#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wpa s PRO 176 N 0.00 -0.49 -0.12 5.55 0.02 -1.26 -5.03 135.00 133.67 2wpa s PRO 176 Ca 0.00 0.38 -0.15 0.00 0.02 0.00 0.00 61.00 61.25 2wpa s PRO 176 Cb 0.00 -1.64 -0.26 0.00 0.02 0.00 0.00 34.50 32.62 2wpa s PRO 176 CO 0.00 -3.32 0.49 -0.44 -0.33 0.00 0.00 177.00 173.40 2wpa h ASP 177 N -2.31 0.34 -0.53 2.53 3.32 -2.08 -3.36 116.42 114.32 2wpa h ASP 177 Ca -0.53 -0.83 0.00 0.00 0.02 0.00 0.00 57.03 55.69 2wpa h ASP 177 Cb 1.33 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2wpa h ASP 177 CO 0.49 1.64 0.00 -1.22 -1.72 0.00 0.00 179.24 178.43 2wpa n TYR 178 N -3.92 1.69 -0.10 4.55 4.01 -1.26 -4.63 117.16 117.50 2wpa n TYR 178 Ca -0.27 -0.72 -0.06 0.00 -0.16 0.00 0.00 57.90 56.70 2wpa n TYR 178 Cb 0.90 -0.40 0.01 0.00 -0.31 0.00 0.00 39.34 39.54 2wpa n TYR 178 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2wpa h HIS 179 N 3.58 -0.14 -0.29 -0.72 2.76 -1.98 0.43 115.15 118.79 2wpa h HIS 179 Ca 0.00 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.13 2wpa h HIS 179 Cb 1.72 0.12 -0.01 0.00 1.55 0.00 0.00 27.41 30.79 2wpa h HIS 179 CO 0.88 -0.13 -0.09 1.49 -1.30 0.00 0.00 177.93 178.78 2wpa h GLU 180 N 0.02 0.57 -0.50 5.26 4.81 -1.90 -2.41 114.58 120.44 2wpa h GLU 180 Ca 0.17 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2wpa h GLU 180 Cb 0.25 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2wpa h GLU 180 CO -0.34 0.78 0.26 -0.44 -0.73 0.00 0.00 179.01 178.54 2wpa h ASP 181 N 0.33 0.61 -0.14 1.04 3.32 -1.74 -2.20 116.42 117.65 2wpa h ASP 181 Ca 0.07 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 2wpa h ASP 181 Cb 0.59 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 2wpa h ASP 181 CO 0.03 0.51 -0.17 0.40 -1.72 0.00 0.00 179.24 178.29 2wpa h ILE 182 N 0.70 1.36 -0.08 0.35 2.04 -0.79 -1.58 117.51 119.51 2wpa h ILE 182 Ca 0.18 -1.37 0.03 0.00 1.00 0.00 0.00 64.86 64.70 2wpa h ILE 182 Cb 0.04 1.94 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 2wpa h ILE 182 CO -0.03 0.40 -0.11 -0.74 0.00 0.00 0.00 178.15 177.68 2wpa h HIS 183 N -0.04 -0.26 -0.93 1.37 2.76 -1.25 0.15 115.15 116.95 2wpa h HIS 183 Ca 0.02 0.01 0.12 0.00 -2.20 0.00 0.00 60.37 58.32 2wpa h HIS 183 Cb 0.72 0.13 -0.08 0.00 1.55 0.00 0.00 27.41 29.72 2wpa h HIS 183 CO 0.09 -0.16 0.56 1.15 -1.30 0.00 0.00 177.93 178.27 2wpa h THR 184 N -0.14 0.89 -0.37 6.26 2.02 -1.40 0.36 112.91 120.53 2wpa h THR 184 Ca 0.07 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 66.83 2wpa h THR 184 Cb 0.24 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.56 2wpa h THR 184 CO -0.16 0.16 -0.19 0.22 0.37 0.00 0.00 175.52 175.91 2wpa h TYR 185 N 0.88 0.90 -0.61 3.16 3.20 -0.31 -2.21 116.97 121.98 2wpa h TYR 185 Ca 0.47 -0.23 -0.09 0.00 3.14 0.00 0.00 58.73 62.02 2wpa h TYR 185 Cb 0.49 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2wpa h TYR 185 CO -0.03 0.97 0.05 -0.07 -1.64 0.00 0.00 178.16 177.44 2wpa h LEU 186 N 0.57 1.02 -1.63 2.82 3.38 -0.01 -0.66 115.31 120.81 2wpa h LEU 186 Ca 0.08 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.79 2wpa h LEU 186 Cb 0.75 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2wpa h LEU 186 CO 0.06 1.05 0.30 0.03 0.09 0.00 0.00 178.44 179.97 2wpa h ARG 187 N 0.96 0.48 -0.14 1.13 2.47 -0.87 0.16 114.38 118.56 2wpa h ARG 187 Ca 0.18 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.83 2wpa h ARG 187 Cb 0.50 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2wpa h ARG 187 CO 0.02 0.32 -0.08 0.93 0.56 0.00 0.00 179.97 181.72 2wpa h GLU 188 N 0.49 0.30 0.00 0.04 5.08 -0.74 -3.32 114.58 116.44 2wpa h GLU 188 Ca 0.18 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2wpa h GLU 188 Cb 0.10 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2wpa h GLU 188 CO -0.04 0.65 -0.06 0.52 -1.00 0.00 0.00 179.01 179.07 2wpa h MET 189 N -0.05 0.00 0.00 2.33 2.86 -0.42 -2.91 114.93 116.74 2wpa h MET 189 Ca 0.03 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.56 2wpa h MET 189 Cb 0.56 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 2wpa h MET 189 CO 0.02 0.06 -0.53 1.05 1.06 0.00 0.00 176.91 178.57 2wpa h GLU 190 N 0.00 0.00 0.00 1.72 4.11 -1.08 -1.32 114.58 118.01 2wpa h GLU 190 Ca -0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.33 2wpa h GLU 190 Cb 0.78 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 2wpa h GLU 190 CO 0.01 0.53 -0.48 0.28 0.07 0.00 0.00 179.01 179.41 2wpa h VAL 191 N 0.00 1.09 0.07 -1.06 2.07 -1.61 -3.27 116.25 113.55 2wpa h VAL 191 Ca -0.01 -1.83 -0.31 0.00 0.82 0.00 0.00 66.70 65.37 2wpa h VAL 191 Cb 1.16 2.