0.01 4.85 2.03 -1.26 -4.69 116.55 116.08 2wb0 n ASP 198 Ca 0.05 0.91 -0.09 0.00 0.52 0.00 0.00 54.79 56.18 2wb0 n ASP 198 Cb 0.48 -0.79 0.06 0.00 -0.72 0.00 0.00 41.12 40.15 2wb0 n ASP 198 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2wb0 h ASN 199 N 0.75 0.64 -0.40 1.67 -0.26 -1.99 -1.43 115.58 114.55 2wb0 h ASN 199 Ca -0.25 -0.32 -0.03 0.00 -0.56 0.00 0.00 56.30 55.14 2wb0 h ASN 199 Cb 1.22 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 38.28 2wb0 h ASN 199 CO 0.47 1.03 0.12 0.44 -1.06 0.00 0.00 177.43 178.43 2wb0 h ASP 200 N 0.46 0.58 -1.00 5.81 3.32 -1.99 0.95 116.42 124.55 2wb0 h ASP 200 Ca 0.02 -0.21 0.04 0.00 0.02 0.00 0.00 57.03 56.90 2wb0 h ASP 200 Cb 1.04 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 40.38 2wb0 h ASP 200 CO 0.10 0.64 0.66 -0.07 -1.72 0.00 0.00 179.24 178.84 2wb0 h LEU 201 N 0.50 1.10 -0.28 1.55 3.38 -1.84 -0.20 115.31 119.52 2wb0 h LEU 201 Ca 0.13 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2wb0 h LEU 201 Cb 0.27 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2wb0 h LEU 201 CO -0.00 0.75 -0.02 0.11 0.09 0.00 0.00 178.44 179.37 2wb0 h LYS 202 N 1.27 0.50 -0.66 1.13 1.57 -0.85 -2.34 116.57 117.19 2wb0 h LYS 202 Ca 0.40 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.98 2wb0 h LYS 202 Cb -0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2wb0 h LYS 202 CO -0.12 0.67 0.30 0.00 -0.57 0.00 0.00 179.45 179.73 2wb0 h ALA 203 N 0.81 0.86 0.00 3.86 0.00 -0.18 -3.00 119.26 121.61 2wb0 h ALA 203 Ca 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2wb0 h ALA 203 Cb 0.46 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2wb0 h ALA 203 CO 0.02 0.44 -0.44 0.09 0.00 0.00 0.00 179.25 179.35 2wb0 n ASN 204 N -4.45 0.47 -4.74 0.00 5.03 -0.14 -4.90 115.26 106.52 2wb0 n ASN 204 Ca 0.05 -0.04 -0.41 0.00 0.87 0.00 0.00 54.58 55.04 2wb0 n ASN 204 Cb 0.14 0.10 -0.02 0.00 -1.02 0.00 0.00 39.78 38.97 2wb0 n ASN 204 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2wb0 s PHE 205 N -3.04 3.01 -0.02 3.10 5.36 -0.88 -4.91 117.98 120.60 2wb0 s PHE 205 Ca 0.10 0.98 0.08 0.00 -0.96 0.00 0.00 56.93 57.14 2wb0 s PHE 205 Cb 0.17 -3.84 0.14 0.00 -0.34 0.00 0.00 43.02 39.15 2wb0 s PHE 205 CO 0.68 -2.77 1.06 1.63 -1.46 0.00 0.00 175.22 174.36 2wb0 n LYS 206 N 2.46 0.19 -2.39 10.12 4.76 -1.26 -5.00 118.16 127.04 2wb0 n LYS 206 Ca 0.07 -1.46 -0.16 0.00 -2.87 0.00 0.00 58.31 53.89 2wb0 n LYS 206 Cb 0.40 -0.54 -0.01 0.00 -1.84 0.00 0.00 35.03 33.04 2wb0 n LYS 206 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 2wb0 n LEU 207 N -0.08 -1.46 -4.89 -0.35 0.00 -1.26 -4.96 117.00 104.00 2wb0 n LEU 207 Ca 0.04 0.12 -0.29 0.00 0.00 0.00 0.00 56.01 55.88 2wb0 n LEU 207 Cb 0.79 -2.47 -0.03 0.00 0.00 0.00 0.00 43.42 41.72 2wb0 n LEU 207 CO -0.01 -0.19 0.35 -0.76 0.00 0.00 0.00 177.39 176.79 2wb0 s LEU 208 N -5.73 3.88 0.44 -1.96 2.01 -1.26 -4.98 118.68 111.07 2wb0 s LEU 208 Ca 0.00 0.93 0.13 0.00 0.01 0.00 0.00 54.13 55.19 2wb0 s LEU 208 Cb 0.00 -3.80 0.97 0.00 0.01 0.00 0.00 46.19 43.37 2wb0 s LEU 208 CO 0.00 -0.36 2.01 -0.65 1.01 0.00 0.00 176.35 178.36 2wb0 h PRO 209 N 1.19 0.12 -0.01 1.29 0.10 -1.96 -0.90 132.00 131.83 2wb0 h PRO 209 Ca -0.47 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 65.61 2wb0 h PRO 209 Cb 1.19 -0.02 0.00 0.00 0.10 0.00 0.00 31.00 32.27 2wb0 h PRO 209 CO 0.64 0.22 -0.10 -0.40 0.10 0.00 0.00 178.00 178.47 2wb0 n ASP 210 N -4.37 1.02 -4.55 -2.05 5.75 -1.26 -4.67 116.55 106.42 2wb0 n ASP 210 Ca -0.02 -1.09 -0.42 0.00 -0.01 0.00 0.00 54.79 53.25 2wb0 n ASP 210 Cb 0.20 0.02 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 2wb0 n ASP 210 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2wb0 s GLN 211 N -2.24 3.74 -0.04 0.11 -0.21 -0.35 -4.66 119.66 116.02 2wb0 s GLN 211 Ca 0.33 -1.55 0.07 0.00 0.02 0.00 0.00 55.36 54.24 2wb0 s GLN 211 Cb 0.20 -5.35 -0.11 0.00 1.00 0.00 0.00 33.01 28.76 2wb0 s GLN 211 CO 0.42 -2.15 0.10 0.28 -2.12 0.00 0.00 175.29 171.82 2wb0 n VAL 212 N 6.44 0.24 -0.15 1.09 0.31 -1.26 -4.72 118.33 120.29 2wb0 n VAL 212 Ca 0.37 -0.24 -0.02 0.00 -0.01 0.00 0.00 64.34 64.43 2wb0 n VAL 212 Cb 0.49 -0.22 0.06 0.00 -0.91 0.00 0.00 33.84 33.25 2wb0 n VAL 212 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2wb0 h GLU 213 N 0.00 0.12 -0.19 5.55 4.81 -1.98 0.18 114.58 123.08 2wb0 h GLU 213 Ca -0.10 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 2wb0 h GLU 213 Cb 0.89 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 2wb0 h GLU 213 CO 0.01 0.08 -0.08 0.00 -0.73 0.00 0.00 179.01 178.28 2wb0 h ALA 214 N 1.42 1.52 0.10 2.92 0.00 -1.90 -0.39 119.26 122.94 2wb0 h ALA 214 Ca 0.24 -0.19 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 2wb0 h ALA 214 Cb 0.36 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.06 2wb0 h ALA 214 CO -0.39 0.34 -1.17 -0.07 0.00 0.00 0.00 179.25 177.96 2wb0 h LEU 215 N 0.27 0.47 -1.14 0.00 3.38 -1.56 -2.12 115.31 114.61 2wb0 h LEU 215 Ca 0.06 -0.46 -0.05 0.00 0.09 0.00 0.00 57.88 57.52 2wb0 h LEU 215 Cb 0.33 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2wb0 h LEU 215 CO 0.02 1.33 0.10 0.00 0.09 0.00 0.00 178.44 179.97 2wb0 h ALA 216 N 0.61 1.30 -0.35 1.53 0.00 -0.40 -1.94 119.26 120.01 2wb0 h ALA 216 Ca -0.12 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 2wb0 h ALA 216 Cb 1.87 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.45 2wb0 h ALA 216 CO 0.20 0.49 -0.17 0.00 0.00 0.00 0.00 179.25 179.76 2wb0 h ALA 217 N 1.43 1.04 -0.17 0.00 0.00 -0.89 0.13 119.26 120.81 2wb0 h ALA 217 Ca 0.15 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.77 2wb0 h ALA 217 Cb 0.28 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2wb0 h ALA 217 CO 0.00 0.58 -0.06 0.28 0.00 0.00 0.00 179.25 180.05 2wb0 h VAL 218 N 0.58 0.80 -0.36 0.00 2.07 -1.06 -1.20 116.25 117.08 2wb0 h VAL 218 Ca 0.09 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.56 2wb0 h VAL 218 Cb 0.62 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2wb0 h VAL 218 CO 0.04 0.00 0.04 0.00 0.02 0.00 0.00 177.57 177.67 2wb0 h LYS 220 N 0.44 1.01 -0.59 0.00 1.63 -0.71 0.46 116.57 118.81 2wb0 h LYS 220 Ca 0.11 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2wb0 h LYS 220 Cb 0.40 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.86 2wb0 h LYS 220 CO 0.01 0.89 0.39 1.15 -3.45 0.00 0.00 179.45 178.44 2wb0 h THR 221 N 0.94 1.16 -0.67 1.00 2.02 -0.94 0.41 112.91 116.84 2wb0 h THR 221 Ca 0.21 -0.30 -0.07 0.00 0.77 0.00 0.00 66.41 67.02 2wb0 h THR 221 Cb 0.31 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 2wb0 h THR 221 CO -0.01 0.15 0.15 -0.25 0.37 0.00 0.00 175.52 175.94 2wb0 h TRP 222 N 0.80 1.12 0.44 3.16 7.01 -0.38 -2.13 115.95 125.98 2wb0 h TRP 222 Ca 0.22 -0.13 -0.02 0.00 2.11 0.00 0.00 58.89 61.06 2wb0 h TRP 222 Cb -0.08 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 26.67 2wb0 h TRP 222 CO -0.03 0.92 -0.21 -0.07 -2.79 0.00 0.00 178.44 176.26 2wb0 h LEU 223 N 1.01 -0.50 -1.87 0.65 4.07 -0.66 0.60 115.31 118.61 2wb0 h LEU 223 Ca 0.21 0.01 0.21 0.00 0.08 0.00 0.00 57.88 58.38 2wb0 h LEU 223 Cb 0.38 0.13 -0.03 0.00 1.08 0.00 0.00 40.66 42.22 2wb0 h LEU 223 CO 0.00 -0.34 0.65 0.78 -1.08 0.00 0.00 178.44 178.46 2wb0 h ASN 224 N -0.61 0.00 0.00 -0.43 -0.26 -0.72 0.50 115.58 114.06 2wb0 h ASN 224 Ca -0.06 0.00 -0.40 0.00 -0.56 0.00 0.00 56.30 55.28 2wb0 h ASN 224 Cb 0.46 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 37.66 2wb0 h ASN 224 CO 0.10 0.00 -2.43 1.21 -1.06 0.00 0.00 177.43 175.25 2wb0 n GLU 225 N -3.84 0.59 -0.00 0.81 2.13 -0.82 -4.50 120.64 115.00 2wb0 n GLU 225 Ca 0.15 0.19 0.08 0.00 0.66 0.00 0.00 57.16 58.24 2wb0 n GLU 225 Cb 0.91 -1.46 -0.11 0.00 0.27 0.00 0.00 31.44 31.05 2wb0 n GLU 225 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2wb0 n GLU 226 N -3.67 1.07 -2.71 5.31 -0.58 0.21 -4.76 120.64 115.51 2wb0 n GLU 226 Ca -0.47 -0.07 -0.06 0.00 -0.42 0.00 0.00 57.16 56.14 2wb0 n GLU 226 Cb 0.92 -1.34 0.06 0.00 -0.57 0.00 0.00 31.44 30.51 2wb0 n GLU 226 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2wb0 n HIS 227 N -1.71 0.03 0.29 -0.32 8.25 0.17 -4.92 115.22 117.01 2wb0 n HIS 227 Ca 0.00 -2.35 0.13 0.00 -0.26 0.00 0.00 57.72 55.25 2wb0 n HIS 227 Cb 0.34 0.30 0.84 0.00 1.12 0.00 0.00 29.99 32.59 2wb0 n HIS 227 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wb0 h ARG 228 N 2.49 0.00 -0.62 -0.41 3.08 -1.73 -1.36 114.38 115.83 2wb0 h ARG 228 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.87 2wb0 h ARG 228 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2wb0 h ARG 228 CO 0.23 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.56 2wb0 n GLY 229 N -1.30 2.15 3.74 0.04 0.00 -1.26 -4.97 105.19 103.59 2wb0 n GLY 229 Ca -0.03 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 2wb0 n GLY 229 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wb0 s LEU 230 N -1.52 4.36 -0.26 0.99 2.96 -0.51 -4.95 118.68 119.74 2wb0 s LEU 230 Ca 0.41 2.79 -0.10 0.00 -0.22 0.00 0.00 54.13 57.02 2wb0 s LEU 230 Cb 0.26 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 2wb0 s LEU 230 CO 0.20 -0.85 0.14 -1.10 -1.32 0.00 0.00 176.35 173.42 2wb0 s GLN 231 N 0.17 3.87 0.16 1.98 -0.21 -1.26 -5.10 119.66 119.28 2wb0 s GLN 231 Ca 0.66 -0.36 0.01 0.00 0.02 0.00 0.00 55.36 55.69 2wb0 s GLN 231 Cb -0.46 -3.51 -0.04 0.00 1.00 0.00 0.00 33.01 30.00 2wb0 s GLN 231 CO 0.40 -0.13 0.32 -0.51 -2.12 0.00 0.00 175.29 173.26 2wb0 s LEU 232 N 1.54 4.30 -0.15 2.90 1.43 -1.26 -5.08 118.68 122.37 2wb0 s LEU 232 Ca 0.07 0.25 -0.03 0.00 -1.03 0.00 0.00 54.13 53.39 2wb0 s LEU 232 Cb -0.15 -3.00 0.05 0.00 0.03 0.00 0.00 46.19 43.12 2wb0 s LEU 232 CO 0.07 0.03 0.03 -0.89 0.23 0.00 0.00 176.35 175.82 2wb0 s THR 233 N -1.77 0.40 -1.52 5.49 2.01 -1.26 -4.75 115.64 114.24 2wb0 s THR 233 Ca 0.36 -0.29 -0.13 0.00 0.31 0.00 0.00 61.69 61.94 2wb0 