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.97 2wpa h VAL 191 CO 0.07 0.47 -1.64 0.11 0.02 0.00 0.00 177.57 176.61 2wpa h LYS 192 N 0.00 0.16 -0.51 1.57 1.57 -1.44 -3.32 116.57 114.60 2wpa h LYS 192 Ca -0.00 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2wpa h LYS 192 Cb 1.03 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2wpa h LYS 192 CO 0.06 0.93 0.00 0.00 -0.57 0.00 0.00 179.45 179.87 2wpa s LYS 194 N -1.58 4.35 0.86 0.00 2.20 -1.23 -4.98 119.74 119.36 2wpa s LYS 194 Ca 0.10 1.66 -0.11 0.00 -0.36 0.00 0.00 55.97 57.26 2wpa s LYS 194 Cb 0.06 -3.56 0.11 0.00 -1.51 0.00 0.00 37.83 32.93 2wpa s LYS 194 CO 0.05 -0.45 1.14 -2.14 -0.36 0.00 0.00 175.35 173.59 2wpa s PRO 195 N 2.24 1.45 -0.14 4.03 0.02 -1.26 -4.95 135.00 136.39 2wpa s PRO 195 Ca 0.55 1.46 -0.29 0.00 0.02 0.00 0.00 61.00 62.74 2wpa s PRO 195 Cb -0.24 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 32.46 2wpa s PRO 195 CO 0.21 -2.30 1.48 0.15 -0.33 0.00 0.00 177.00 176.22 2wpa s LYS 196 N -4.66 4.10 0.20 5.54 1.02 -1.26 -4.91 119.74 119.77 2wpa s LYS 196 Ca 0.66 1.83 -0.11 0.00 0.02 0.00 0.00 55.97 58.37 2wpa s LYS 196 Cb -0.22 -3.91 0.24 0.00 -0.52 0.00 0.00 37.83 33.42 2wpa s LYS 196 CO 0.56 -0.91 1.74 0.28 -0.92 0.00 0.00 175.35 176.11 2wpa h VAL 197 N 5.69 0.77 -0.87 3.17 2.07 -1.92 -2.65 116.25 122.51 2wpa h VAL 197 Ca -0.33 -0.12 -0.58 0.00 0.82 0.00 0.00 66.70 66.49 2wpa h VAL 197 Cb 1.14 0.38 -0.31 0.00 -1.52 0.00 0.00 31.29 30.98 2wpa h VAL 197 CO 0.97 0.06 0.29 0.61 0.02 0.00 0.00 177.57 179.53 2wpa n GLY 198 N -1.29 5.81 0.19 2.17 0.00 -1.26 -4.68 105.19 106.13 2wpa n GLY 198 Ca 0.07 -2.19 0.04 0.00 0.00 0.00 0.00 46.02 43.94 2wpa n GLY 198 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2wpa h TYR 199 N 1.86 0.00 -0.48 1.61 -0.00 -1.85 -3.27 116.97 114.84 2wpa h TYR 199 Ca 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 59.19 2wpa h TYR 199 Cb 1.28 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.99 2wpa h TYR 199 CO 1.25 0.36 0.11 1.98 -0.00 0.00 0.00 178.16 181.86 2wpa h MET 200 N 0.00 0.73 0.00 0.10 4.05 -1.85 -2.36 114.93 115.60 2wpa h MET 200 Ca -0.00 -0.14 -0.08 0.00 -0.28 0.00 0.00 59.70 59.20 2wpa h MET 200 Cb 0.68 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 2wpa h MET 200 CO 0.05 0.67 -0.37 1.57 0.23 0.00 0.00 176.91 179.05 2wpa h LYS 201 N 0.71 0.00 0.00 0.39 2.10 -1.91 -2.52 116.57 115.35 2wpa h LYS 201 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 2wpa h LYS 201 Cb 0.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 2wpa h LYS 201 CO -0.00 0.37 0.00 1.63 -2.00 0.00 0.00 179.45 179.45 2wpa n LYS 202 N -3.22 0.02 -2.53 0.07 5.02 -0.92 -4.76 118.16 111.84 2wpa n LYS 202 Ca 0.02 0.05 -0.42 0.00 -2.02 0.00 0.00 58.31 55.95 2wpa n LYS 202 Cb 0.66 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.14 2wpa n LYS 202 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2wpa s GLN 203 N -2.98 4.46 0.33 1.97 -1.52 -0.95 -4.95 119.66 116.03 2wpa s GLN 203 Ca 0.13 1.63 0.10 0.00 -1.95 0.00 0.00 55.36 55.27 2wpa s GLN 203 Cb 0.17 -3.42 0.56 0.00 -0.22 0.00 0.00 33.01 30.10 2wpa s GLN 203 CO 0.47 -0.21 1.74 -1.00 -0.25 0.00 0.00 175.29 176.04 2wpa h PRO 204 N 6.89 0.08 0.00 2.91 0.13 -1.86 -3.40 132.00 136.75 2wpa h PRO 204 Ca -0.40 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2wpa h PRO 204 Cb 1.21 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2wpa h PRO 204 CO 0.80 0.50 -0.73 -3.47 -0.23 0.00 0.00 178.00 174.88 2wpa n ASP 205 N -4.02 3.63 -4.72 1.44 2.03 -1.26 -5.08 116.55 108.58 2wpa n ASP 205 Ca -0.02 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.07 2wpa n ASP 205 Cb 0.47 0.52 -0.06 0.00 -0.72 0.00 0.00 41.12 41.33 2wpa n ASP 205 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2wpa s ILE 206 N -1.61 3.71 0.27 5.18 -4.36 -1.26 -4.71 121.20 118.42 2wpa s ILE 206 Ca 0.00 -1.72 0.03 0.00 -0.26 0.00 0.00 60.65 58.71 2wpa s ILE 206 Cb 0.00 -3.04 -0.06 0.00 1.25 0.00 0.00 42.46 40.61 2wpa s ILE 206 CO 0.00 -0.34 0.03 0.42 0.24 0.00 0.00 174.94 175.29 2wpa s THR 207 N -2.28 1.03 0.40 8.37 -4.23 -1.26 -4.86 115.64 112.81 2wpa s THR 207 Ca 0.33 -2.02 0.15 0.00 -1.18 0.00 0.00 61.69 58.97 2wpa s THR 207 Cb -0.06 -2.55 0.37 0.00 1.34 0.00 0.00 72.50 71.59 2wpa s THR 207 CO 0.22 -0.16 1.85 0.78 -0.54 0.00 0.00 174.62 176.77 2wpa h ASN 208 N 2.33 0.48 -0.24 3.99 -0.26 -2.00 -1.95 115.58 117.93 2wpa h ASN 208 Ca -0.39 0.05 -0.04 0.00 -0.56 0.00 0.00 56.30 55.36 2wpa h ASN 208 Cb 1.23 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 38.45 2wpa h ASN 208 CO 0.66 0.19 -0.00 -1.28 -1.06 0.00 0.00 177.43 175.94 2wpa h SER 209 N 0.48 0.41 -0.80 5.81 0.87 -1.95 -0.33 113.55 118.03 2wpa h SER 209 Ca 0.48 -0.31 0.02 0.00 -1.23 0.00 0.00 61.79 60.75 2wpa h SER 209 Cb 1.09 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.90 2wpa h SER 209 CO -0.20 0.63 0.52 0.24 -0.53 0.00 0.00 176.83 177.48 2wpa h MET 210 N 0.19 1.00 -0.23 2.24 2.86 -1.78 -1.12 114.93 118.10 2wpa h MET 210 Ca 0.07 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2wpa h MET 210 Cb 0.42 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2wpa h MET 210 CO 0.01 0.66 0.14 -0.09 1.06 0.00 0.00 176.91 178.70 2wpa h ARG 211 N 1.03 0.29 -0.99 1.72 2.43 -1.19 -0.95 114.38 116.72 2wpa h ARG 211 Ca 0.31 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.51 2wpa h ARG 211 Cb -0.05 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.37 2wpa h ARG 211 CO -0.09 0.19 0.65 0.00 -1.51 0.00 0.00 179.97 179.20 2wpa h ALA 212 N 1.10 1.39 -0.70 2.80 0.00 -0.54 0.66 119.26 123.97 2wpa h ALA 212 Ca 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2wpa h ALA 212 Cb -0.02 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2wpa h ALA 212 CO -0.03 0.48 0.22 0.82 0.00 0.00 0.00 179.25 180.73 2wpa h ILE 213 N 1.20 1.25 -0.13 0.00 2.04 -0.76 -1.95 117.51 119.17 2wpa h ILE 213 Ca 0.41 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 2wpa h ILE 213 Cb 0.10 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2wpa h ILE 213 CO -0.15 0.34 0.02 0.25 0.00 0.00 0.00 178.15 178.61 2wpa h LEU 214 N 1.03 0.20 0.04 1.44 5.85 0.37 -1.52 115.31 122.72 2wpa h LEU 214 Ca 0.23 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2wpa h LEU 214 Cb 0.29 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2wpa h LEU 214 CO -0.01 0.42 -0.02 0.58 -0.34 0.00 0.00 178.44 179.07 2wpa h VAL 215 N -0.02 1.11 -0.99 1.05 2.07 -0.93 -1.60 116.25 116.94 2wpa h VAL 215 Ca 0.04 -0.49 0.24 0.00 0.82 0.00 0.00 66.70 67.31 2wpa h VAL 215 Cb 0.30 1.44 -0.08 0.00 -1.52 0.00 0.00 31.29 31.43 2wpa h VAL 215 CO 0.00 0.12 0.65 -0.78 0.02 0.00 0.00 177.57 177.59 2wpa h ASP 216 N -0.27 0.41 -0.35 0.57 3.58 -1.37 0.48 116.42 119.46 2wpa h ASP 216 Ca -0.01 0.06 -0.10 0.00 0.42 0.00 0.00 57.03 57.40 2wpa h ASP 216 Cb 0.24 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.27 2wpa h ASP 216 CO 0.01 0.12 -0.14 -0.25 -2.88 0.00 0.00 179.24 176.09 2wpa h TRP 217 N 0.38 0.90 -0.09 0.28 7.01 -0.54 -2.78 115.95 121.12 2wpa h TRP 217 Ca 0.54 -0.18 -0.24 0.00 2.11 0.00 0.00 58.89 61.12 2wpa h TRP 217 Cb 1.40 -0.23 0.01 0.00 -2.10 0.00 0.00 29.16 28.25 2wpa h TRP 217 CO -0.00 0.90 -0.88 -0.07 -2.79 0.00 0.00 178.44 175.60 2wpa h LEU 218 N 0.72 0.87 -0.66 0.65 3.38 0.78 0.31 115.31 121.37 2wpa h LEU 218 Ca 0.11 -0.62 0.14 0.00 0.09 0.00 0.00 57.88 57.60 2wpa h LEU 218 Cb 0.65 -0.26 -0.11 0.00 0.09 0.00 0.00 40.66 41.02 2wpa h LEU 218 CO 0.05 1.42 -0.00 0.58 0.09 0.00 0.00 178.44 180.57 2wpa h VAL 219 N 0.45 0.44 -0.41 1.22 2.07 -1.05 0.29 116.25 119.27 2wpa h VAL 219 Ca -0.08 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 2wpa h VAL 219 Cb 1.51 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 2wpa h VAL 219 CO 0.17 0.02 0.25 -0.08 0.02 0.00 0.00 177.57 177.95 2wpa h GLU 220 N 0.11 0.55 -0.59 1.57 4.81 -1.11 -2.38 114.58 117.55 2wpa h GLU 220 Ca 0.35 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2wpa h GLU 220 Cb 0.58 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 2wpa h GLU 220 CO -0.57 0.41 0.34 0.28 -0.73 0.00 0.00 179.01 178.73 2wpa h VAL 221 N 0.54 1.17 -0.39 0.32 2.07 0.12 -1.99 116.25 118.09 2wpa h VAL 221 Ca 0.15 -0.40 -0.12 0.00 0.82 0.00 0.00 66.70 67.14 2wpa h VAL 221 Cb 0.00 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2wpa h VAL 221 CO -0.03 0.18 -0.24 1.23 0.02 0.00 0.00 177.57 178.74 2wpa h GLY 222 N 0.86 0.86 1.23 2.17 0.00 -0.10 -2.45 103.07 105.64 2wpa h GLY 222 Ca 0.21 -0.75 -0.04 0.00 0.00 0.00 0.00 47.33 46.75 2wpa h GLY 222 CO -0.04 0.68 0.26 0.83 0.00 0.00 0.00 176.54 178.27 2wpa h GLU 223 N 0.69 0.98 -0.63 4.80 4.39 -0.92 0.31 114.58 124.19 2wpa h GLU 223 Ca 0.09 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.56 2wpa h GLU 223 Cb 0.76 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.22 2wpa h GLU 223 CO 0.06 0.81 0.14 1.49 -1.16 0.00 0.00 179.01 180.35 2wpa h GLU 224 N 0.96 1.02 -0.47 2.33 4.57 -1.04 -3.00 114.58 118.95 2wpa h GLU 224 Ca 0.22 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2wpa h GLU 224 Cb 0.20 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 2wpa h GLU 224 CO -0.02 0.93 0.00 0.66 -1.18 0.00 0.00 179.01 179.40 2wpa n TYR 225 N -4.31 0.82 -3.58 0.92 4.02 -0.95 -4.99 117.16 109.10 2wpa n TYR 225 Ca 0.04 -0.57 -0.19 0.00 -0.01 0.00 0.00 57.90 57.16 2wpa n TYR 225 Cb 0.25 -0.10 0.06 0.00 -0.02 0.00 0.00 39.34 39.53 2wpa n TYR 225 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2wpa n LYS 226 N 0.74 -5.55 -3.20 -0.72 5.02 0.88 -4.96 118.16 110.36 2wpa n LYS 226 Ca 0.18 0.72 -0.27 0.00 -2.02 0.00 0.00 58.31 56.92 2wpa