s THR 233 Cb -0.11 -0.81 0.08 0.00 0.01 0.00 0.00 72.50 71.67 2wb0 s THR 233 CO 0.29 -0.07 0.94 0.49 -0.69 0.00 0.00 174.62 175.58 2wb0 n PHE 234 N 5.11 -2.28 -4.21 4.92 3.72 -1.26 -4.31 117.46 119.15 2wb0 n PHE 234 Ca -0.08 0.86 -0.18 0.00 -0.05 0.00 0.00 57.45 58.00 2wb0 n PHE 234 Cb 0.48 -3.95 -0.15 0.00 -0.94 0.00 0.00 39.48 34.92 2wb0 n PHE 234 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2wb0 s THR 235 N -3.26 0.52 0.30 4.37 2.01 -1.26 -3.30 115.64 115.02 2wb0 s THR 235 Ca 0.63 -0.23 -0.18 0.00 0.31 0.00 0.00 61.69 62.22 2wb0 s THR 235 Cb -0.32 -0.47 -0.09 0.00 0.01 0.00 0.00 72.50 71.63 2wb0 s THR 235 CO 0.78 0.17 0.77 -0.94 -0.69 0.00 0.00 174.62 174.71 2wb0 s SER 236 N 0.17 6.93 0.26 3.53 1.04 -0.27 -4.92 113.70 120.45 2wb0 s SER 236 Ca -0.02 1.41 -0.02 0.00 0.48 0.00 0.00 55.95 57.80 2wb0 s SER 236 Cb -0.06 -2.42 0.46 0.00 0.10 0.00 0.00 66.02 64.09 2wb0 s SER 236 CO -0.00 -0.13 1.82 0.78 0.98 0.00 0.00 173.24 176.69 2wb0 h ASN 237 N 2.68 0.80 -0.44 7.02 2.35 -2.00 -0.60 115.58 125.39 2wb0 h ASN 237 Ca -0.48 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.29 2wb0 h ASN 237 Cb 1.18 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.42 2wb0 h ASN 237 CO 0.65 0.44 0.18 0.50 -1.65 0.00 0.00 177.43 177.55 2wb0 h LYS 238 N 0.90 0.65 -0.46 0.81 3.64 -1.95 -1.99 116.57 118.17 2wb0 h LYS 238 Ca 0.44 -0.12 -0.14 0.00 -1.27 0.00 0.00 60.65 59.56 2wb0 h LYS 238 Cb 0.40 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2wb0 h LYS 238 CO -0.25 0.59 -0.27 1.15 -2.27 0.00 0.00 179.45 178.41 2wb0 h THR 239 N 0.57 1.27 -0.15 1.00 2.02 -1.66 -0.29 112.91 115.66 2wb0 h THR 239 Ca 0.15 -1.44 0.02 0.00 0.77 0.00 0.00 66.41 65.91 2wb0 h THR 239 Cb 0.18 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 2wb0 h THR 239 CO -0.01 0.49 0.03 0.15 0.37 0.00 0.00 175.52 176.55 2wb0 h PHE 240 N 0.84 0.05 -0.68 3.16 3.57 -0.87 -1.54 116.94 121.46 2wb0 h PHE 240 Ca 0.10 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 2wb0 h PHE 240 Cb 0.85 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 2wb0 h PHE 240 CO 0.06 0.02 0.19 0.28 -2.23 0.00 0.00 178.31 176.63 2wb0 h VAL 241 N 0.09 1.26 -0.96 1.41 2.07 -1.23 -0.50 116.25 118.38 2wb0 h VAL 241 Ca 0.07 -0.91 0.01 0.00 0.82 0.00 0.00 66.70 66.69 2wb0 h VAL 241 Cb 0.06 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2wb0 h VAL 241 CO -0.09 0.35 0.63 0.74 0.02 0.00 0.00 177.57 179.22 2wb0 h THR 242 N 1.00 1.25 -0.23 2.57 2.02 -0.91 0.44 112.91 119.05 2wb0 h THR 242 Ca 0.22 -0.46 -0.12 0.00 0.77 0.00 0.00 66.41 66.81 2wb0 h THR 242 Cb 0.33 -0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 66.57 2wb0 h THR 242 CO -0.00 0.24 -0.34 0.24 0.37 0.00 0.00 175.52 176.03 2wb0 h MET 243 N 1.31 0.63 -0.87 6.66 2.07 -0.88 -0.97 114.93 122.88 2wb0 h MET 243 Ca 0.35 -0.38 0.13 0.00 -2.07 0.00 0.00 59.70 57.74 2wb0 h MET 243 Cb -0.14 0.03 -0.09 0.00 -1.87 0.00 0.00 31.60 29.53 2wb0 h MET 243 CO -0.07 0.99 0.48 0.52 1.07 0.00 0.00 176.91 179.89 2wb0 h MET 244 N 0.34 0.70 -0.55 1.72 2.86 -0.90 -1.26 114.93 117.83 2wb0 h MET 244 Ca 0.02 -0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.70 2wb0 h MET 244 Cb 0.92 -0.16 -0.06 0.00 0.06 0.00 0.00 31.60 32.36 2wb0 h MET 244 CO 0.08 0.46 0.20 0.78 1.06 0.00 0.00 176.91 179.49 2wb0 h GLY 245 N 0.72 0.74 1.19 8.32 0.00 -0.34 0.18 103.07 113.87 2wb0 h GLY 245 Ca 0.46 -0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.61 2wb0 h GLY 245 CO -0.32 0.00 0.14 3.21 0.00 0.00 0.00 176.54 179.57 2wb0 h ARG 246 N 0.38 1.00 -0.37 4.80 3.08 -0.57 0.45 114.38 123.17 2wb0 h ARG 246 Ca 0.27 -0.23 -0.14 0.00 0.07 0.00 0.00 59.98 59.94 2wb0 h ARG 246 Cb 0.30 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 2wb0 h ARG 246 CO -0.27 0.90 -0.33 0.74 -1.07 0.00 0.00 179.97 179.94 2wb0 h PHE 247 N 0.96 0.97 -0.18 3.04 0.04 -0.51 -0.19 116.94 121.06 2wb0 h PHE 247 Ca 0.20 -0.27 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 2wb0 h PHE 247 Cb 0.36 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 2wb0 h PHE 247 CO 0.02 1.04 0.06 1.25 -0.60 0.00 0.00 178.31 180.09 2wb0 h LEU 248 N 0.69 0.26 -0.73 1.54 6.46 -0.48 -1.33 115.31 121.71 2wb0 h LEU 248 Ca 0.07 -0.19 0.16 0.00 -0.12 0.00 0.00 57.88 57.81 2wb0 h LEU 248 Cb 0.89 -0.07 -0.12 0.00 -0.73 0.00 0.00 40.66 40.63 2wb0 h LEU 248 CO 0.08 0.37 0.10 -0.61 -0.62 0.00 0.00 178.44 177.76 2wb0 h GLN 249 N 0.12 0.18 -0.49 1.25 4.15 -0.82 0.29 115.11 119.79 2wb0 h GLN 249 Ca 0.06 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 2wb0 h GLN 249 Cb 0.20 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 2wb0 h GLN 249 CO -0.00 0.12 0.04 0.00 -1.93 0.00 0.00 178.83 177.06 2wb0 h ALA 250 N 1.64 1.16 -0.27 3.38 0.00 -0.30 -1.11 119.26 123.75 2wb0 h ALA 250 Ca 0.41 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2wb0 h ALA 250 Cb 0.71 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2wb0 h ALA 250 CO -0.57 0.55 -0.52 1.88 0.00 0.00 0.00 179.25 180.59 2wb0 h TYR 251 N 0.75 0.98 -0.37 0.00 0.05 -0.20 -1.07 116.97 117.10 2wb0 h TYR 251 Ca 0.15 -0.34 -0.03 0.00 0.05 0.00 0.00 58.73 58.57 2wb0 h TYR 251 Cb 0.39 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.93 2wb0 h TYR 251 CO 0.02 1.14 0.13 -0.07 -1.05 0.00 0.00 178.16 178.33 2wb0 h LEU 252 N 0.61 0.53 -0.09 3.88 -0.00 -0.81 0.30 115.31 119.74 2wb0 h LEU 252 Ca 0.02 -0.19 0.01 0.00 -0.00 0.00 0.00 57.88 57.72 2wb0 h LEU 252 Cb 1.10 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 41.62 2wb0 h LEU 252 CO 0.11 0.58 0.04 1.56 -0.00 0.00 0.00 178.44 180.72 2wb0 h GLN 253 N 0.45 0.08 -0.40 1.13 4.20 -1.18 -0.83 115.11 118.56 2wb0 h GLN 253 Ca 0.12 -0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.88 2wb0 h GLN 253 Cb 0.23 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 2wb0 h GLN 253 CO -0.01 0.05 0.13 0.77 -0.67 0.00 0.00 178.83 179.11 2wb0 h SER 254 N 0.08 0.14 0.06 1.46 0.02 -0.98 0.17 113.55 114.50 2wb0 h SER 254 Ca 0.04 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2wb0 h SER 254 Cb 0.01 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.54 2wb0 h SER 254 CO -0.03 0.11 -0.28 0.15 -1.14 0.00 0.00 176.83 175.65 2wb0 h PHE 255 N 0.29 -0.75 0.00 3.45 3.57 -0.08 -2.61 116.94 120.81 2wb0 h PHE 255 Ca 0.18 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2wb0 h PHE 255 Cb 0.17 0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.23 2wb0 h PHE 255 CO -0.15 -0.38 0.00 0.00 -2.23 0.00 0.00 178.31 175.55 2wb0 h ALA 256 N 0.30 1.00 -5.87 2.41 0.00 -1.03 -3.48 119.26 112.60 2wb0 h ALA 256 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.56 2wb0 h ALA 256 Cb 0.51 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.43 2wb0 h ALA 256 CO -0.20 0.00 -0.69 0.39 0.00 0.00 0.00 179.25 178.75 2wb0 n GLU 257 N -2.41 -7.74 -3.95 0.00 1.02 0.45 -4.44 120.64 103.58 2wb0 n GLU 257 Ca 0.03 0.82 -0.35 0.00 -0.02 0.00 0.00 57.16 57.63 2wb0 n GLU 257 Cb 0.31 -5.86 -0.08 0.00 -0.02 0.00 0.00 31.44 25.79 2wb0 n GLU 257 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2wb0 s VAL 258 N -3.32 5.09 -0.00 2.62 -7.23 -0.35 -4.85 120.40 112.36 2wb0 s VAL 258 Ca 0.55 0.07 0.01 0.00 -1.81 0.00 0.00 61.98 60.80 2wb0 s VAL 258 Cb -0.24 -3.26 -0.00 0.00 0.56 0.00 0.00 36.38 33.43 2wb0 s VAL 258 CO 0.74 0.52 -0.04 0.42 -0.31 0.00 0.00 175.10 176.42 2wb0 s THR 259 N -0.19 0.34 -0.25 5.32 -4.23 -1.26 -4.44 115.64 110.92 2wb0 s THR 259 Ca 0.09 -0.23 -0.06 0.00 -1.18 0.00 0.00 61.69 60.32 2wb0 s THR 259 Cb -0.12 -0.30 -0.00 0.00 1.34 0.00 0.00 72.50 73.42 2wb0 s THR 259 CO 0.01 0.06 0.03 -0.31 -0.54 0.00 0.00 174.62 173.87 2wb0 s TYR 260 N -0.17 3.06 0.32 3.99 2.02 -1.26 -5.08 117.35 120.23 2wb0 s TYR 260 Ca 0.01 -0.87 -0.29 0.00 -0.37 0.00 0.00 57.07 55.55 2wb0 s TYR 260 Cb -0.02 -2.19 -0.12 0.00 -0.40 0.00 0.00 41.96 39.23 2wb0 s TYR 260 CO -0.00 -0.52 1.47 1.17 -1.57 0.00 0.00 175.55 176.09 2wb0 n LYS 261 N 4.84 2.47 -0.93 -0.62 4.81 -1.26 -1.54 118.16 125.94 2wb0 n LYS 261 Ca -0.16 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 2wb0 n LYS 261 Cb 0.50 -2.58 0.00 0.00 0.02 0.00 0.00 35.03 32.97 2wb0 n LYS 261 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2wb0 n HIS 262 N 1.18 0.00 -3.35 5.64 8.25 -1.26 -4.92 115.22 120.77 2wb0 n HIS 262 Ca 0.06 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.25 2wb0 n HIS 262 Cb 0.36 -0.78 -0.07 0.00 1.12 0.00 0.00 29.99 30.62 2wb0 n HIS 262 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2wb0 n HIS 263 N -2.39 3.27 -2.08 4.41 8.25 -0.59 -4.70 115.22 121.40 2wb0 n HIS 263 Ca 0.00 -4.08 -0.42 0.00 -0.26 0.00 0.00 57.72 52.96 2wb0 n HIS 263 Cb 0.14 -0.53 -0.03 0.00 1.12 0.00 0.00 29.99 30.69 2wb0 n HIS 263 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2wb0 s GLU 264 N -2.46 4.27 0.17 -0.41 -6.30 -1.26 -4.66 118.70 108.04 2wb0 s GLU 264 Ca 0.40 2.17 -0.01 0.00 -2.50 0.00 0.00 54.97 55.04 2wb0 s GLU 264 Cb 0.17 -3.31 0.02 0.00 0.00 0.00 0.00 34.13 31.01 2wb0 s GLU 264 CO -0.03 -0.54 1.40 -1.00 0.02 0.00 0.00 175.26 175.11 2wb0 h PRO 265 N 7.15 0.35 -0.21 4.30 0.13 -1.94 -3.31 132.00 138.47 2wb0 h PRO 265 Ca -0.42 -0.32 -0.11 0.00 -0.87 0.00 0.00 66.00 64.28 2wb0 h PRO 265 Cb 1.20 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2wb0 h PRO 265 CO 0.89 0.98 -0.33 1.79 -0.23 0.00 0.00 178.00 181.11 2wb0 h THR 266 N 0.23 1.28 -0.82 1.56 1.35 -1.90 -3.45 112.91 111.16 2wb0 h THR 266 Ca -0.04 -1.40 -0.19 0.00 -0.55 0.00 0.00 66.41 64.23 2wb0 h THR 266 Cb 1.39 1.49 -0.05 0.00 -1.73 0.00 0.00 68.15 69.25 2wb0 h THR 266 CO 0.13 0.44 -0.20 0.61 -0.25 0.00 0.00 175.52 176.25 2wb0 n GLY 267 N -0.25 0.63 3.40 5.82 0.00 -1.25 -4.83 105.19 108.71 2wb0 n GLY 267 Ca -0.01 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.25 2wb0 n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wb0 s ALA 269 N -3.48 -0.09 -0.27 0.00 0.00 0.16 -4.28 121.76 113.81 2wb0 s ALA 269 Ca 0.35 -0.83 -0.07 0.00 0.00 0.00 0.00 51.96 51.42 2wb0 s ALA 269 Cb 0.07 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 24.05 2wb0 s ALA 269 CO 0.15 -0.67 0.06 -0.51 0.00 0.00 0.00 175.76 174.79 2wb0 s LEU 270 N -2.96 3.55 -0.24 0.00 1.02 -0.34 -1.23 118.68 118.48 2wb0 s LEU 270 Ca 0.17 -0.46 -0.07 0.00 0.02 0.00 0.00 54.13 53.79 2wb0 s LEU 270 Cb 0.03 -1.88 -0.03 0.00 0.02 0.00 0.00 46.19 44.33 2wb0 s LEU 270 CO 0.00 -0.10 0.06 0.86 0.02 0.00 0.00 176.35 177.19 2wb0 s TRP 271 N 1.55 3.08 -0.95 0.29 -0.00 -0.04 0.50 118.94 123.37 2wb0 s TRP 271 Ca 0.05 -0.42 -0.23 0.00 -0.00 0.00 0.00 56.10 55.50 2wb0 s TRP 271 Cb -0.16 -2.21 0.06 0.00 -0.00 0.00 0.00 33.47 31.16 2wb0 s TRP 271 CO 0.02 -0.33 1.35 -1.17 -0.00 0.00 0.00 176.95 176.82 2wb0 s LEU 272 N 1.49 3.77 0.06 5.86 2.96 -1.26 0.00 118.68 131.56 2wb0 s LEU 272 Ca 0.06 -1.40 -0.02 0.00 -0.22 0.00 0.00 54.13 52.55 2wb0 s LEU 272 Cb -0.15 -2.53 -0.27 0.00 0.50 0.00 0.00 46.19 43.74 2wb0 s LEU 272 CO 0.03 -1.47 1.08 1.12 -1.32 0.00 0.00 176.35 175.79 2wb0 h HIS 273 N 9.65 0.39 -3.51 5.38 2.07 -1.92 -3.47 115.15 123.74 2wb0 h HIS 273 Ca 0.11 -0.28 -0.36 0.00 -2.85 0.00 0.00 60.37 56.98 2wb0 h HIS 273 Cb 1.02 -0.02 -0.01 0.00 2.57 0.00 0.00 27.41 30.97 2wb0 h HIS 273 CO 1.23 1.25 -0.47 0.54 -3.07 0.00 0.00 177.93 177.40 2wb0 n ARG 274 N -3.47 -2.24 0.00 5.12 1.74 -1.26 -4.49 116.66 112.06 2wb0 n ARG 274 Ca -0.09 0.85 0.12 0.00 -0.77 0.00 0.00 57.85 57.96 2wb0 n ARG 274 Cb 1.02 -5.52 0.17 0.00 -1.02 0.00 0.00 32.46 27.11 2wb0 n ARG 274 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wb0 n ALA 276 N -0.24 2.61 -0.10 0.00 0.00 -1.26 -4.76 120.51 116.76 2wb0 n ALA 276 Ca 0.11 -2.79 -0.17 0.00 0.00 0.00 0.00 53.44 50.58 2wb0 n ALA 276 Cb 0.42 -0.37 -0.13 0.00 0.00 0.00 0.00 19.45 19.37 2wb0 n ALA 276 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2wb0 n GLU 277 N -1.35 0.67 -4.75 0.00 2.13 -1.26 -4.91 120.64 111.18 2wb0 n GLU 277 Ca 0.17 0.15 -0.33 0.00 0.66 0.00 0.00 57.16 57.82 2wb0 n GLU 277 Cb 0.65 -1.56 -0.16 0.00 0.27 0.00 0.00 31.44 30.64 2wb0 n GLU 277 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2wb0 s ILE 278 N -2.52 2.16 -0.00 6.31 1.01 -1.26 -5.08 121.20 121.81 2wb0 s ILE 278 Ca -0.29 -0.95 -0.35 0.00 0.00 0.00 0.00 60.65 59.05 2wb0 s ILE 278 Cb 0.08 -1.86 -0.14 0.00 0.01 0.00 0.00 42.46 40.55 2wb0 s ILE 278 CO 0.66 0.55 1.69 1.21 0.00 0.00 0.00 174.94 179.04 2wb0 n GLU 279 N 3.96 1.92 -0.59 2.79 4.07 -1.26 -1.02 120.64 130.51 2wb0 n GLU 279 Ca -0.20 0.70 0.00 0.00 -0.06 0.00 0.00 57.16 57.60 2wb0 n GLU 279 Cb 0.52 -2.47 0.00 0.00 -0.06 0.00 0.00 31.44 29.43 2wb0 n GLU 279 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2wb0 n GLY 280 N 3.79 1.59 3.59 8.31 0.00 -1.26 -5.00 105.19 116.21 2wb0 n GLY 280 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2wb0 n GLY 280 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wb0 s GLU 281 N -0.06 3.91 0.03 1.61 2.12 -0.19 -4.98 118.70 121.13 2wb0 s GLU 281 Ca 0.00 -0.36 0.02 0.00 0.36 0.00 0.00 54.97 54.99 2wb0 s GLU 281 Cb 0.00 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 2wb0 s GLU 281 CO 0.00 0.06 0.03 -0.51 -0.54 0.00 0.00 175.26 174.29 2wb0 s LEU 282 N 0.99 3.61 -0.03 2.70 1.43 -1.26 -4.65 118.68 121.47 2wb0 s LEU 282 Ca 0.05 -0.01 0.05 0.00 -1.03 0.00 0.00 54.13 53.19 2wb0 s LEU 282 Cb -0.14 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.89 2wb0 s LEU 282 CO 0.03 0.24 -0.17 -0.54 0.23 0.00 0.00 176.35 176.14 2wb0 s LYS 283 N -1.86 2.37 0.24 1.70 1.02 -1.26 -0.71 119.74 121.23 2wb0 s LYS 283 Ca 0.23 -0.78 -0.02 0.00 0.02 0.00 0.00 55.97 55.42 2wb0 s LYS 283 Cb -0.12 -2.28 0.05 0.00 -0.52 0.00 0.00 37.83 34.96 2wb0 s LYS 283 CO 0.14 0.60 0.33 0.00 -0.92 0.00 0.00 175.35 175.50 2wb0 h LEU 285 N 0.00 0.00 -1.87 0.00 -0.00 -1.93 0.13 115.31 111.64 2wb0 h LEU 285 Ca -0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.77 2wb0 h LEU 285 Cb 0.35 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.01 2wb0 h LEU 285 CO 0.10 0.05 -0.01 0.45 -0.00 0.00 0.00 178.44 179.03 2wb0 h HIS 286 N 0.00 0.00 0.00 1.13 3.86 -1.97 -3.41 115.15 114.76 2wb0 h HIS 286 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2wb0 h HIS 286 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 2wb0 h HIS 286 CO 0.00 0.01 0.00 0.41 0.86 0.00 0.00 177.93 179.21 2wb0 n GLY 287 N -0.27 0.72 3.88 2.45 0.00 0.03 -4.93 105.19 107.07 2wb0 n GLY 287 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2wb0 n GLY 287 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wb0 s SER 288 N -2.31 6.11 0.53 1.61 1.04 -1.26 -4.84 113.70 114.59 2wb0 s SER 288 Ca 0.00 0.17 -0.22 0.00 0.48 0.00 0.00 55.95 56.37 2wb0 s SER 288 Cb 0.00 -1.81 -0.05 0.00 0.10 0.00 0.00 66.02 64.26 2wb0 s SER 288 CO 0.00 0.15 1.39 2.30 0.98 0.00 0.00 173.24 178.06 2wb0 n ILE 289 N 0.20 3.66 -3.19 -1.02 -6.64 -1.26 -1.47 119.36 109.63 2wb0 n ILE 289 Ca -0.06 -0.50 -0.39 0.00 -1.77 0.00 0.00 62.75 60.03 2wb0 n ILE 289 Cb 0.52 -1.72 -0.06 0.00 -1.44 0.00 0.00 39.64 36.94 2wb0 n ILE 289 CO 0.00 0.00 0.00 -0.04 -1.77 0.00 0.00 176.55 174.74 2wb0 s MET 290 N -2.81 4.31 0.16 6.28 -1.94 0.11 -4.32 119.30 121.09 2wb0 s MET 290 Ca 0.70 0.82 -0.25 0.00 -1.71 0.00 0.00 55.69 55.24 2wb0 s MET 290 Cb -0.42 -3.29 -0.08 0.00 2.01 0.00 0.00 34.83 33.05 2wb0 s MET 290 CO 0.51 0.50 0.77 0.42 -0.01 0.00 0.00 175.02 177.20 2wb0 s ILE 291 N -0.67 4.39 0.36 2.53 -1.09 -0.51 -4.77 121.20 121.44 2wb0 s ILE 291 Ca 0.31 1.67 -0.27 0.00 -2.23 0.00 0.00 60.65 60.14 2wb0 s ILE 291 Cb -0.20 -4.12 -0.09 0.00 -1.58 0.00 0.00 42.46 36.48 2wb0 s ILE 291 CO 0.20 0.51 1.16 0.20 -1.23 0.00 0.00 174.94 175.78 2wb0 s ASN 292 N -1.17 6.75 0.02 3.58 -0.87 -1.26 -1.64 114.94 120.35 2wb0 s ASN 292 Ca 0.36 2.35 -0.03 0.00 -1.57 0.00 0.00 52.86 53.97 2wb0 s ASN 292 Cb -0.23 -2.62 -0.01 0.00 -0.02 0.00 0.00 41.25 38.37 2wb0 s ASN 292 CO 0.26 -0.52 0.04 -0.54 -2.57 0.00 0.00 177.10 173.77 2wb0 s LYS 293 N -2.05 0.42 -0.01 -0.60 -0.14 -0.20 -4.91 119.74 112.25 2wb0 s LYS 293 Ca 0.53 -0.59 -0.20 0.00 -1.36 0.00 0.00 55.97 54.35 2wb0 s LYS 293 Cb -0.32 0.16 -0.05 0.00 -1.68 0.00 0.00 37.83 35.94 2wb0 s LYS 293 CO 0.40 -0.09 0.59 -2.00 -0.76 0.00 0.00 175.35 173.49 2wb0 s GLU 294 N -1.70 4.31 -0.22 1.68 2.12 -1.26 -1.84 118.70 121.79 2wb0 s GLU 294 Ca -0.13 0.71 0.00 0.00 0.36 0.00 0.00 54.97 55.92 2wb0 s GLU 294 Cb -0.07 -3.34 0.06 0.00 0.26 0.00 0.00 34.13 31.03 2wb0 s GLU 294 CO -0.01 0.36 -0.05 -1.58 -0.54 0.00 0.00 175.26 173.44 2wb0 s HIS 295 N -0.17 2.26 -0.27 5.30 5.65 0.21 -4.61 115.29 123.66 2wb0 s HIS 295 Ca 0.31 -1.62 -0.12 0.00 0.25 0.00 0.00 55.06 53.87 2wb0 s HIS 295 Cb -0.18 -1.53 -0.05 0.00 -1.18 0.00 0.00 32.58 29.64 2wb0 s HIS 295 CO 0.17 -0.75 0.24 0.14 -0.65 0.00 0.00 174.74 173.89 2wb0 s VAL 296 N 1.44 5.28 0.23 0.89 -7.23 -1.26 0.03 120.40 119.78 2wb0 s VAL 296 Ca -0.04 0.28 0.09 0.00 -1.81 0.00 0.00 61.98 60.49 2wb0 s VAL 296 Cb -0.18 -3.57 -0.04 0.00 0.56 0.00 0.00 36.38 33.14 2wb0 s VAL 296 CO -0.07 0.24 0.02 -0.63 -0.31 0.00 0.00 175.10 174.35 2wb0 s ILE 297 N 1.77 3.65 0.01 -0.62 1.01 0.83 -4.94 121.20 122.92 2wb0 s ILE 297 Ca 0.09 -1.69 0.00 0.00 0.00 0.00 0.00 60.65 59.05 2wb0 s ILE 297 Cb -0.16 -2.92 -0.01 0.00 0.01 0.00 0.00 42.46 39.39 2wb0 s ILE 297 CO 0.10 -0.28 -0.01 -1.61 0.00 0.00 0.00 174.94 173.14 2wb0 s GLU 298 N -3.44 0.14 -0.30 2.79 2.02 -1.26 0.10 118.70 118.75 2wb0 s GLU 298 Ca 0.30 -0.27 -0.09 0.00 0.02 0.00 0.00 54.97 54.93 2wb0 s GLU 298 Cb -0.08 0.04 -0.01 0.00 0.10 0.00 0.00 34.13 34.19 2wb0 s GLU 298 CO 0.20 -0.02 0.12 -1.14 0.02 0.00 0.00 175.26 174.44 2wb0 s GLN 330 N -0.65 3.31 -0.13 1.61 0.74 -1.26 -5.28 119.66 118.00 2wb0 s GLN 330 Ca -0.07 -0.73 -0.04 0.00 0.05 0.00 0.00 55.36 54.57 2wb0 s GLN 330 Cb -0.04 -3.48 -0.03 0.00 1.10 0.00 0.00 33.01 30.55 2wb0 s GLN 330 CO -0.00 -0.40 0.01 0.42 -0.55 0.00 0.00 175.29 174.77 2wb0 s ILE 331 N 1.58 4.33 -0.38 -2.34 1.01 0.28 -5.11 121.20 120.58 2wb0 s ILE 331 Ca 0.04 -0.22 -0.08 0.00 0.00 0.00 0.00 60.65 60.39 2wb0 s ILE 331 Cb -0.17 -2.88 0.06 0.00 0.01 0.00 0.00 42.46 39.48 2wb0 s ILE 331 CO 0.05 0.54 0.19 -0.44 0.00 0.00 0.00 174.94 175.28 2wb0 s SER 332 N -0.24 5.51 -0.56 3.58 0.01 -1.26 -0.12 113.70 120.63 2wb0 s SER 332 Ca 0.06 -1.33 -0.17 0.00 1.31 0.00 0.00 55.95 55.81 2wb0 s SER 332 Cb -0.12 -1.94 0.12 0.00 0.21 0.00 0.00 66.02 64.28 2wb0 s SER 332 CO 0.02 -0.44 0.58 0.20 0.41 0.00 0.00 173.24 174.01 2wb0 s ASN 333 N 1.77 6.19 0.00 2.44 0.01 0.10 -4.89 114.94 120.56 2wb0 s ASN 333 Ca 0.01 -1.61 0.20 0.00 -0.71 0.00 0.00 52.86 50.76 2wb0 s ASN 333 Cb -0.21 -2.25 0.76 0.00 0.41 0.00 0.00 41.25 39.96 2wb0 s ASN 333 CO 0.03 -0.96 1.55 0.35 -1.51 0.00 0.00 177.10 176.55 2wb0 n THR 334 N 5.38 0.20 -1.64 1.60 -2.24 -1.26 0.66 114.28 116.98 2wb0 n THR 334 Ca -0.12 -0.33 0.05 0.00 -2.27 0.00 0.00 64.05 61.38 2wb0 n THR 334 Cb 0.41 0.32 0.20 0.00 -2.10 0.00 0.00 70.33 69.16 2wb0 n THR 334 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2wb0 n ASP 335 N 0.24 1.80 -4.81 3.42 2.03 -1.26 -4.63 116.55 113.35 2wb0 n ASP 335 Ca 0.16 -3.85 -0.31 0.00 0.52 0.00 0.00 54.79 51.30 2wb0 n ASP 335 Cb 0.31 -0.52 0.06 0.00 -0.72 0.00 0.00 41.12 40.25 2wb0 n ASP 335 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wb0 s ALA 336 N -3.17 2.60 -0.01 -1.67 0.00 -0.76 -0.90 121.76 117.84 2wb0 s ALA 336 Ca 0.38 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.42 2wb0 s ALA 336 Cb 0.37 -3.18 0.01 0.00 0.00 0.00 0.00 23.12 20.33 2wb0 s ALA 336 CO -0.07 -1.33 -0.00 1.03 0.00 0.00 0.00 175.76 175.39 2wb0 s ARG 337 N -5.04 0.15 0.24 0.00 1.81 0.02 -1.03 118.95 115.10 2wb0 s ARG 337 Ca 0.59 0.03 0.10 0.00 -1.72 0.00 0.00 55.73 54.73 2wb0 s ARG 337 Cb -0.14 -0.26 -0.05 