n LYS 226 Cb 0.61 -5.47 -0.02 0.00 -0.02 0.00 0.00 35.03 30.14 2wpa n LYS 226 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wpa s LEU 227 N -6.52 3.95 0.81 -0.35 1.43 -0.02 -5.03 118.68 112.95 2wpa s LEU 227 Ca 0.01 0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 53.66 2wpa s LEU 227 Cb -0.00 -3.53 0.08 0.00 0.03 0.00 0.00 46.19 42.77 2wpa s LEU 227 CO 0.78 -0.32 1.15 -1.10 0.23 0.00 0.00 176.35 177.09 2wpa s GLN 228 N -4.09 1.78 0.28 1.70 -1.52 -1.26 -4.82 119.66 111.73 2wpa s GLN 228 Ca 0.43 1.51 0.04 0.00 -1.95 0.00 0.00 55.36 55.39 2wpa s GLN 228 Cb -0.10 -1.82 0.42 0.00 -0.22 0.00 0.00 33.01 31.29 2wpa s GLN 228 CO 0.35 -2.06 1.70 -0.91 -0.25 0.00 0.00 175.29 174.13 2wpa h ASN 229 N -1.08 0.40 -0.85 5.90 2.35 -1.99 -2.99 115.58 117.32 2wpa h ASN 229 Ca -0.45 -0.15 0.01 0.00 -0.55 0.00 0.00 56.30 55.17 2wpa h ASN 229 Cb 1.27 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 39.48 2wpa h ASN 229 CO 0.47 0.71 0.56 -0.08 -1.65 0.00 0.00 177.43 177.44 2wpa h GLU 230 N 0.33 1.10 -0.35 0.81 4.57 -2.00 -2.08 114.58 116.96 2wpa h GLU 230 Ca 0.04 -0.07 0.07 0.00 -1.18 0.00 0.00 59.36 58.22 2wpa h GLU 230 Cb 0.75 -0.25 -0.06 0.00 -0.16 0.00 0.00 28.75 29.02 2wpa h GLU 230 CO 0.06 0.73 -0.07 1.15 -1.18 0.00 0.00 179.01 179.70 2wpa h THR 231 N 1.13 0.67 -0.26 0.32 2.02 -1.85 -0.80 112.91 114.14 2wpa h THR 231 Ca 0.32 -0.01 0.03 0.00 0.77 0.00 0.00 66.41 67.52 2wpa h THR 231 Cb -0.10 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 2wpa h THR 231 CO -0.08 0.00 0.06 0.25 0.37 0.00 0.00 175.52 176.13 2wpa h LEU 232 N 0.02 0.03 -1.14 2.58 5.85 -1.44 -1.23 115.31 119.98 2wpa h LEU 232 Ca 0.17 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2wpa h LEU 232 Cb 0.26 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2wpa h LEU 232 CO -0.35 0.05 0.33 0.45 -0.34 0.00 0.00 178.44 178.58 2wpa h HIS 233 N 0.16 0.92 -0.11 1.25 3.86 -1.02 -2.34 115.15 117.87 2wpa h HIS 233 Ca 0.12 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 2wpa h HIS 233 Cb 0.11 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.29 2wpa h HIS 233 CO -0.15 0.67 0.01 -0.07 0.86 0.00 0.00 177.93 179.24 2wpa h LEU 234 N 0.93 0.19 -1.03 2.43 3.38 -0.64 -1.99 115.31 118.58 2wpa h LEU 234 Ca 0.23 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2wpa h LEU 234 Cb 0.08 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 2wpa h LEU 234 CO -0.03 0.43 0.65 0.00 0.09 0.00 0.00 178.44 179.58 2wpa h ALA 235 N 0.76 1.35 -0.62 1.53 0.00 -1.00 -0.60 119.26 120.67 2wpa h ALA 235 Ca 0.03 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2wpa h ALA 235 Cb 0.33 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2wpa h ALA 235 CO 0.00 0.56 0.14 0.28 0.00 0.00 0.00 179.25 180.23 2wpa h VAL 236 N 1.26 1.25 -0.72 0.00 2.07 -1.35 -0.14 116.25 118.61 2wpa h VAL 236 Ca 0.39 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 2wpa h VAL 236 Cb -0.01 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 2wpa h VAL 236 CO -0.12 0.35 0.31 -1.13 0.02 0.00 0.00 177.57 177.00 2wpa h ASN 237 N 0.94 0.98 -0.57 0.57 -0.73 -0.43 -1.67 115.58 114.66 2wpa h ASN 237 Ca 0.20 -0.16 -0.06 0.00 1.87 0.00 0.00 56.30 58.15 2wpa h ASN 237 Cb 0.35 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.67 2wpa h ASN 237 CO 0.00 0.86 0.13 1.88 -0.37 0.00 0.00 177.43 179.93 2wpa h TYR 238 N 1.03 0.96 0.11 0.67 0.05 -0.74 -2.58 116.97 116.48 2wpa h TYR 238 Ca 0.24 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 58.90 2wpa h TYR 238 Cb 0.17 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 37.64 2wpa h TYR 238 CO 0.01 0.83 -0.05 0.82 -1.05 0.00 0.00 178.16 178.72 2wpa h ILE 239 N 0.82 0.98 -0.40 -2.88 2.04 -0.74 -1.10 117.51 116.23 2wpa h ILE 239 Ca 0.18 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.69 2wpa h ILE 239 Cb 0.36 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2wpa h ILE 239 CO 0.00 0.09 0.26 0.44 0.00 0.00 0.00 178.15 178.95 2wpa h ASP 240 N -0.32 0.43 -0.05 1.72 3.32 -1.28 -0.91 116.42 119.32 2wpa h ASP 240 Ca -0.02 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 56.81 2wpa h ASP 240 Cb 0.26 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.72 2wpa h ASP 240 CO 0.03 0.31 -0.82 0.03 -1.72 0.00 0.00 179.24 177.06 2wpa h ARG 241 N 0.50 0.65 -0.50 3.56 3.08 -1.28 -1.46 114.38 118.93 2wpa h ARG 241 Ca 0.15 -0.63 -0.01 0.00 0.07 0.00 0.00 59.98 59.56 2wpa h ARG 241 Cb -0.00 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2wpa h ARG 241 CO -0.03 1.23 0.26 0.35 -1.07 0.00 0.00 179.97 180.71 2wpa h PHE 242 N 0.30 0.70 0.00 3.04 3.04 -0.70 -2.35 116.94 120.98 2wpa h PHE 242 Ca -0.09 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.84 2wpa h PHE 242 Cb 1.48 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 39.76 2wpa h PHE 242 CO 0.11 0.54 0.00 -0.07 -2.02 0.00 0.00 178.31 176.87 2wpa h LEU 243 N 0.66 0.00 -2.41 0.59 3.38 -1.21 -0.62 115.31 115.71 2wpa h LEU 243 Ca 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2wpa h LEU 243 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2wpa h LEU 243 CO -0.03 0.00 -0.03 0.28 0.09 0.00 0.00 178.44 178.75 2wpa h SER 244 N 0.00 0.00 0.00 -0.43 0.02 -0.69 -3.33 113.55 109.12 2wpa h SER 244 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wpa h SER 244 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 2wpa h SER 244 CO 0.00 0.03 -0.10 -1.54 -1.14 0.00 0.00 176.83 174.08 2wpa n SER 245 N -3.47 0.51 -4.19 3.07 3.41 -0.92 -4.87 113.62 107.16 2wpa n SER 245 Ca -0.02 -0.18 -0.32 0.00 -0.26 0.00 0.00 58.87 58.09 2wpa n SER 245 Cb 0.14 0.46 -0.17 0.00 -0.26 0.00 0.00 64.21 64.38 2wpa n SER 245 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2wpa s MET 246 N -0.56 3.03 0.04 4.33 -1.94 -0.29 -5.09 119.30 118.82 2wpa s MET 246 Ca 0.00 -0.86 -0.30 0.00 -1.71 0.00 0.00 55.69 52.81 2wpa s MET 246 Cb 0.00 -2.39 -0.07 0.00 2.01 0.00 0.00 34.83 34.39 2wpa s MET 246 CO 0.00 0.06 1.47 -1.12 -0.01 0.00 0.00 175.02 175.42 2wpa s SER 247 N 0.64 6.77 -0.03 3.03 0.01 -1.26 -4.54 113.70 118.33 2wpa s SER 247 Ca -0.11 2.26 0.06 0.00 1.31 0.00 0.00 55.95 59.46 2wpa s SER 247 Cb -0.16 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.49 2wpa s SER 247 CO 0.02 -0.76 -0.21 -0.69 0.41 0.00 0.00 173.24 172.01 2wpa s VAL 248 N 2.26 1.71 0.18 3.43 1.01 -1.26 -5.12 120.40 122.61 2wpa s VAL 248 Ca 0.67 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 2wpa s VAL 248 Cb -0.35 -1.43 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 2wpa s VAL 248 CO 0.29 0.48 0.53 -0.76 0.00 0.00 0.00 175.10 175.64 2wpa s LEU 249 N -0.38 4.25 0.09 3.92 1.02 -1.26 -4.49 118.68 121.83 2wpa s LEU 249 Ca 0.05 0.97 -0.17 0.00 0.02 0.00 0.00 54.13 55.00 2wpa s LEU 249 Cb -0.10 -3.45 -0.03 0.00 0.02 0.00 0.00 46.19 42.63 2wpa s LEU 249 CO 0.00 0.02 0.85 0.54 0.02 0.00 0.00 176.35 177.79 2wpa n ARG 250 N 0.33 -0.24 0.00 1.70 1.74 -1.26 -0.51 116.66 118.43 2wpa n ARG 250 Ca -0.03 0.84 0.12 0.00 -0.77 0.00 0.00 57.85 58.01 2wpa n ARG 250 Cb 0.52 -1.23 0.72 0.00 -1.02 0.00 0.00 32.46 31.45 2wpa n ARG 250 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wpa n GLY 251 N -1.15 -0.92 0.00 -0.13 0.00 -1.26 -2.13 105.19 99.61 2wpa n GLY 251 Ca 0.01 -0.15 0.03 0.00 0.00 0.00 0.00 46.02 45.91 2wpa n GLY 251 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wpa n LYS 252 N -0.91 4.70 -0.29 1.61 4.76 0.34 -4.69 118.16 123.67 2wpa n LYS 252 Ca 0.18 -0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.73 2wpa n LYS 252 Cb 0.08 -0.83 0.36 0.00 -1.84 0.00 0.00 35.03 32.80 2wpa n LYS 252 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2wpa h LEU 253 N 0.01 0.70 -0.22 -0.35 5.85 -0.85 -1.03 115.31 119.43 2wpa h LEU 253 Ca 0.00 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2wpa h LEU 253 Cb 0.16 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2wpa h LEU 253 CO 0.00 0.35 -0.17 -0.61 -0.34 0.00 0.00 178.44 177.67 2wpa h GLN 254 N 0.74 0.00 -0.30 1.25 4.15 -1.84 -2.31 115.11 116.80 2wpa h GLN 254 Ca 0.47 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.79 2wpa h GLN 254 Cb 0.72 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 2wpa h GLN 254 CO -0.23 0.17 -0.20 1.25 -1.93 0.00 0.00 178.83 177.89 2wpa h LEU 255 N 0.00 0.70 -0.55 -2.39 5.85 -1.51 0.31 115.31 117.73 2wpa h LEU 255 Ca -0.00 -0.43 0.04 0.00 0.84 0.00 0.00 57.88 58.33 2wpa h LEU 255 Cb 1.05 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 2wpa h LEU 255 CO 0.02 0.99 0.31 0.58 -0.34 0.00 0.00 178.44 179.99 2wpa h VAL 256 N 0.43 0.99 -0.47 1.05 2.07 -1.32 -1.76 116.25 117.24 2wpa h VAL 256 Ca 0.06 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.27 2wpa h VAL 256 Cb 0.75 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2wpa h VAL 256 CO 0.06 0.11 -0.15 1.23 0.02 0.00 0.00 177.57 178.84 2wpa h GLY 257 N 0.59 0.97 1.08 2.17 0.00 -1.23 -0.80 103.07 105.86 2wpa h GLY 257 Ca 0.24 -0.78 -0.11 0.00 0.00 0.00 0.00 47.33 46.67 2wpa h GLY 257 CO -0.14 0.72 -0.11 -0.84 0.00 0.00 0.00 176.54 176.17 2wpa h THR 258 N 0.79 1.27 -0.33 4.70 2.02 -0.72 -2.06 112.91 118.58 2wpa h THR 258 Ca 0.12 -1.26 -0.04 0.00 0.77 0.00 0.00 66.41 66.00 2wpa h THR 258 Cb 0.68 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 2wpa h THR 258 CO 0.05 0.44 0.04 0.00 0.37 0.00 0.00 175.52 176.42 2wpa h ALA 259 N 0.92 0.44 -0.85 6.16 0.00 -1.09 -0.67 119.26 124.16 2wpa h ALA 259 Ca 0.14 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 54.97 2wpa h ALA 259 Cb 0.67 