0.00 -0.45 0.00 0.00 34.95 34.05 2wb0 s ARG 337 CO 0.55 -0.05 -0.18 0.00 -0.68 0.00 0.00 175.30 174.93 2wb0 h VAL 340 N 2.26 0.75 0.00 0.00 3.04 -1.89 -0.71 116.25 119.70 2wb0 h VAL 340 Ca -0.49 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 2wb0 h VAL 340 Cb 1.28 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.58 2wb0 h VAL 340 CO 0.61 0.01 0.00 1.41 -1.01 0.00 0.00 177.57 178.59 2wb0 n HIS 341 N -4.15 0.05 -0.29 3.17 8.25 -1.26 -1.16 115.22 119.82 2wb0 n HIS 341 Ca -0.03 0.02 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 2wb0 n HIS 341 Cb 0.09 -0.53 0.31 0.00 1.12 0.00 0.00 29.99 30.99 2wb0 n HIS 341 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2wb0 n ASP 342 N -1.54 3.90 0.28 0.41 8.00 -0.27 -4.73 116.55 122.59 2wb0 n ASP 342 Ca 0.04 -2.00 0.14 0.00 0.71 0.00 0.00 54.79 53.69 2wb0 n ASP 342 Cb 0.21 -0.46 0.80 0.00 -0.02 0.00 0.00 41.12 41.65 2wb0 n ASP 342 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wb0 h ALA 343 N 4.29 1.26 -0.39 2.24 0.00 -1.19 0.26 119.26 125.73 2wb0 h ALA 343 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2wb0 h ALA 343 Cb 0.99 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2wb0 h ALA 343 CO 0.00 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.35 2wb0 n ALA 344 N -2.25 2.43 -2.36 0.00 0.00 -1.26 -4.93 120.51 112.14 2wb0 n ALA 344 Ca -0.02 -0.97 -0.30 0.00 0.00 0.00 0.00 53.44 52.16 2wb0 n ALA 344 Cb 0.21 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 18.73 2wb0 n ALA 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wb0 n PRO 346 N -1.01 0.57 -1.66 0.00 -0.02 -1.26 -4.89 135.00 126.74 2wb0 n PRO 346 Ca 0.00 0.23 -0.45 0.00 -2.02 0.00 0.00 63.50 61.26 2wb0 n PRO 346 Cb 0.54 -1.89 -0.03 0.00 -0.02 0.00 0.00 33.50 32.10 2wb0 n PRO 346 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wb0 n ALA 347 N -1.90 0.85 -1.49 3.55 0.00 -1.26 -2.26 120.51 117.99 2wb0 n ALA 347 Ca 0.12 0.42 -0.09 0.00 0.00 0.00 0.00 53.44 53.89 2wb0 n ALA 347 Cb 0.48 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.66 2wb0 n ALA 347 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wb0 n ASN 348 N 2.24 -3.90 -4.46 0.00 5.15 -1.26 -5.02 115.26 108.01 2wb0 n ASN 348 Ca 0.13 0.17 -0.30 0.00 -0.60 0.00 0.00 54.58 53.98 2wb0 n ASN 348 Cb 0.30 -2.45 -0.12 0.00 -0.53 0.00 0.00 39.78 36.98 2wb0 n ASN 348 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2wb0 s GLN 349 N -3.19 1.80 -0.09 1.20 -0.21 -0.96 -5.12 119.66 113.08 2wb0 s GLN 349 Ca 0.00 -1.15 0.04 0.00 0.02 0.00 0.00 55.36 54.27 2wb0 s GLN 349 Cb 0.00 -2.09 -0.00 0.00 1.00 0.00 0.00 33.01 31.92 2wb0 s GLN 349 CO 0.00 0.49 -0.24 -0.06 -2.12 0.00 0.00 175.29 173.37 2wb0 s PHE 350 N -1.05 2.47 0.86 0.91 0.08 -1.26 -4.79 117.98 115.20 2wb0 s PHE 350 Ca 0.16 -0.94 -0.12 0.00 0.12 0.00 0.00 56.93 56.15 2wb0 s PHE 350 Cb -0.10 -1.65 0.11 0.00 -0.57 0.00 0.00 43.02 40.81 2wb0 s PHE 350 CO 0.08 -0.36 1.15 -1.54 -0.10 0.00 0.00 175.22 174.44 2wb0 s SER 351 N 0.22 3.96 0.00 1.36 1.04 -1.26 -4.86 113.70 114.17 2wb0 s SER 351 Ca -0.15 0.94 0.10 0.00 0.48 0.00 0.00 55.95 57.32 2wb0 s SER 351 Cb -0.17 -1.51 0.49 0.00 0.10 0.00 0.00 66.02 64.93 2wb0 s SER 351 CO 0.07 -2.26 1.28 0.61 0.98 0.00 0.00 173.24 173.92 2wb0 n GLY 352 N -2.58 -0.74 0.52 7.32 0.00 -1.26 -1.63 105.19 106.82 2wb0 n GLY 352 Ca 0.07 -0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.10 2wb0 n GLY 352 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wb0 n LYS 353 N -1.39 1.55 -1.55 1.61 5.02 -1.26 -4.62 118.16 117.51 2wb0 n LYS 353 Ca 0.04 -1.54 -0.33 0.00 -2.02 0.00 0.00 58.31 54.46 2wb0 n LYS 353 Cb 0.10 -1.23 0.07 0.00 -0.02 0.00 0.00 35.03 33.95 2wb0 n LYS 353 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2wb0 s SER 354 N -0.95 4.69 0.00 4.39 0.15 -0.65 -4.84 113.70 116.49 2wb0 s SER 354 Ca 0.17 2.07 0.26 0.00 0.70 0.00 0.00 55.95 59.14 2wb0 s SER 354 Cb 0.10 -2.56 0.60 0.00 -1.71 0.00 0.00 66.02 62.45 2wb0 s SER 354 CO 0.14 -1.92 1.47 0.00 1.20 0.00 0.00 173.24 174.14 2wb0 n GLY 356 N 1.39 0.80 3.77 0.00 0.00 -1.26 -4.69 105.19 105.20 2wb0 n GLY 356 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 2wb0 n GLY 356 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2wb0 s MET 357 N -0.36 4.46 -0.25 1.61 0.00 -1.26 -4.97 119.30 118.52 2wb0 s MET 357 Ca 0.00 1.01 -0.19 0.00 0.00 0.00 0.00 55.69 56.51 2wb0 s MET 357 Cb 0.00 -3.31 0.07 0.00 0.00 0.00 0.00 34.83 31.59 2wb0 s MET 357 CO 0.00 0.43 0.65 0.12 0.00 0.00 0.00 175.02 176.23 2wb0 s PHE 358 N -0.56 -0.86 -0.17 4.11 5.36 -1.26 -3.24 117.98 121.35 2wb0 s PHE 358 Ca 0.35 1.88 0.01 0.00 -0.96 0.00 0.00 56.93 58.22 2wb0 s PHE 358 Cb -0.21 0.41 0.02 0.00 -0.34 0.00 0.00 43.02 42.90 2wb0 s PHE 358 CO 0.23 -0.42 -0.20 -0.06 -1.46 0.00 0.00 175.22 173.31 2wb0 s PHE 359 N 0.97 2.76 0.38 10.12 0.08 -0.31 -4.97 117.98 127.03 2wb0 s PHE 359 Ca -0.05 -1.55 0.11 0.00 0.12 0.00 0.00 56.93 55.56 2wb0 s PHE 359 Cb -0.05 -1.91 0.77 0.00 -0.57 0.00 0.00 43.02 41.27 2wb0 s PHE 359 CO -0.09 -0.75 1.89 0.77 -0.10 0.00 0.00 175.22 176.93 2wb0 h SER 360 N 7.81 0.14 -3.15 1.36 0.02 -1.91 0.09 113.55 117.90 2wb0 h SER 360 Ca -0.43 -0.03 -0.56 0.00 -0.84 0.00 0.00 61.79 59.92 2wb0 h SER 360 Cb 1.15 -0.04 -0.40 0.00 0.14 0.00 0.00 62.40 63.26 2wb0 h SER 360 CO 0.62 0.37 -0.76 -1.83 -1.14 0.00 0.00 176.83 174.09 2wb0 s GLU 361 N -4.53 0.67 0.17 3.45 -1.05 -1.26 -3.35 118.70 112.80 2wb0 s GLU 361 Ca -0.04 -0.88 -0.09 0.00 -0.15 0.00 0.00 54.97 53.80 2wb0 s GLU 361 Cb 0.15 -1.94 0.03 0.00 -0.44 0.00 0.00 34.13 31.93 2wb0 s GLU 361 CO 0.73 -0.91 1.57 0.78 0.95 0.00 0.00 175.26 178.37 2wb0 h GLY 362 N 8.15 1.06 0.99 -3.83 0.00 -1.22 -0.98 103.07 107.24 2wb0 h GLY 362 Ca -0.15 -0.93 -0.00 0.00 0.00 0.00 0.00 47.33 46.25 2wb0 h GLY 362 CO 0.44 0.85 0.26 0.00 0.00 0.00 0.00 176.54 178.09 2wb0 h ALA 363 N 0.91 0.55 -0.82 3.60 0.00 -1.94 -0.43 119.26 121.13 2wb0 h ALA 363 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2wb0 h ALA 363 Cb 0.78 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2wb0 h ALA 363 CO 0.06 0.04 0.42 -0.22 0.00 0.00 0.00 179.25 179.55 2wb0 h LYS 364 N 0.57 1.16 -0.46 0.00 3.64 -1.87 -1.64 116.57 117.96 2wb0 h LYS 364 Ca 0.15 -0.15 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2wb0 h LYS 364 Cb -0.01 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 31.55 2wb0 h LYS 364 CO -0.03 0.87 0.23 0.00 -2.27 0.00 0.00 179.45 178.25 2wb0 h ALA 365 N 1.22 0.58 -0.56 5.00 0.00 -0.83 -2.34 119.26 122.34 2wb0 h ALA 365 Ca 0.28 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 2wb0 h ALA 365 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2wb0 h ALA 365 CO -0.04 -0.12 -0.01 0.37 0.00 0.00 0.00 179.25 179.44 2wb0 h GLN 366 N 0.46 0.96 -0.64 0.00 4.15 -0.73 -1.89 115.11 117.42 2wb0 h GLN 366 Ca 0.20 -0.29 0.12 0.00 0.77 0.00 0.00 58.65 59.45 2wb0 h GLN 366 Cb 0.12 -0.09 -0.09 0.00 0.21 0.00 0.00 27.48 27.62 2wb0 h GLN 366 CO -0.15 0.96 0.17 0.28 -1.93 0.00 0.00 178.83 178.16 2wb0 h VAL 367 N 0.88 0.63 -0.42 2.39 2.07 -1.01 -0.49 116.25 120.30 2wb0 h VAL 367 Ca 0.16 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.50 2wb0 h VAL 367 Cb 0.53 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2wb0 h VAL 367 CO 0.03 0.05 -0.04 0.00 0.02 0.00 0.00 177.57 177.63 2wb0 h ALA 368 N 1.50 1.14 -0.30 1.67 0.00 -0.84 -0.25 119.26 122.20 2wb0 h ALA 368 Ca 0.34 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 2wb0 h ALA 368 Cb 0.52 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2wb0 h ALA 368 CO -0.41 0.55 -0.31 0.74 0.00 0.00 0.00 179.25 179.81 2wb0 h PHE 369 N 0.65 0.73 -0.50 0.00 0.04 -0.95 -2.12 116.94 114.78 2wb0 h PHE 369 Ca 0.13 -0.18 -0.06 0.00 2.80 0.00 0.00 57.97 60.65 2wb0 h PHE 369 Cb 0.47 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 2wb0 h PHE 369 CO 0.02 0.87 0.08 0.87 -0.60 0.00 0.00 178.31 179.55 2wb0 h LYS 370 N 0.54 0.79 -0.31 1.51 1.57 -0.51 -2.38 116.57 117.77 2wb0 h LYS 370 Ca 0.06 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 2wb0 h LYS 370 Cb 0.80 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2wb0 h LYS 370 CO 0.07 0.75 0.14 0.37 -0.57 0.00 0.00 179.45 180.21 2wb0 h GLN 371 N 0.75 0.45 -0.36 3.15 -0.00 -0.93 -0.55 115.11 117.61 2wb0 h GLN 371 Ca 0.16 -0.07 -0.17 0.00 -0.00 0.00 0.00 58.65 58.57 2wb0 h GLN 371 Cb 0.35 -0.08 -0.00 0.00 0.00 0.00 0.00 27.48 27.74 2wb0 h GLN 371 CO 0.01 0.43 -0.43 0.97 0.00 0.00 0.00 178.83 179.81 2wb0 h ILE 372 N 0.36 1.27 -0.78 2.39 6.09 -1.22 -0.49 117.51 125.13 2wb0 h ILE 372 Ca 0.11 -1.60 0.00 0.00 -1.37 0.00 0.00 64.86 61.99 2wb0 h ILE 372 Cb 0.13 1.44 -0.04 0.00 0.47 0.00 0.00 36.82 38.83 2wb0 h ILE 372 CO -0.01 0.53 0.49 0.50 -3.07 0.00 0.00 178.15 176.59 2wb0 h LYS 373 N 0.74 1.05 -0.30 2.19 3.64 -1.38 -0.17 116.57 122.34 2wb0 h LYS 373 Ca 0.05 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.23 2wb0 h LYS 373 Cb 1.03 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 2wb0 h LYS 373 CO 0.10 0.72 -0.28 0.00 -2.27 0.00 0.00 179.45 177.72 2wb0 h ALA 374 N 1.26 0.95 -0.52 5.00 0.00 -0.87 -0.95 119.26 124.14 2wb0 h ALA 374 Ca 0.28 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2wb0 h ALA 374 Cb -0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2wb0 h ALA 374 CO -0.06 0.61 0.19 0.35 0.00 0.00 0.00 179.25 180.34 2wb0 h PHE 375 N 0.53 0.81 -0.48 0.00 3.57 -0.61 -1.14 116.94 119.62 2wb0 h PHE 375 Ca 0.07 -0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2wb0 h PHE 375 Cb 0.75 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 2wb0 h PHE 375 CO 0.03 0.68 -0.05 0.52 -2.23 0.00 0.00 178.31 177.27 2wb0 h MET 376 N 0.71 0.87 -0.51 1.11 2.86 -0.76 -1.30 114.93 117.91 2wb0 h MET 376 Ca 0.17 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 2wb0 h MET 376 Cb 0.23 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 