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.25 2wpa h ALA 259 CO 0.05 0.16 0.46 0.00 0.00 0.00 0.00 179.25 179.91 2wpa h ALA 260 N 0.88 1.27 -0.35 0.00 0.00 -1.02 -0.27 119.26 119.78 2wpa h ALA 260 Ca 0.10 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 2wpa h ALA 260 Cb 0.38 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2wpa h ALA 260 CO 0.01 -0.04 -0.29 1.98 0.00 0.00 0.00 179.25 180.91 2wpa h MET 261 N 0.68 0.81 -0.00 0.00 -1.53 -0.92 0.38 114.93 114.34 2wpa h MET 261 Ca 0.45 -0.41 0.02 0.00 -3.44 0.00 0.00 59.70 56.32 2wpa h MET 261 Cb 0.59 0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.62 2wpa h MET 261 CO -0.33 1.04 -0.11 1.25 0.14 0.00 0.00 176.91 178.90 2wpa h LEU 262 N 0.59 -0.31 -0.74 3.39 5.85 -0.40 1.00 115.31 124.69 2wpa h LEU 262 Ca 0.06 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.85 2wpa h LEU 262 Cb 0.87 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.99 2wpa h LEU 262 CO 0.08 -0.15 0.48 -0.07 -0.34 0.00 0.00 178.44 178.43 2wpa h LEU 263 N -0.18 0.81 -0.65 2.25 3.38 -0.99 -1.55 115.31 118.38 2wpa h LEU 263 Ca 0.04 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2wpa h LEU 263 Cb 0.23 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 2wpa h LEU 263 CO -0.11 0.57 0.41 0.00 0.09 0.00 0.00 178.44 179.40 2wpa h ALA 264 N 1.29 0.84 -0.52 1.53 0.00 -0.41 -1.29 119.26 120.70 2wpa h ALA 264 Ca 0.28 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 2wpa h ALA 264 Cb -0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2wpa h ALA 264 CO -0.08 0.19 0.18 0.77 0.00 0.00 0.00 179.25 180.30 2wpa h SER 265 N 0.82 0.74 -0.61 0.00 0.02 -0.42 -1.21 113.55 112.90 2wpa h SER 265 Ca 0.25 -0.20 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 2wpa h SER 265 Cb -0.02 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 2wpa h SER 265 CO -0.09 0.74 0.20 0.11 -1.14 0.00 0.00 176.83 176.66 2wpa h LYS 266 N 0.71 0.98 -0.19 3.45 1.57 -0.88 0.20 116.57 122.40 2wpa h LYS 266 Ca 0.17 -0.19 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 2wpa h LYS 266 Cb 0.25 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2wpa h LYS 266 CO -0.01 0.84 -0.37 0.35 -0.57 0.00 0.00 179.45 179.69 2wpa h PHE 267 N 0.95 0.73 0.00 -1.35 3.57 -1.04 -3.40 116.94 116.40 2wpa h PHE 267 Ca 0.21 -0.26 -0.26 0.00 3.53 0.00 0.00 57.97 61.19 2wpa h PHE 267 Cb 0.27 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.82 2wpa h PHE 267 CO 0.02 1.01 -1.98 -1.91 -2.23 0.00 0.00 178.31 173.22 2wpa n GLU 268 N -4.28 0.71 -2.36 1.11 4.07 -0.47 -5.00 120.64 114.42 2wpa n GLU 268 Ca -0.06 0.08 -0.35 0.00 -0.06 0.00 0.00 57.16 56.77 2wpa n GLU 268 Cb 0.52 -1.35 -0.01 0.00 -0.06 0.00 0.00 31.44 30.54 2wpa n GLU 268 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2wpa s GLU 269 N -2.34 3.52 0.02 5.31 0.41 0.67 -4.96 118.70 121.32 2wpa s GLU 269 Ca -0.20 1.53 -0.23 0.00 -0.41 0.00 0.00 54.97 55.65 2wpa s GLU 269 Cb 0.06 -2.04 -0.17 0.00 -1.78 0.00 0.00 34.13 30.20 2wpa s GLU 269 CO 0.43 -0.70 1.39 0.82 -0.49 0.00 0.00 175.26 176.71 2wpa h ILE 270 N 1.34 1.31 -3.31 -1.63 2.04 -1.93 -3.41 117.51 111.91 2wpa h ILE 270 Ca -0.50 -0.97 -0.59 0.00 1.00 0.00 0.00 64.86 63.80 2wpa h ILE 270 Cb 1.25 1.83 -0.40 0.00 -0.74 0.00 0.00 36.82 38.75 2wpa h ILE 270 CO 0.58 0.27 -0.75 -0.47 0.00 0.00 0.00 178.15 177.77 2wpa s TYR 271 N -4.66 2.07 0.52 1.37 5.04 -1.26 -5.13 117.35 115.30 2wpa s TYR 271 Ca -0.15 -1.87 -0.21 0.00 -2.44 0.00 0.00 57.07 52.41 2wpa s TYR 271 Cb 0.04 -1.83 -0.06 0.00 0.35 0.00 0.00 41.96 40.45 2wpa s TYR 271 CO 0.70 -0.85 1.18 -1.25 -1.34 0.00 0.00 175.55 173.99 2wpa s PRO 272 N 1.50 3.41 0.77 4.97 0.04 -1.26 -5.00 135.00 139.42 2wpa s PRO 272 Ca 0.07 1.78 -0.14 0.00 0.04 0.00 0.00 61.00 62.75 2wpa s PRO 272 Cb -0.18 -2.17 0.06 0.00 0.04 0.00 0.00 34.50 32.25 2wpa s PRO 272 CO -0.19 -0.84 1.22 -2.14 0.04 0.00 0.00 177.00 175.10 2wpa s PRO 273 N -3.03 1.85 0.62 0.56 0.02 -1.26 -4.99 135.00 128.78 2wpa s PRO 273 Ca 0.70 1.82 -0.13 0.00 0.02 0.00 0.00 61.00 63.41 2wpa s PRO 273 Cb -0.29 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.41 2wpa s PRO 273 CO 0.33 -2.07 1.04 -1.21 -0.33 0.00 0.00 177.00 174.76 2wpa s GLU 274 N -3.97 3.39 0.34 5.54 2.02 -1.26 -4.94 118.70 119.82 2wpa s GLU 274 Ca 0.75 0.94 0.04 0.00 0.02 0.00 0.00 54.97 56.73 2wpa s GLU 274 Cb -0.31 -2.05 0.68 0.00 0.10 0.00 0.00 34.13 32.55 2wpa s GLU 274 CO 0.48 -0.74 1.94 0.28 0.02 0.00 0.00 175.26 177.24 2wpa h VAL 275 N -0.08 1.02 -0.72 2.63 2.07 -2.00 -0.72 116.25 118.46 2wpa h VAL 275 Ca -0.45 -0.29 0.10 0.00 0.82 0.00 0.00 66.70 66.89 2wpa h VAL 275 Cb 1.20 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 2wpa h VAL 275 CO 0.59 0.15 0.47 0.00 0.02 0.00 0.00 177.57 178.81 2wpa