2wb0 h MET 376 CO -0.01 0.94 0.29 1.96 1.06 0.00 0.00 176.91 181.15 2wb0 h GLN 377 N 0.72 0.69 -0.02 1.72 4.20 -1.03 0.15 115.11 121.55 2wb0 h GLN 377 Ca 0.13 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.61 2wb0 h GLN 377 Cb 0.58 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2wb0 h GLN 377 CO 0.03 0.50 -0.77 0.00 -0.67 0.00 0.00 178.83 177.92 2wb0 h ALA 378 N 1.62 0.67 0.00 3.87 0.00 -0.80 -2.27 119.26 122.36 2wb0 h ALA 378 Ca 0.18 -0.67 -0.24 0.00 0.00 0.00 0.00 54.91 54.19 2wb0 h ALA 378 Cb -0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2wb0 h ALA 378 CO -0.03 0.87 -1.23 1.25 0.00 0.00 0.00 179.25 180.11 2wb0 h LEU 379 N 0.09 0.01 -5.71 0.00 5.85 -0.74 -3.39 115.31 111.43 2wb0 h LEU 379 Ca -0.02 -0.01 -0.57 0.00 0.84 0.00 0.00 57.88 58.12 2wb0 h LEU 379 Cb 1.35 -0.00 -0.41 0.00 0.37 0.00 0.00 40.66 41.97 2wb0 h LEU 379 CO 0.11 1.01 -0.77 -1.22 -0.34 0.00 0.00 178.44 177.23 2wb0 n TYR 380 N -3.26 2.87 0.32 1.25 4.01 0.49 -4.95 117.16 117.90 2wb0 n TYR 380 Ca -0.06 -3.97 0.20 0.00 -0.16 0.00 0.00 57.90 53.92 2wb0 n TYR 380 Cb 0.98 -0.48 1.06 0.00 -0.31 0.00 0.00 39.34 40.58 2wb0 n TYR 380 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2wb0 h PRO 381 N 3.37 0.00 -0.22 -0.72 0.13 -1.60 -2.49 132.00 130.47 2wb0 h PRO 381 Ca 0.14 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.23 2wb0 h PRO 381 Cb 0.66 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 2wb0 h PRO 381 CO 0.74 0.01 -0.02 0.09 -0.23 0.00 0.00 178.00 178.59 2wb0 n ASN 382 N -3.21 3.32 -4.72 1.44 3.02 -1.26 -5.03 115.26 108.82 2wb0 n ASN 382 Ca -0.02 -3.18 -0.43 0.00 -0.03 0.00 0.00 54.58 50.92 2wb0 n ASN 382 Cb 0.13 -0.54 -0.02 0.00 -0.61 0.00 0.00 39.78 38.73 2wb0 n ASN 382 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wb0 n ALA 383 N -0.81 2.23 0.09 5.41 0.00 -0.94 -4.91 120.51 121.59 2wb0 n ALA 383 Ca 0.22 0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.85 2wb0 n ALA 383 Cb 0.87 -2.43 -0.12 0.00 0.00 0.00 0.00 19.45 17.76 2wb0 n ALA 383 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2wb0 h GLN 384 N 5.32 0.58 -3.91 0.00 4.20 -1.96 -3.48 115.11 115.87 2wb0 h GLN 384 Ca -0.45 -0.78 -0.13 0.00 0.06 0.00 0.00 58.65 57.35 2wb0 h GLN 384 Cb 1.23 0.26 -0.18 0.00 0.30 0.00 0.00 27.48 29.09 2wb0 h GLN 384 CO 0.84 1.35 -0.58 0.95 -0.67 0.00 0.00 178.83 180.72 2wb0 s THR 385 N -2.98 0.14 0.00 -0.54 -4.23 -1.26 -4.97 115.64 101.80 2wb0 s THR 385 Ca -0.09 -1.19 0.00 0.00 -1.18 0.00 0.00 61.69 59.23 2wb0 s THR 385 Cb 0.06 -0.91 0.00 0.00 1.34 0.00 0.00 72.50 72.99 2wb0 s THR 385 CO 0.92 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.96 2wb0 n GLY 386 N 0.77 0.68 0.26 3.99 0.00 -1.26 -4.96 105.19 104.67 2wb0 n GLY 386 Ca -0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.97 2wb0 n GLY 386 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2wb0 h HIS 387 N 0.00 0.00 -0.01 1.61 3.86 -1.94 -2.19 115.15 116.47 2wb0 h HIS 387 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2wb0 h HIS 387 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2wb0 h HIS 387 CO 0.00 0.11 -0.17 0.41 0.86 0.00 0.00 177.93 179.13 2wb0 n GLY 388 N -0.33 -0.09 3.84 2.45 0.00 -1.26 -4.70 105.19 105.10 2wb0 n GLY 388 Ca -0.01 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 2wb0 n GLY 388 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wb0 s HIS 389 N -2.26 3.70 -0.20 1.61 4.02 -0.83 -3.05 115.29 118.28 2wb0 s HIS 389 Ca 0.28 1.02 -0.06 0.00 1.02 0.00 0.00 55.06 57.33 2wb0 s HIS 389 Cb 0.20 -2.32 -0.03 0.00 -1.02 0.00 0.00 32.58 29.41 2wb0 s HIS 389 CO 0.44 0.58 0.03 -1.17 1.02 0.00 0.00 174.74 175.64 2wb0 s LEU 390 N -1.38 3.51 -0.20 0.89 2.96 0.10 -4.85 118.68 119.71 2wb0 s LEU 390 Ca 0.29 -0.09 -0.29 0.00 -0.22 0.00 0.00 54.13 53.82 2wb0 s LEU 390 Cb -0.16 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.63 2wb0 s LEU 390 CO 0.16 0.10 1.07 -0.22 -1.32 0.00 0.00 176.35 176.14 2wb0 s LEU 391 N 0.82 4.14 0.04 -0.68 0.20 -1.26 -0.86 118.68 121.08 2wb0 s LEU 391 Ca 0.02 1.46 0.02 0.00 0.69 0.00 0.00 54.13 56.31 2wb0 s LEU 391 Cb -0.14 -3.54 -0.02 0.00 -0.43 0.00 0.00 46.19 42.05 2wb0 s LEU 391 CO 0.02 -0.65 -0.07 0.00 -0.29 0.00 0.00 176.35 175.36 2wb0 s MET 392 N 3.07 0.49 0.30 1.98 0.23 -0.36 -4.88 119.30 120.13 2wb0 s MET 392 Ca 0.46 -0.76 -0.25 0.00 -1.03 0.00 0.00 55.69 54.12 2wb0 s MET 392 Cb -0.17 -0.19 -0.10 0.00 -1.53 0.00 0.00 34.83 32.85 2wb0 s MET 392 CO 0.09 0.02 0.89 -1.25 -2.03 0.00 0.00 175.02 172.75 2wb0 s PRO 393 N -1.69 4.50 -0.00 3.16 0.04 -1.26 -0.66 135.00 139.08 2wb0 s PRO 393 Ca -0.10 1.22 0.22 0.00 0.04 0.00 0.00 61.00 62.38 2wb0 s PRO 393 Cb -0.09 -2.81 -0.19 0.00 0.04 0.00 0.00 34.50 31.45 2wb0 s PRO 393 CO -0.00 0.30 0.83 1.28 0.04 0.00 0.00 177.00 179.45 2wb0 n LEU 394 N 0.57 0.68 -3.90 -3.56 4.77 0.14 -4.22 117.00 111.49 2wb0 n LEU 394 Ca 0.01 -0.30 -0.17 0.00 -0.03 0.00 0.00 56.01 55.52 2wb0 n LEU 394 Cb 0.50 -0.02 -0.15 0.00 -2.33 0.00 0.00 43.42 41.42 2wb0 n LEU 394 CO 0.44 0.16 -0.40 -0.13 -1.33 0.00 0.00 177.39 176.13 2wb0 s ARG 395 N -3.15 0.53 0.00 3.23 0.52 -1.03 -4.31 118.95 114.73 2wb0 s ARG 395 Ca 0.04 -0.10 0.00 0.00 -0.52 0.00 0.00 55.73 55.15 2wb0 s ARG 395 Cb 0.15 -0.57 0.00 0.00 0.52 0.00 0.00 34.95 35.05 2wb0 s ARG 395 CO 0.86 -0.01 0.00 0.00 0.02 0.00 0.00 175.30 176.17 2wb0 h GLU 397 N 0.00 0.39 -0.76 0.00 5.08 -1.98 -2.77 114.58 114.54 2wb0 h GLU 397 Ca 0.00 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.16 2wb0 h GLU 397 Cb 0.00 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 2wb0 h GLU 397 CO 0.00 0.71 0.38 0.00 -1.00 0.00 0.00 179.01 179.09 2wb0 n ASN 399 N -4.33 3.16 0.19 0.00 6.94 -1.24 -4.77 115.26 115.21 2wb0 n ASN 399 Ca 0.07 -3.83 0.03 0.00 -0.02 0.00 0.00 54.58 50.84 2wb0 n ASN 399 Cb 0.13 -0.50 0.38 0.00 -2.36 0.00 0.00 39.78 37.43 2wb0 n ASN 399 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 2wb0 h SER 400 N 1.44 0.00 -2.96 0.53 4.64 -1.23 -3.43 113.55 112.55 2wb0 h SER 400 Ca 0.19 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.88 2wb0 h SER 400 Cb 1.29 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.30 2wb0 h SER 400 CO 0.38 0.36 -0.39 -0.54 -0.87 0.00 0.00 176.83 175.78 2wb0 s LYS 401 N -4.10 3.84 0.53 4.77 1.02 -1.26 -5.01 119.74 119.52 2wb0 s LYS 401 Ca -0.02 0.03 0.19 0.00 0.02 0.00 0.00 55.97 56.18 2wb0 s LYS 401 Cb 0.14 -3.28 1.35 0.00 -0.52 0.00 0.00 37.83 35.51 2wb0 s LYS 401 CO 0.71 0.57 2.13 -1.00 -0.92 0.00 0.00 175.35 176.84 2wb0 h PRO 402 N 5.54 0.00 -0.87 -1.68 0.13 -1.84 -0.48 132.00 132.80 2wb0 h PRO 402 Ca -0.49 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.31 2wb0 h PRO 402 Cb 1.20 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 2wb0 h PRO 402 CO 0.65 0.00 0.42 0.41 -0.23 0.00 0.00 178.00 179.25 2wb0 n GLY 403 N -1.54 3.86 3.61 1.56 0.00 -1.26 -5.01 105.19 106.41 2wb0 n GLY 403 Ca -0.01 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.69 2wb0 n GLY 403 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2wb0 n HIS 404 N -0.51 0.63 -1.74 1.61 1.44 -0.19 -4.88 115.22 111.58 2wb0 n HIS 404 Ca 0.46 0.40 -0.42 0.00 -2.01 0.00 0.00 57.72 56.15 2wb0 n HIS 404 Cb 1.45 -2.09 -0.02 0.00 0.12 0.00 0.00 29.99 29.45 2wb0 n HIS 404 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2wb0 n ALA 405 N -2.30 2.56 -1.62 1.59 0.00 -1.26 -4.92 120.51 114.56 2wb0 n ALA 405 Ca 0.13 0.38 -0.40 0.00 0.00 0.00 0.00 53.44 53.55 2wb0 n ALA 405 Cb 0.49 -2.47 0.03 0.00 0.00 0.00 0.00 19.45 17.50 2wb0 n ALA 405 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2wb0 n PRO 406 N 2.32 1.26 -4.12 0.00 -0.02 -1.26 -5.03 135.00 128.15 2wb0 n PRO 406 Ca 0.09 0.46 -0.08 0.00 -2.02 0.00 0.00 63.50 61.95 2wb0 n PRO 406 Cb 0.36 -2.11 -0.10 0.00 -0.02 0.00 0.00 33.50 31.63 2wb0 n PRO 406 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2wb0 s PHE 407 N -1.36 0.68 0.63 6.00 -0.12 -1.26 -5.05 117.98 117.50 2wb0 s PHE 407 Ca 0.67 -1.08 0.01 0.00 -0.05 0.00 0.00 56.93 56.49 2wb0 s PHE 407 Cb -0.50 -0.44 0.08 0.00 -0.63 0.00 0.00 43.02 41.53 2wb0 s PHE 407 CO 0.54 -0.36 0.87 -0.51 -0.05 0.00 0.00 175.22 175.71 2wb0 s LEU 408 N -2.98 3.12 0.00 -1.99 2.01 -1.26 -4.88 118.68 112.71 2wb0 s LEU 408 Ca 0.12 -0.26 0.00 0.00 0.01 0.00 0.00 54.13 53.99 2wb0 s LEU 408 Cb 0.07 -2.33 0.00 0.00 0.01 0.00 0.00 46.19 43.94 2wb0 s LEU 408 CO -0.06 -1.49 0.00 0.61 1.01 0.00 0.00 176.35 176.42 2wb0 n GLY 409 N -2.55 -0.25 3.79 -3.19 0.00 0.11 -4.86 105.19 98.24 2wb0 n GLY 409 Ca 0.12 -1.24 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 2wb0 n GLY 409 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wb0 s ARG 410 N 0.00 4.10 -0.00 1.61 3.52 -1.26 -0.86 118.95 126.06 2wb0 s ARG 410 Ca 0.00 1.40 0.10 0.00 -0.13 0.00 0.00 55.73 57.10 2wb0 s ARG 410 Cb 0.00 -2.38 0.28 0.00 -1.56 0.00 0.00 34.95 31.29 2wb0 s ARG 410 CO 0.00 -0.17 1.23 1.04 -0.81 0.00 0.00 175.30 176.59 2wb0 n GLN 411 N -0.36 2.89 -3.87 5.12 1.13 -1.26 -4.64 117.38 116.39 2wb0 n GLN 411 Ca 0.06 -2.01 -0.09 0.00 -1.94 0.00 0.00 57.00 53.03 2wb0 n GLN 411 Cb 0.51 -1.25 -0.07 0.00 0.11 0.00 0.00 30.24 29.54 2wb0 n GLN 411 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2wb0 s LEU 412 N -1.01 1.38 0.17 1.08 1.43 -1.26 -4.93 118.68 115.54 2wb0 s LEU 412 Ca 0.21 -0.68 -0.33 0.00 -1.03 0.00 0.00 54.13 52.30 2wb0 s LEU 412 Cb 0.11 1.05 -0.15 0.00 0.03 0.00 0.00 46.19 47.23 2wb0 s LEU 412 CO 0.14 -0.75 1.28 -2.65 0.23 0.00 0.00 176.35 174.61 2wb0 n PRO 413 N -0.08 1.41 -1.90 1.29 -0.02 -1.26 -4.21 135.00 130.23 2wb0 n PRO 413 Ca -0.14 0.50 -0.37 0.00 -2.02 0.00 0.00 63.50 61.47 2wb0 n PRO 413 Cb 0.62 -2.08 0.04 0.00 -0.02 0.00 0.00 33.50 32.06 2wb0 n PRO 413 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2wb0 s LYS 414 N -0.10 3.11 -0.22 -0.52 2.20 -0.76 -4.76 119.74 118.70 2wb0 s LYS 414 Ca 0.75 2.05 -0.02 0.00 -0.36 0.00 0.00 55.97 58.40 2wb0 s LYS 414 Cb -0.82 -2.15 0.01 0.00 -1.51 0.00 0.00 37.83 33.37 2wb0 s LYS 414 CO 0.49 -1.16 -0.10 -1.17 -0.36 0.00 0.00 175.35 173.06 2wb0 s LEU 415 N -3.69 2.79 -0.04 5.43 0.20 -1.26 -1.65 118.68 120.46 2wb0 s LEU 415 Ca 0.73 -0.66 0.01 0.00 0.69 0.00 0.00 54.13 54.90 2wb0 s LEU 415 Cb -0.36 -1.63 0.02 0.00 -0.43 0.00 0.00 46.19 43.79 2wb0 s LEU 415 CO 0.41 -0.06 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.49 2wb0 s THR 416 N 1.36 0.46 0.09 3.68 2.01 -0.36 -4.86 115.64 118.03 2wb0 s THR 416 Ca 0.03 -0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.64 2wb0 s THR 416 Cb -0.15 -0.49 -0.05 0.00 0.01 0.00 0.00 72.50 71.82 2wb0 s THR 416 CO -0.07 0.20 0.98 -2.16 -0.69 0.00 0.00 174.62 172.89 2wb0 s PRO 417 N 0.87 4.66 -0.11 4.92 0.04 -1.26 -0.47 135.00 143.64 2wb0 s PRO 417 Ca -0.11 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.42 2wb0 s PRO 417 Cb -0.14 -3.38 -0.01 0.00 0.04 0.00 0.00 34.50 31.00 2wb0 s PRO 417 CO -0.00 0.14 -0.16 -0.06 0.04 0.00 0.00 177.00 176.96 2wb0 s PHE 418 N 0.21 2.73 0.41 0.56 0.40 0.46 -4.95 117.98 117.81 2wb0 s PHE 418 Ca 0.48 -0.70 -0.25 0.00 -0.60 0.00 0.00 56.93 55.86 2wb0 s PHE 418 Cb -0.23 -1.79 -0.08 0.00 0.51 0.00 0.00 43.02 41.42 2wb0 s PHE 418 CO 0.30 -0.23 1.27 0.00 0.70 0.00 0.00 175.22 177.26 2wb0 s ALA 419 N 0.25 3.20 -0.82 5.36 0.00 -1.26 -0.83 121.76 127.65 2wb0 s ALA 419 Ca -0.11 1.16 -0.17 0.00 0.00 0.00 0.00 51.96 52.84 2wb0 s ALA 419 Cb -0.16 -3.46 0.16 0.00 0.00 0.00 0.00 23.12 19.66 2wb0 s ALA 419 CO 0.06 -0.78 0.90 -0.51 0.00 0.00 0.00 175.76 175.44 2wb0 s LEU 420 N -2.53 5.78 0.00 0.00 1.43 -0.23 -4.85 118.68 118.28 2wb0 s LEU 420 Ca 0.58 -2.16 0.00 0.00 -1.03 0.00 0.00 54.13 51.52 2wb0 s LEU 420 Cb -0.36 -2.31 0.00 0.00 0.03 0.00 0.00 46.19 43.55 2wb0 s LEU 420 CO 0.46 -0.89 0.68 -1.54 0.23 0.00 0.00 176.35 175.29 2wb0 n SER 421 N 5.52 0.00 0.00 2.29 3.41 -1.26 -2.68 113.62 120.89 2wb0 n SER 421 Ca 0.13 0.68 0.02 0.00 -0.26 0.00 0.00 58.87 59.45 2wb0 n SER 421 Cb 0.47 -0.18 0.12 0.00 -0.26 0.00 0.00 64.21 64.35 2wb0 n SER 421 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2wb0 n ASN 422 N -1.44 0.00 0.11 4.04 5.03 -1.26 -3.83 115.26 117.91 2wb0 n ASN 422 Ca 0.00 0.13 0.10 0.00 0.87 0.00 0.00 54.58 55.67 2wb0 n ASN 422 Cb 0.00 -0.21 0.44 0.00 -1.02 0.00 0.00 39.78 38.99 2wb0 n ASN 422 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2wb0 n ALA 423 N -1.21 1.42 0.05 5.41 0.00 -1.09 -1.76 120.51 123.33 2wb0 n ALA 423 Ca 0.02 0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.64 2wb0 n ALA 423 Cb 0.03 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.10 2wb0 n ALA 423 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2wb0 n GLU 424 N -2.06 0.63 0.00 0.00 1.02 -1.25 -3.69 120.64 115.29 2wb0 n GLU 424 Ca 0.01 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2wb0 n GLU 424 Cb 0.14 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 29.85 2wb0 n GLU 424 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2wb0 n ASP 425 N -2.57 0.00 -4.76 1.62 -0.08 -0.72 -4.68 116.55 105.35 2wb0 n ASP 425 Ca -0.04 -0.37 -0.36 0.00 -1.51 0.00 0.00 54.79 52.52 2wb0 n ASP 425 Cb 0.61 -0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.99 2wb0 n ASP 425 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2wb0 s LEU 426 N -0.98 3.96 -0.79 -2.67 1.43 -1.24 -5.07 118.68 113.32 2wb0 s LEU 426 Ca 0.00 0.28 -0.24 0.00 -1.03 0.00 0.00 54.13 53.14 2wb0 s LEU 426 Cb 0.00 -1.95 0.06 0.00 0.03 0.00 0.00 46.19 44.33 2wb0 s LEU 426 CO 0.00 0.37 1.18 -0.62 0.23 0.00 0.00 176.35 177.51 2wb0 s ASP 427 N -0.79 6.28 0.56 2.29 2.15 -1.26 -4.91 116.67 120.99 2wb0 s ASP 427 Ca 0.13 -1.01 0.34 0.00 0.43 0.00 0.00 52.55 52.44 2wb0 s ASP 427 Cb -0.12 -2.49 1.49 0.00 -0.30 0.00 0.00 42.92 41.50 2wb0 s ASP 427 CO 0.03 -1.55 1.80 0.00 -0.17 0.00 0.00 175.17 175.28 2wb0 h ALA 428 N 9.68 2.91 0.00 3.66 0.00 -1.95 -2.16 119.26 131.39 2wb0 h ALA 428 Ca -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2wb0 h ALA 428 Cb 1.05 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2wb0 h ALA 428 CO 1.25 -1.30 0.00 -0.44 0.00 0.00 0.00 179.25 178.76 2wb0 h ASP 429 N 0.00 0.00 0.90 0.00 3.32 -2.05 -2.73 116.42 115.86 2wb0 h ASP 429 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 2wb0 h ASP 429 Cb 2.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.59 2wb0 h ASP 429 CO -0.01 0.00 -0.13 0.18 -1.72 0.00 0.00 179.24 177.56 2wb0 n LEU 430 N -2.97 0.17 -4.44 1.55 7.99 -0.81 -4.86 117.00 113.63 2wb0 n LEU 430 Ca 0.02 0.38 -0.34 0.00 -0.01 0.00 0.00 56.01 56.06 2wb0 n LEU 430 Cb 0.36 -0.43 -0.13 0.00 -0.11 0.00 0.00 43.42 43.12 2wb0 n LEU 430 CO 0.28 0.02 -0.36 -0.63 -1.51 0.00 0.00 177.39 175.19 2wb0 s ILE 431 N -3.01 3.75 -0.39 -0.08 1.01 -1.03 -4.96 121.20 116.49 2wb0 s ILE 431 Ca 0.13 -0.40 0.09 0.00 0.00 0.00 0.00 60.65 60.47 2wb0 s ILE 431 Cb 0.18 -2.66 -0.10 0.00 0.01 0.00 0.00 42.46 39.89 2wb0 s ILE 431 CO 0.58 0.47 0.37 -1.54 0.00 0.00 0.00 174.94 174.81 2wb0 n SER 432 N 3.93 0.70 -4.61 3.58 3.41 -1.26 -4.94 113.62 114.42 2wb0 n SER 432 Ca -0.17 -0.64 -0.43 0.00 -0.26 0.00 0.00 58.87 57.37 2wb0 n SER 432 Cb 0.52 1.05 -0.03 0.00 -0.26 0.00 0.00 64.21 65.49 2wb0 n SER 432 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wb0 s ASP 433 N -2.00 6.05 0.51 4.04 -1.08 -1.26 -4.85 116.67 118.08 2wb0 s ASP 433 Ca 0.03 1.50 0.17 0.00 -0.52 0.00 0.00 52.55 53.72 2wb0 s ASP 433 Cb 0.07 -2.53 1.25 0.00 -1.46 0.00 0.00 42.92 40.25 2wb0 s ASP 433 CO 0.38 -1.55 2.11 0.11 0.52 0.00 0.00 175.17 176.75 2wb0 h LYS 434 N 12.20 0.06 -0.20 4.34 1.79 -1.93 -0.89 116.57 131.94 2wb0 h LYS 434 Ca -0.35 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.13 2wb0 h LYS 434 Cb 1.17 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.79 2wb0 h LYS 434 CO 1.01 0.04 0.09 0.77 -1.08 0.00 0.00 179.45 180.28 2wb0 h SER 435 N 0.06 0.12 -0.49 0.86 0.02 -1.88 -1.51 113.55 110.73 2wb0 h SER 435 Ca 0.06 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 2wb0 h SER 435 Cb 0.16 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2wb0 h SER 435 CO -0.01 0.10 -0.07 0.58 -1.14 0.00 0.00 176.83 176.29 2wb0 h VAL 436 N 0.19 1.27 -0.05 2.27 2.07 -1.78 -2.96 116.25 117.26 2wb0 h VAL 436 Ca 0.08 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 2wb0 h VAL 436 Cb 0.03 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2wb0 h VAL 436 CO -0.07 0.41 -0.11 -0.07 0.02 0.00 0.00 177.57 177.76 2wb0 h LEU 437 N 0.77 0.07 -0.84 2.57 -0.00 -0.94 -1.08 115.31 115.86 2wb0 h LEU 437 Ca 0.13 -0.01 0.13 0.00 -0.00 0.00 0.00 57.88 58.13 2wb0 h LEU 437 Cb 0.61 -0.02 -0.09 0.00 -0.00 0.00 0.00 40.66 41.16 2wb0 h LEU 437 CO 0.04 0.20 0.45 0.00 -0.00 0.00 0.00 178.44 179.12 2wb0 h ALA 438 N 1.82 1.24 -0.08 1.53 0.00 -1.10 0.31 119.26 122.98 2wb0 h ALA 438 Ca 0.02 0.07 -0.21 0.00 0.00 0.00 0.00 54.91 54.78 2wb0 h ALA 438 Cb 0.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2wb0 h ALA 438 CO 0.02 -0.04 -0.82 0.77 0.00 0.00 0.00 179.25 179.18 2wb0 h SER 439 N 0.67 0.71 -0.04 0.00 0.02 -1.32 0.15 113.55 113.74 2wb0 h SER 439 Ca 0.44 -0.49 0.01 0.00 -0.84 0.00 0.00 61.79 60.91 2wb0 h SER 439 Cb 0.57 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2wb0 h SER 439 CO -0.33 1.27 0.00 0.58 -1.14 0.00 0.00 176.83 177.21 2wb0 h VAL 440 N 0.38 0.97 -0.04 2.27 2.07 -0.52 -2.19 116.25 119.19 2wb0 h VAL 440 Ca -0.06 -0.01 -0.11 0.00 0.82 0.00 0.00 66.70 67.34 2wb0 h VAL 440 Cb 1.43 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 2wb0 h VAL 440 CO 0.15 0.00 -0.50 0.45 0.02 0.00 0.00 177.57 177.69 2wb0 h HIS 441 N 0.02 0.11 -2.74 1.57 3.86 -0.46 -3.37 115.15 114.14 2wb0 h HIS 441 Ca 0.02 -0.04 -0.60 0.00 -1.16 0.00 0.00 60.37 58.59 2wb0 h HIS 441 Cb 0.02 -0.02 -0.40 0.00 1.06 0.00 0.00 27.41 28.07 2wb0 h HIS 441 CO -0.10 0.58 -0.78 -1.01 0.86 0.00 0.00 177.93 177.48 2wb0 s HIS 442 N -3.91 2.22 -1.57 2.45 3.76 0.04 -5.03 115.29 113.24 2wb0 s HIS 442 Ca -0.03 -2.75 -0.11 0.00 -0.15 0.00 0.00 55.06 52.03 2wb0 s HIS 442 Cb 0.13 -1.77 -0.04 0.00 1.11 0.00 0.00 32.58 32.00 2wb0 s HIS 442 CO 0.76 -0.71 2.74 -0.35 -0.85 0.00 0.00 174.74 176.33 2wb0 n PRO 443 N 2.59 3.53 -3.67 8.40 -0.04 -0.84 -4.50 135.00 140.48 2wb0 n PRO 443 Ca 0.23 -2.38 -0.14 0.00 -0.04 0.00 0.00 63.50 61.17 2wb0 n PRO 443 Cb 0.41 -2.92 -0.08 0.00 -0.04 0.00 0.00 33.50 30.87 2wb0 n PRO 443 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wb0 s ALA 444 N 2.25 -1.39 0.02 0.55 0.00 -1.26 -1.07 121.76 120.86 2wb0 s ALA 444 Ca 0.63 1.49 0.04 0.00 0.00 0.00 0.00 51.96 54.11 2wb0 s ALA 444 Cb 0.17 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 2wb0 s ALA 444 CO -0.07 -0.27 -0.06 -0.51 0.00 0.00 0.00 175.76 174.85 2wb0 s LEU 445 N 0.06 3.20 0.08 0.00 1.02 -0.01 -4.01 118.68 119.02 2wb0 s LEU 445 Ca -0.02 -0.16 -0.30 0.00 0.02 0.00 0.00 54.13 53.67 2wb0 s LEU 445 Cb -0.04 -1.86 -0.05 0.00 0.02 0.00 0.00 46.19 44.26 2wb0 s LEU 445 CO 0.02 0.27 1.10 -0.63 0.02 0.00 0.00 176.35 177.13 2wb0 s ILE 446 N -1.04 4.23 -0.08 -0.59 1.01 -1.26 -0.40 121.20 123.07 2wb0 s ILE 446 Ca 0.18 1.69 0.03 0.00 0.00 0.00 0.00 60.65 62.55 2wb0 s ILE 446 Cb -0.11 -4.08 0.01 0.00 0.01 0.00 0.00 42.46 38.28 2wb0 s ILE 446 CO 0.09 0.18 -0.17 -0.69 0.00 0.00 0.00 174.94 174.35 2wb0 s VAL 447 N 0.65 1.49 -0.17 2.92 1.01 0.38 -0.54 120.40 126.14 2wb0 s VAL 447 Ca 0.54 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 2wb0 s VAL 447 Cb -0.27 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 2wb0 s VAL 447 CO 0.30 0.43 0.19 -0.36 0.00 0.00 0.00 175.10 175.67 2wb0 s PHE 448 N 0.49 3.47 0.00 5.22 0.08 0.15 -1.22 117.98 126.18 2wb0 s PHE 448 Ca -0.15 0.47 0.00 0.00 0.12 0.00 0.00 56.93 57.37 2wb0 s PHE 448 Cb -0.16 -2.18 0.00 0.00 -0.57 0.00 0.00 43.02 40.11 2wb0 s PHE 448 CO 0.05 0.36 0.00 1.04 -0.10 0.00 0.00 175.22 176.58 2wb0 n GLN 449 N 3.21 1.29 -1.39 0.44 6.02 -0.66 -1.00 117.38 125.29 2wb0 n GLN 449 Ca -0.15 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.47 2wb0 n GLN 449 Cb 0.52 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.84 2wb0 n GLN 449 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wb0 n ASN 452 N -5.15 0.20 -4.77 0.00 4.13 -1.26 -4.22 115.26 104.20 2wb0 n ASN 452 Ca 0.24 -2.55 -0.35 0.00 1.68 0.00 0.00 54.58 53.60 2wb0 n ASN 452 Cb 0.75 -0.59 0.01 0.00 -1.54 0.00 0.00 39.78 38.40 2wb0 n ASN 452 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 2wb0 s PRO 453 N -0.32 3.27 -0.15 3.52 0.02 -1.25 -4.71 135.00 135.39 2wb0 s PRO 453 Ca 0.32 1.58 -0.20 0.00 0.02 0.00 0.00 61.00 62.72 2wb0 s PRO 453 Cb 0.04 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 2wb0 s PRO 453 CO -0.19 -0.91 0.57 0.08 -0.33 0.00 0.00 177.00 176.23 2wb0 s VAL 454 N -1.85 5.10 -0.96 3.83 1.01 -1.26 -5.09 120.40 121.18 2wb0 s VAL 454 Ca 0.72 1.11 0.11 0.00 0.00 0.00 0.00 61.98 63.92 2wb0 s VAL 454 Cb -0.23 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 2wb0 s VAL 454 CO 0.29 0.22 0.65 -1.22 0.00 0.00 0.00 175.10 175.04 2wb0 n TYR 455 N 4.28 0.00 0.00 5.22 4.02 -1.26 -5.18 117.16 124.24 2wb0 n TYR 455 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 2wb0 n TYR 455 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 2wb0 n TYR 455 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wb0 n GLY 464 N 1.00 0.00 3.79 2.72 0.00 -1.26 -5.38 105.19 106.06 2wb0 n GLY 464 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2wb0 n GLY 464 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wb0 s PRO 465 N -0.33 3.31 0.01 1.61 0.04 -1.26 -5.08 135.00 133.29 2wb0 s PRO 465 Ca 0.00 1.30 -0.18 0.00 0.04 0.00 0.00 61.00 62.16 2wb0 s PRO 465 Cb 0.00 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.55 2wb0 s PRO 465 CO 0.00 -0.83 0.38 0.54 0.04 0.00 0.00 177.00 177.13 2wb0 s ASN 466 N -2.54 -0.26 0.29 6.66 4.22 -1.26 -4.79 114.94 117.25 2wb0 s ASN 466 Ca 0.66 0.10 0.04 0.00 -2.14 0.00 0.00 52.86 51.51 2wb0 s ASN 466 Cb -0.17 0.38 -0.04 0.00 1.28 0.00 0.00 41.25 42.70 2wb0 s ASN 466 CO 0.34 -0.55 0.20 0.00 -2.04 0.00 0.00 177.10 175.05 2wb0 n ASP 468 N -1.00 4.73 -4.62 0.00 5.68 -1.26 -4.49 116.55 115.59 2wb0 n ASP 468 Ca 0.04 -2.62 -0.48 0.00 -0.50 0.00 0.00 54.79 51.22 2wb0 n ASP 468 Cb 0.64 -0.61 -0.04 0.00 -1.14 0.00 0.00 41.12 39.97 2wb0 n ASP 468 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2wb0 n PHE 469 N 0.73 1.74 -3.39 2.11 7.35 -1.26 -4.92 117.46 119.82 2wb0 n PHE 469 Ca 0.23 0.53 0.02 0.00 -0.76 0.00 0.00 57.45 57.47 2wb0 n PHE 469 Cb 0.95 -2.39 -0.03 0.00 0.35 0.00 0.00 39.48 38.37 2wb0 n PHE 469 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 2wb0 s LYS 470 N 0.14 0.51 -0.17 -4.13 2.20 -1.25 -3.08 119.74 113.95 2wb0 s LYS 470 Ca 0.77 1.10 -0.14 0.00 -0.36 0.00 0.00 55.97 57.34 2wb0 s LYS 470 Cb -0.80 0.65 0.05 0.00 -1.51 0.00 0.00 37.83 36.21 2wb0 s LYS 470 CO 0.47 -0.34 0.44 -1.50 -0.36 0.00 0.00 175.35 174.06 2wb0 s ILE 471 N 2.83 -0.01 0.34 5.43 2.07 -0.17 -1.11 121.20 130.58 2wb0 s ILE 471 Ca 0.05 0.03 -0.07 0.00 -1.41 0.00 0.00 60.65 59.25 2wb0 s ILE 471 Cb -0.12 -0.63 -0.06 0.00 0.13 0.00 0.00 42.46 41.78 2wb0 s ILE 471 CO -0.19 0.01 0.64 -0.94 -1.91 0.00 0.00 174.94 172.55 2wb0 s SER 472 N 0.62 6.47 0.23 4.50 1.04 -1.21 -0.67 113.70 124.69 2wb0 s SER 472 Ca -0.03 0.88 -0.07 0.00 0.48 0.00 0.00 55.95 57.21 2wb0 s SER 472 Cb -0.05 -2.21 0.30 0.00 0.10 0.00 0.00 66.02 64.16 2wb0 s SER 472 CO -0.04 -0.28 1.83 0.00 0.98 0.00 0.00 173.24 175.73 2wb0 h ALA 473 N 1.48 1.06 -0.40 5.32 0.00 -1.18 0.34 119.26 125.87 2wb0 h ALA 473 Ca -0.47 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2wb0 h ALA 473 Cb 1.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2wb0 h ALA 473 CO 0.65 0.17 -0.03 -1.35 0.00 0.00 0.00 179.25 178.69 2wb0 h PRO 474 N 0.84 0.66 -0.10 0.00 0.11 -1.94 -2.02 132.00 129.54 2wb0 h PRO 474 Ca 0.35 -0.17 -0.12 0.00 0.11 0.00 0.00 66.00 66.17 2wb0 h PRO 474 Cb 0.20 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 2wb0 h PRO 474 CO -0.18 0.70 -0.46 -0.44 -0.21 0.00 0.00 178.00 177.40 2wb0 h ASP 475 N 0.62 0.26 -0.46 -2.05 3.32 -1.76 -1.06 116.42 115.28 2wb0 h ASP 475 Ca 0.12 -0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2wb0 h ASP 475 Cb 0.43 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2wb0 h ASP 475 CO 0.02 0.69 0.10 0.25 -1.72 0.00 0.00 179.24 178.58 2wb0 h LEU 476 N 0.20 0.72 -0.63 1.55 6.46 -0.60 0.77 115.31 123.79 2wb0 h LEU 476 Ca 0.01 -0.24 -0.08 0.00 -0.12 0.00 0.00 57.88 57.45 2wb0 h LEU 476 Cb 0.90 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.61 2wb0 h LEU 476 CO 0.07 0.78 0.10 0.25 -0.62 0.00 0.00 178.44 179.02 2wb0 h LEU 477 N 0.63 1.00 -1.47 2.25 6.46 -1.22 -2.32 115.31 120.63 2wb0 h LEU 477 Ca 0.14 -0.26 -0.06 0.00 -0.12 0.00 0.00 57.88 57.58 2wb0 h LEU 477 Cb 0.35 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.01 2wb0 h LEU 477 CO 0.00 1.01 -0.27 0.78 -0.62 0.00 0.00 178.44 179.35 2wb0 h ASN 478 N 0.95 0.00 -0.53 1.25 2.35 -0.93 -0.19 115.58 118.48 2wb0 h ASN 478 Ca 0.19 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 2wb0 h ASN 478 Cb 0.44 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 2wb0 h ASN 478 CO 0.01 0.27 0.22 0.00 -1.65 0.00 0.00 177.43 176.28 2wb0 h ALA 479 N 1.73 0.69 -0.25 -0.83 0.00 -0.32 0.29 119.26 120.57 2wb0 h ALA 479 Ca -0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2wb0 h ALA 479 Cb 0.50 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2wb0 h ALA 479 CO 0.03 0.29 0.10 1.25 0.00 0.00 0.00 179.25 180.93 2wb0 h LEU 480 N 0.71 0.33 -0.84 0.00 5.85 -0.85 -1.86 115.31 118.66 2wb0 h LEU 480 Ca 0.18 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 2wb0 h LEU 480 Cb 0.18 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2wb0 h LEU 480 CO -0.02 0.40 0.15 0.58 -0.34 0.00 0.00 178.44 179.21 2wb0 h VAL 481 N 0.25 1.25 -0.02 1.05 2.07 -0.81 -1.76 116.25 118.28 2wb0 h VAL 481 Ca 0.08 -0.93 -0.17 0.00 0.82 0.00 0.00 66.70 66.50 2wb0 h VAL 481 Cb 0.16 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2wb0 h VAL 481 CO -0.01 0.35 -0.75 0.24 0.02 0.00 0.00 177.57 177.43 2wb0 h MET 482 N 0.97 0.16 -0.85 1.57 2.86 -0.40 -2.02 114.93 117.22 2wb0 h MET 482 Ca 0.20 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 2wb0 h MET 482 Cb 0.36 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 2wb0 h MET 482 CO 0.00 0.83 0.46 0.28 1.06 0.00 0.00 176.91 179.54 2wb0 h VAL 483 N 0.10 1.25 -0.86 -2.22 2.07 -0.96 -1.03 116.25 114.60 2wb0 h VAL 483 Ca -0.02 -0.64 0.02 0.00 0.82 0.00 0.00 66.70 66.88 2wb0 h VAL 483 Cb 1.32 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2wb0 h VAL 483 CO 0.11 0.29 0.56 0.03 0.02 0.00 0.00 177.57 178.58 2wb0 h ARG 484 N 1.19 1.09 -0.10 1.57 3.08 -0.84 0.29 114.38 120.67 2wb0 h ARG 484 Ca 0.30 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2wb0 h ARG 484 Cb 0.05 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 2wb0 h ARG 484 CO -0.05 0.72 0.06 0.77 -1.07 0.00 0.00 179.97 180.41 2wb0 h SER 485 N 1.13 0.12 -0.65 7.04 0.02 -0.89 -1.18 113.55 119.14 2wb0 h SER 485 Ca 0.33 -0.03 0.05 0.00 -0.84 0.00 0.00 61.79 61.29 2wb0 h SER 485 Cb -0.07 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.39 2wb0 h SER 485 CO -0.09 0.11 0.38 0.25 -1.14 0.00 0.00 176.83 176.34 2wb0 h LEU 486 N 0.11 0.58 -0.46 5.07 5.85 -0.70 -2.09 115.31 123.67 2wb0 h LEU 486 Ca 0.04 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.78 2wb0 h LEU 486 Cb 0.01 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2wb0 h LEU 486 CO -0.01 0.39 0.29 -0.25 -0.34 0.00 0.00 178.44 178.53 2wb0 h TRP 487 N 0.71 0.56 0.00 1.25 2.91 -0.17 -2.59 115.95 118.62 2wb0 h TRP 487 Ca 0.28 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.29 2wb0 h TRP 487 Cb 0.12 -0.19 -0.00 0.00 -0.51 0.00 0.00 29.16 28.58 2wb0 h TRP 487 CO -0.07 0.34 -0.12 0.66 -1.03 0.00 0.00 178.44 178.23 2wb0 h SER 488 N 0.60 0.00 0.23 2.65 4.64 -0.58 0.33 113.55 121.42 2wb0 h SER 488 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2wb0 h SER 488 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2wb0 h SER 488 CO -0.05 0.12 -0.02 -0.62 -0.87 0.00 0.00 176.83 175.38 2wb0 n GLU 489 N -3.70 0.84 0.00 4.77 1.02 -0.87 -4.16 120.64 118.52 2wb0 n GLU 489 Ca -0.02 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 2wb0 n GLU 489 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 2wb0 n GLU 489 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2wb0 n ASN 490 N -0.97 3.01 -4.11 1.62 4.13 0.88 -5.07 115.26 114.75 2wb0 n ASN 490 Ca 0.19 0.00 -0.12 0.00 1.68 0.00 0.00 54.58 56.33 2wb0 n ASN 490 Cb 0.20 0.60 -0.11 0.00 -1.54 0.00 0.00 39.78 38.94 2wb0 n ASN 490 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2wb0 s PHE 491 N -1.20 0.76 -0.31 3.10 0.40 0.43 -5.08 117.98 116.08 2wb0 s PHE 491 Ca 0.00 -0.72 0.22 0.00 -0.60 0.00 0.00 56.93 55.84 2wb0 s PHE 491 Cb 0.00 -0.45 -0.12 0.00 0.51 0.00 0.00 43.02 42.95 2wb0 s PHE 491 CO 0.00 -0.13 0.82 0.25 0.70 0.00 0.00 175.22 176.86 2wb0 n THR 492 N 0.71 0.22 -4.40 0.64 -2.24 -1.26 -4.37 114.28 103.58 2wb0 n THR 492 Ca -0.17 -0.41 -0.26 0.00 -2.27 0.00 0.00 64.05 60.93 2wb0 n THR 492 Cb 0.58 0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.71 2wb0 n THR 492 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wb0 s GLU 493 N -3.35 1.45 -0.25 -0.78 8.01 -1.26 -5.08 118.70 117.44 2wb0 s GLU 493 Ca -0.02 -1.47 -0.12 0.00 0.01 0.00 0.00 54.97 53.37 2wb0 s GLU 493 Cb 0.13 -1.76 -0.05 0.00 -4.31 0.00 0.00 34.13 28.14 2wb0 s GLU 493 CO 0.84 0.38 0.25 -1.17 0.01 0.00 0.00 175.26 175.58 2wb0 s LEU 494 N -2.56 4.08 0.80 1.80 0.20 -1.26 -4.96 118.68 116.78 2wb0 s LEU 494 Ca 0.19 0.18 -0.13 0.00 0.69 0.00 0.00 54.13 55.05 2wb0 s LEU 494 Cb -0.08 -2.24 0.08 0.00 -0.43 0.00 0.00 46.19 43.52 2wb0 s LEU 494 CO 0.09 -0.04 1.17 -2.84 -0.29 0.00 0.00 176.35 174.43 2wb0 s PRO 495 N 1.52 1.73 0.27 0.98 0.02 -1.26 -4.96 135.00 133.29 2wb0 s PRO 495 Ca 0.11 1.61 -0.30 0.00 0.02 0.00 0.00 61.00 62.43 2wb0 s PRO 495 Cb -0.15 -1.80 -0.13 0.00 0.02 0.00 0.00 34.50 32.44 2wb0 s PRO 495 CO 0.08 -2.11 1.41 -2.13 -0.33 0.00 0.00 177.00 173.91 2wb0 n ARG 496 N -3.39 2.13 -3.53 5.54 0.63 -1.26 -5.00 116.66 111.78 2wb0 n ARG 496 Ca 0.12 0.76 -0.12 0.00 -0.92 0.00 0.00 57.85 57.69 2wb0 n ARG 496 Cb 0.51 -2.41 -0.11 0.00 0.45 0.00 0.00 32.46 30.90 2wb0 n ARG 496 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 2wb0 s MET 497 N -0.70 0.26 -0.29 -0.14 1.75 -1.26 -4.81 119.30 114.10 2wb0 s MET 497 Ca 0.65 0.63 -0.09 0.00 -1.25 0.00 0.00 55.69 55.63 2wb0 s MET 497 Cb -0.62 -0.34 -0.01 0.00 2.84 0.00 0.00 34.83 36.71 2wb0 s MET 497 CO 0.52 -0.47 0.12 0.08 -0.65 0.00 0.00 175.02 174.63 2wb0 s VAL 498 N 2.48 4.49 -0.10 10.11 1.01 -1.26 -5.07 120.40 132.06 2wb0 s VAL 498 Ca 0.06 -0.36 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 2wb0 s VAL 498 Cb -0.14 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 2wb0 s VAL 498 CO -0.12 0.15 1.05 -0.69 0.00 0.00 0.00 175.10 175.48 2wb0 s VAL 499 N 1.61 4.68 0.37 2.92 1.01 -1.26 -4.99 120.40 124.73 2wb0 s VAL 499 Ca 0.05 1.96 -0.28 0.00 0.00 0.00 0.00 61.98 63.70 2wb0 s VAL 499 Cb -0.16 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 31.85 2wb0 s VAL 499 CO 0.05 -0.00 1.50 -2.84 0.00 0.00 0.00 175.10 173.81 2wb0 s PRO 500 N 2.11 4.10 0.24 2.72 0.02 -1.26 -4.51 135.00 138.42 2wb0 s PRO 500 Ca 0.50 2.59 -0.30 0.00 0.02 0.00 0.00 61.00 63.81 2wb0 s PRO 500 Cb -0.19 -2.97 -0.09 0.00 0.02 0.00 0.00 34.50 31.26 2wb0 s PRO 500 CO 0.18 -0.56 1.29 -1.21 -0.33 0.00 0.00 177.00 176.38 2wb0 s GLU 501 N -1.95 4.40 0.21 5.54 0.41 -1.26 -1.19 118.70 124.85 2wb0 s GLU 501 Ca 0.54 2.09 -0.30 0.00 -0.41 0.00 0.00 54.97 56.89 2wb0 s GLU 501 Cb -0.47 -3.16 -0.08 0.00 -1.78 0.00 0.00 34.13 28.64 2wb0 s GLU 501 CO 0.62 -0.20 1.17 0.12 -0.49 0.00 0.00 175.26 176.49 2wb0 s PHE 502 N -0.35 3.46 -0.03 1.61 5.36 0.18 -4.76 117.98 123.45 2wb0 s PHE 502 Ca 0.54 1.49 0.02 0.00 -0.96 0.00 0.00 56.93 58.02 2wb0 s PHE 502 Cb -0.37 -3.39 0.00 0.00 -0.34 0.00 0.00 43.02 38.92 2wb0 s PHE 502 CO 0.43 -1.04 -0.09 0.15 -1.46 0.00 0.00 175.22 173.21 2wb0 s LYS 503 N -0.53 1.01 0.29 10.12 1.02 -1.26 -4.82 119.74 125.57 2wb0 s LYS 503 Ca 0.51 -0.30 -0.29 0.00 0.02 0.00 0.00 55.97 55.90 2wb0 s LYS 503 Cb -0.32 -0.94 -0.10 0.00 -0.52 0.00 0.00 37.83 35.95 2wb0 s LYS 503 CO 0.38 0.10 1.31 -0.46 -0.92 0.00 0.00 175.35 175.75 2wb0 s TRP 504 N 0.26 3.14 0.28 3.18 -0.11 -1.26 -5.00 118.94 119.42 2wb0 s TRP 504 Ca -0.04 1.35 -0.15 0.00 1.22 0.00 0.00 56.10 58.47 2wb0 s TRP 504 Cb -0.09 -3.65 0.01 0.00 -1.50 0.00 0.00 33.47 28.24 2wb0 s TRP 504 CO 0.01 -1.86 0.59 -1.54 -4.62 0.00 0.00 176.95 169.52 2wb0 s SER 505 N -0.23 -0.08 0.51 5.86 1.04 -1.26 -5.04 113.70 114.49 2wb0 s SER 505 Ca 0.52 -0.87 0.30 0.00 0.48 0.00 0.00 55.95 56.38 2wb0 s SER 505 Cb -0.39 0.66 1.08 0.00 0.10 0.00 0.00 66.02 67.48 2wb0 s SER 505 CO 0.47 -1.27 1.88 0.71 0.98 0.00 0.00 173.24 176.01 2wb0 h THR 506 N 2.14 0.00 0.00 2.02 1.35 -1.99 -1.79 112.91 114.64 2wb0 h THR 506 Ca -0.24 -0.62 -0.00 0.00 -0.55 0.00 0.00 66.41 64.99 2wb0 h THR 506 Cb 1.25 1.61 -0.00 0.00 -1.73 0.00 0.00 68.15 69.28 2wb0 h THR 506 CO 0.32 0.00 -0.00 0.07 -0.25 0.00 0.00 175.52 175.65 2wb0 h LYS 507 N 0.00 0.00 -0.02 4.72 2.10 -1.98 -0.84 116.57 120.55 2wb0 h LYS 507 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2wb0 h LYS 507 Cb 0.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 2wb0 h LYS 507 CO 0.00 0.00 -0.15 0.72 -2.00 0.00 0.00 179.45 178.03 2wb0 n HIS 508 N -3.68 0.00 -1.76 0.07 8.25 -0.67 -4.94 115.22 112.49 2wb0 n HIS 508 Ca -0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2wb0 n HIS 508 Cb 0.09 -0.03 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 2wb0 n HIS 508 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2wb0 n GLN 509 N 0.22 2.62 -1.83 -0.41 7.27 -0.32 -4.43 117.38 120.50 2wb0 n GLN 509 Ca 0.14 0.92 -0.41 0.00 0.07 0.00 0.00 57.00 57.73 2wb0 n GLN 509 Cb 0.43 -2.65 -0.00 0.00 2.41 0.00 0.00 30.24 30.43 2wb0 n GLN 509 CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 2wb0 s TYR 510 N -0.76 2.61 -0.51 3.69 6.14 -0.20 -4.64 117.35 123.68 2wb0 s TYR 510 Ca 0.57 1.19 -0.14 0.00 0.64 0.00 0.00 57.07 59.33 2wb0 s TYR 510 Cb -0.49 -3.99 0.12 0.00 0.42 0.00 0.00 41.96 38.01 2wb0 s TYR 510 CO 0.59 -2.91 0.45 1.03 0.64 0.00 0.00 175.55 175.35 2wb0 s ARG 511 N -2.10 2.87 0.08 4.97 0.52 -0.04 -4.63 118.95 120.63 2wb0 s ARG 511 Ca 0.53 -1.67 -0.10 0.00 -0.52 0.00 0.00 55.73 53.97 2wb0 s ARG 511 Cb -0.46 -4.19 -0.06 0.00 0.52 0.00 0.00 34.95 30.76 2wb0 s ARG 511 CO 0.62 -1.26 0.41 1.21 0.02 0.00 0.00 175.30 176.30 2wb0 s ASN 512 N 3.25 6.65 -0.10 0.23 2.47 -1.26 0.07 114.94 126.24 2wb0 s ASN 512 Ca 0.04 0.80 0.01 0.00 0.42 0.00 0.00 52.86 54.13 2wb0 s ASN 512 Cb -0.28 -2.18 0.02 0.00 -1.45 0.00 0.00 41.25 37.35 2wb0 s ASN 512 CO 0.03 0.17 -0.13 0.54 -3.72 0.00 0.00 177.10 173.98 2wb0 s VAL 513 N -1.40 1.37 -0.34 -5.21 0.11 -1.26 -4.94 120.40 108.73 2wb0 s VAL 513 Ca 0.33 -0.56 -0.04 0.00 -2.93 0.00 0.00 61.98 58.79 2wb0 s VAL 513 Cb -0.14 -1.27 0.06 0.00 -1.53 0.00 0.00 36.38 33.50 2wb0 s VAL 513 CO 0.18 0.42 0.08 -0.55 -3.33 0.00 0.00 175.10 171.90 2wb0 s SER 514 N 1.08 5.12 -0.21 3.54 0.15 -1.26 -5.08 113.70 117.05 2wb0 s SER 514 Ca -0.05 -1.37 -0.03 0.00 0.70 0.00 0.00 55.95 55.20 2wb0 s SER 514 Cb -0.15 -1.79 -0.01 0.00 -1.71 0.00 0.00 66.02 62.36 2wb0 s SER 514 CO -0.02 -0.34 -0.06 -0.76 1.20 0.00 0.00 173.24 173.25 2wb0 s LEU 515 N 1.29 2.83 0.37 3.45 1.02 -1.26 -5.09 118.68 121.29 2wb0 s LEU 515 Ca -0.01 -0.40 -0.27 0.00 0.02 0.00 0.00 54.13 53.46 2wb0 s LEU 515 Cb -0.20 -1.71 -0.11 0.00 0.02 0.00 0.00 46.19 44.18 2wb0 s LEU 515 CO -0.00 0.00 1.28 -2.65 0.02 0.00 0.00 176.35 175.00 2wb0 n PRO 516 N 4.66 2.07 -4.53 1.29 -0.02 -1.26 -4.99 135.00 132.21 2wb0 n PRO 516 Ca -0.18 0.73 -0.31 0.00 -2.02 0.00 0.00 63.50 61.72 2wb0 n PRO 516 Cb 0.51 -2.35 -0.17 0.00 -0.02 0.00 0.00 33.50 31.47 2wb0 n PRO 516 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2wb0 s VAL 517 N -1.14 1.81 0.24 -1.45 -7.23 -1.26 -5.10 120.40 106.27 2wb0 s VAL 517 Ca 0.57 -0.82 -0.30 0.00 -1.81 0.00 0.00 61.98 59.62 2wb0 s VAL 517 Cb -0.54 -1.62 -0.09 0.00 0.56 0.00 0.00 36.38 34.68 2wb0 s VAL 517 CO 0.61 0.50 1.34 0.00 -0.31 0.00 0.00 175.10 177.24 2wb0 s ALA 518 N 0.94 3.55 0.55 1.32 0.00 -1.26 -5.00 121.76 121.85 2wb0 s ALA 518 Ca -0.06 1.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.96 2wb0 s ALA 518 Cb -0.15 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 2wb0 s ALA 518 CO -0.03 -0.60 0.98 -1.58 0.00 0.00 0.00 175.76 174.53 2wb0 s HIS 519 N -0.20 3.52 0.53 0.00 2.46 -1.26 -5.03 115.29 115.31 2wb0 s HIS 519 Ca 0.56 1.35 -0.16 0.00 0.47 0.00 0.00 55.06 57.27 2wb0 s HIS 519 Cb -0.38 -2.73 -0.07 0.00 -0.13 0.00 0.00 32.58 29.27 2wb0 s HIS 519 CO 0.42 -0.47 1.00 -1.54 -2.47 0.00 0.00 174.74 171.69 2wb0 s SER 520 N -3.52 6.48 -0.03 9.88 1.04 -1.26 -5.05 113.70 121.24 2wb0 s SER 520 Ca 0.57 1.61 -0.00 0.00 0.48 0.00 0.00 55.95 58.60 2wb0 s SER 520 Cb -0.10 -2.51 0.03 0.00 0.10 0.00 0.00 66.02 63.53 2wb0 s SER 520 CO 0.40 -0.68 0.02 -0.62 0.98 0.00 0.00 173.24 173.34 2wb0 s ASP 521 N -3.03 0.60 0.56 7.02 -1.08 -1.26 -5.02 116.67 114.46 2wb0 s ASP 521 Ca 0.60 0.01 0.33 0.00 -0.52 0.00 0.00 52.55 52.97 2wb0 s ASP 521 Cb -0.11 -0.18 1.64 0.00 -1.46 0.00 0.00 42.92 42.80 2wb0 s ASP 521 CO 0.32 -0.15 2.11 0.00 0.52 0.00 0.00 175.17 177.97 2wb0 h ALA 522 N 7.63 1.12 -2.84 3.66 0.00 -2.00 -3.44 119.26 123.39 2wb0 h ALA 522 Ca -0.34 -0.06 -0.52 0.00 0.00 0.00 0.00 54.91 53.98 2wb0 h ALA 522 Cb 1.13 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 18.99 2wb0 h ALA 522 CO 0.38 0.08 0.56 1.03 0.00 0.00 0.00 179.25 181.30 2wb0 s ARG 523 N -4.01 3.72 0.23 0.00 0.52 -1.26 -4.93 118.95 113.22 2wb0 s ARG 523 Ca -0.02 2.02 -0.00 0.00 -0.52 0.00 0.00 55.73 57.21 2wb0 s ARG 523 Cb 0.12 -2.52 0.25 0.00 0.52 0.00 0.00 34.95 33.31 2wb0 s ARG 523 CO 0.53 -0.66 1.60 0.37 0.02 0.00 0.00 175.30 177.17 2wb0 h GLN 524 N 2.19 0.51 -6.41 3.54 4.15 -2.03 -3.46 115.11 113.60 2wb0 h GLN 524 Ca -0.50 -0.26 -0.66 0.00 0.77 0.00 0.00 58.65 58.00 2wb0 h GLN 524 Cb 1.26 0.00 -0.29 0.00 0.21 0.00 0.00 27.48 28.66 2wb0 h GLN 524 CO 0.61 0.84 -0.87 -0.80 -1.93 0.00 0.00 178.83 176.67 2wb0 s ASN 525 N -6.86 2.83 0.31 -0.69 0.01 -1.26 -5.04 114.94 104.24 2wb0 s ASN 525 Ca -0.07 -0.46 0.02 0.00 -0.71 0.00 0.00 52.86 51.64 2wb0 s ASN 525 Cb 0.12 -0.30 0.50 0.00 0.41 0.00 0.00 41.25 41.98 2wb0 s ASN 525 CO 0.82 0.28 1.83 1.55 -1.51 0.00 0.00 177.10 180.06 2wb0 h PRO 526 N 5.38 0.63 -4.98 -0.60 0.13 -2.02 -3.45 132.00 127.09 2wb0 h PRO 526 Ca -0.42 -0.15 -0.39 0.00 -0.87 0.00 0.00 66.00 64.17 2wb0 h PRO 526 Cb 1.13 -0.08 -0.25 0.00 0.13 0.00 0.00 31.00 31.93 2wb0 h PRO 526 CO 0.46 0.65 -0.77 -0.06 -0.23 0.00 0.00 178.00 178.05 2wb0 s PHE 527 N -4.97 0.97 0.24 1.56 0.08 -1.26 -5.13 117.98 109.47 2wb0 s PHE 527 Ca -0.08 -0.33 -0.30 0.00 0.12 0.00 0.00 56.93 56.34 2wb0 s PHE 527 Cb 0.15 -0.59 -0.09 0.00 -0.57 0.00 0.00 43.02 41.93 2wb0 s PHE 527 CO 0.78 -0.00 0.99 -0.51 -0.10 0.00 0.00 175.22 176.38 2wb0 s ASP 528 N -1.00 7.54 0.00 1.36 1.01 -1.26 -5.18 116.67 119.13 2wb0 s ASP 528 Ca -0.01 2.02 0.06 0.00 0.71 0.00 0.00 52.55 55.33 2wb0 s ASP 528 Cb -0.07 -2.61 0.05 0.00 1.01 0.00 0.00 42.92 41.29 2wb0 s ASP 528 CO 0.01 0.06 0.68 0.49 0.21 0.00 0.00 175.17 176.62