h ALA 276 N 1.58 1.90 -0.50 1.67 0.00 -1.99 0.15 119.26 122.06 2wpa h ALA 276 Ca 0.35 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 2wpa h ALA 276 Cb 0.27 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2wpa h ALA 276 CO -0.12 -0.06 -0.04 0.93 0.00 0.00 0.00 179.25 179.96 2wpa h GLU 277 N 0.57 0.92 0.00 0.00 4.39 -1.50 -1.53 114.58 117.44 2wpa h GLU 277 Ca 0.33 -0.31 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 2wpa h GLU 277 Cb 0.53 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 2wpa h GLU 277 CO -0.11 0.97 -0.33 0.74 -1.16 0.00 0.00 179.01 179.11 2wpa h PHE 278 N 0.78 0.00 -0.07 4.33 0.04 -0.65 -0.74 116.94 120.63 2wpa h PHE 278 Ca 0.14 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.67 2wpa h PHE 278 Cb 0.58 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.74 2wpa h PHE 278 CO 0.04 0.33 -0.89 0.28 -0.60 0.00 0.00 178.31 177.47 2wpa h VAL 279 N 0.00 1.30 -0.57 -0.55 2.07 -0.94 -3.31 116.25 114.24 2wpa h VAL 279 Ca -0.00 -2.15 -0.08 0.00 0.82 0.00 0.00 66.70 65.29 2wpa h VAL 279 Cb 0.70 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.64 2wpa h VAL 279 CO 0.04 0.67 0.03 0.22 0.02 0.00 0.00 177.57 178.55 2wpa h TYR 280 N 0.42 1.08 0.00 1.57 3.20 -0.60 -2.71 116.97 119.93 2wpa h TYR 280 Ca -0.08 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 61.61 2wpa h TYR 280 Cb 1.52 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.51 2wpa h TYR 280 CO 0.08 0.96 0.00 0.44 -1.64 0.00 0.00 178.16 178.00 2wpa n ILE 281 N -4.26 0.31 0.97 1.81 -5.35 -0.35 -1.72 119.36 110.77 2wpa n ILE 281 Ca 0.02 0.08 0.12 0.00 -0.27 0.00 0.00 62.75 62.70 2wpa n ILE 281 Cb 0.32 -0.77 0.10 0.00 -1.74 0.00 0.00 39.64 37.55 2wpa n ILE 281 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 2wpa n THR 282 N -1.20 0.01 -2.13 7.28 -2.24 -1.03 -4.96 114.28 110.02 2wpa n THR 282 Ca 0.11 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.29 2wpa n THR 282 Cb 0.12 1.48 -0.01 0.00 -2.10 0.00 0.00 70.33 69.83 2wpa n THR 282 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wpa n ASP 283 N 1.32 -3.13 -2.85 3.42 8.00 -0.70 -2.85 116.55 119.75 2wpa n ASP 283 Ca 0.14 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.45 2wpa n ASP 283 Cb 0.59 -2.38 0.00 0.00 -0.02 0.00 0.00 41.12 39.31 2wpa n ASP 283 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2wpa n ASP 284 N 0.32 -4.61 0.19 -2.24 9.92 -1.21 -4.82 116.55 114.10 2wpa n ASP 284 Ca -0.10 -0.12 0.06 0.00 -0.53 0.00 0.00 54.79 54.09 2wpa n ASP 284 Cb 0.57 -3.82 0.33 0.00 -0.64 0.00 0.00 41.12 37.56 2wpa n ASP 284 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2wpa h THR 285 N -0.63 0.84 -3.01 -3.53 2.02 -1.80 -3.45 112.91 103.34 2wpa h THR 285 Ca -0.41 -1.51 -0.42 0.00 0.77 0.00 0.00 66.41 64.83 2wpa h THR 285 Cb 1.29 1.94 -0.14 0.00 -1.74 0.00 0.00 68.15 69.50 2wpa h THR 285 CO 0.48 0.36 -0.71 -0.31 0.37 0.00 0.00 175.52 175.71 2wpa s TYR 286 N -3.57 1.63 0.29 3.16 2.02 -1.26 -5.16 117.35 114.46 2wpa s TYR 286 Ca 0.00 -0.69 0.01 0.00 -0.37 0.00 0.00 57.07 56.02 2wpa s TYR 286 Cb 0.11 -0.84 -0.04 0.00 -0.40 0.00 0.00 41.96 40.79 2wpa s TYR 286 CO 0.68 0.22 0.48 0.95 -1.57 0.00 0.00 175.55 176.31 2wpa s THR 287 N -3.13 5.15 0.31 -0.71 -4.23 -1.26 -4.97 115.64 106.81 2wpa s THR 287 Ca 0.23 -0.53 0.08 0.00 -1.18 0.00 0.00 61.69 60.30 2wpa s THR 287 Cb 0.02 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.33 2wpa s THR 287 CO 0.07 -0.42 1.72 0.50 -0.54 0.00 0.00 174.62 175.94 2wpa h LYS 288 N 1.14 0.52 -0.65 3.99 3.64 -1.95 -1.01 116.57 122.24 2wpa h LYS 288 Ca -0.50 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 58.77 2wpa h LYS 288 Cb 1.21 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 2wpa h LYS 288 CO 0.63 0.34 0.07 -0.22 -2.27 0.00 0.00 179.45 178.01 2wpa h LYS 289 N 0.53 1.09 -0.40 1.90 3.64 -2.00 -1.79 116.57 119.55 2wpa h LYS 289 Ca 0.63 -0.31 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 2wpa h LYS 289 Cb 1.19 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 2wpa h LYS 289 CO -0.49 1.02 -0.06 1.96 -2.27 0.00 0.00 179.45 179.61 2wpa h GLN 290 N 1.01 0.75 -0.68 1.90 4.20 -1.61 -2.02 115.11 118.66 2wpa h GLN 290 Ca 0.19 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 2wpa h GLN 290 Cb 0.48 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 2wpa h GLN 290 CO 0.02 0.87 0.41 0.28 -0.67 0.00 0.00 178.83 179.74 2wpa h VAL 291 N 0.57 1.20 -0.46 -0.54 2.07 -1.08 -1.35 116.25 116.67 2wpa h VAL 291 Ca 0.11 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 67.06 2wpa h VAL 291 Cb 0.57 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2wpa h VAL 291 CO 0.03 0.20 -0.22 -0.07 0.02 0.00 0.00 177.57 177.54 2wpa h LEU 292 N 0.92 0.95 -0.97 2.57 -0.00 -1.23 -1.62 115.31 115.94 2wpa h LEU 292 Ca 0.24 -0.36 -0.08 0.00 -0.00 0.00 0.00 57.88 57.68 2wpa h LEU 292 Cb -0.02 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 40.36 2wpa h LEU 292 CO -0.05 1.13 -0.12 0.03 -0.00 0.00 0.00 178.44 179.44 2wpa h ARG 293 N 0.80 0.62 -0.05 1.13 2.47 -1.13 -2.54 114.38 115.68 2wpa h ARG 293 Ca 0.11 -0.19 -0.14 0.00 -1.26 0.00 0.00 59.98 58.50 2wpa h ARG 293 Cb 0.78 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 29.03 2wpa h ARG 293 CO 0.06 0.72 -0.60 1.98 0.56 0.00 0.00 179.97 182.70 2wpa h MET 294 N 0.57 0.17 -0.40 0.04 4.05 -1.00 -1.98 114.93 116.37 2wpa h MET 294 Ca 0.10 -0.11 0.01 0.00 -0.28 0.00 0.00 59.70 59.42 2wpa h MET 294 Cb 0.53 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.33 2wpa h MET 294 CO 0.03 0.71 0.25 1.49 0.23 0.00 0.00 176.91 179.63 2wpa h GLU 295 N 0.12 0.49 -0.71 0.39 4.81 -1.00 0.19 114.58 118.87 2wpa h GLU 295 Ca -0.01 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 2wpa h GLU 295 Cb 1.09 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.31 2wpa h GLU 295 CO 0.09 0.33 0.44 1.25 -0.73 0.00 0.00 179.01 180.39 2wpa h HIS 296 N 0.51 0.83 0.02 0.92 2.76 -1.19 -1.70 115.15 117.30 2wpa h HIS 296 Ca 0.15 0.02 -0.24 0.00 -2.20 0.00 0.00 60.37 58.11 2wpa h HIS 296 Cb -0.02 -0.27 0.01 0.00 1.55 0.00 0.00 27.41 28.67 2wpa h HIS 296 CO -0.06 0.47 -0.99 1.25 -1.30 0.00 0.00 177.93 177.30 2wpa h LEU 297 N 0.86 0.57 0.07 0.26 5.85 -0.73 0.35 115.31 122.55 2wpa h LEU 297 Ca 0.29 -0.47 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 2wpa h LEU 297 Cb 0.03 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2wpa h LEU 297 CO -0.11 1.28 -0.03 0.58 -0.34 0.00 0.00 178.44 179.81 2wpa h VAL 298 N 0.23 0.96 -0.70 1.05 2.07 -0.61 0.12 116.25 119.37 2wpa h VAL 298 Ca -0.09 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.42 2wpa h VAL 298 Cb 1.64 1.03 -0.07 0.00 -1.52 0.00 0.00 31.29 32.37 2wpa h VAL 298 CO 0.17 0.03 0.34 -0.07 0.02 0.00 0.00 177.57 178.06 2wpa h LEU 299 N -0.14 0.42 -0.41 2.57 3.38 -1.15 0.10 115.31 120.08 2wpa h LEU 299 Ca -0.01 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2wpa h LEU 299 Cb 0.12 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2wpa h LEU 299 CO 0.02 0.24 0.15 0.50 0.09 0.00 0.00 178.44 179.43 2wpa h LYS 300 N 0.57 0.63 0.00 1.13 3.64 -0.68 -0.36 116.57 121.49 2wpa h LYS 300 Ca 0.35 -0.12 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 2wpa h LYS 300 Cb 0.38 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2wpa h LYS 300 CO -0.28 0.60 -0.40 0.28 -2.27 0.00 0.00 179.45 177.39 2wpa h VAL 301 N 0.52 1.21 -0.02 2.00 2.07 -0.07 -2.69 116.25 119.27 2wpa h VAL 301 Ca 0.13 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.26 2wpa h VAL 301 Cb 0.23 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2wpa h VAL 301 CO -0.01 0.39 -0.10 0.18 0.02 0.00 0.00 177.57 178.05 2wpa n LEU 302 N -3.96 1.98 -3.86 2.57 4.77 0.28 -4.96 117.00 113.82 2wpa n LEU 302 Ca -0.02 -0.66 -0.30 0.00 -0.03 0.00 0.00 56.01 55.01 2wpa n LEU 302 Cb 0.44 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.54 2wpa n LEU 302 CO 0.39 0.34 0.12 0.35 -1.33 0.00 0.00 177.39 177.25 2wpa n THR 303 N 0.40 -2.03 -1.32 -5.08 -2.24 -0.25 -1.83 114.28 101.93 2wpa n THR 303 Ca 0.15 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.82 2wpa n THR 303 Cb 0.45 -2.89 -0.05 0.00 -2.10 0.00 0.00 70.33 65.74 2wpa n THR 303 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2wpa n PHE 304 N -4.69 0.00 -2.88 4.78 3.72 -0.60 -4.91 117.46 112.88 2wpa n PHE 304 Ca 0.04 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 57.00 2wpa n PHE 304 Cb 0.53 -2.70 -0.02 0.00 -0.94 0.00 0.00 39.48 36.35 2wpa n PHE 304 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2wpa s ASP 305 N -2.44 6.78 -0.01 4.37 1.01 -0.76 -4.77 116.67 120.84 2wpa s ASP 305 Ca 0.00 -2.33 0.16 0.00 0.71 0.00 0.00 52.55 51.09 2wpa s ASP 305 Cb 0.00 -2.43 -0.21 0.00 1.01 0.00 0.00 42.92 41.30 2wpa s ASP 305 CO 0.00 -1.01 0.57 0.18 0.21 0.00 0.00 175.17 175.13 2wpa n LEU 306 N 6.59 0.49 -3.44 1.23 4.77 -1.26 -4.67 117.00 120.71 2wpa n LEU 306 Ca 0.31 -0.32 -0.40 0.00 -0.03 0.00 0.00 56.01 55.57 2wpa n LEU 306 Cb 0.47 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.54 2wpa n LEU 306 CO 0.58 0.12 2.82 0.00 -1.33 0.00 0.00 177.39 179.58 2wpa n ALA 307 N -1.63 7.03 -1.93 -1.18 0.00 -1.26 -4.96 120.51 116.57 2wpa n ALA 307 Ca 0.01 -3.86 -0.37 0.00 0.00 0.00 0.00 53.44 49.23 2wpa n ALA 307 Cb 0.32 -3.06 -0.06 0.00 0.00 0.00 0.00 19.45 16.64 2wpa n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wpa s ALA 308 N 0.46 3.31 0.19 0.00 0.00 -1.26 -5.04 121.76 119.43 2wpa s ALA 308 Ca 0.60 0.36 -0.31 0.00 0.00 0.00 0.00 51.96 52.60 2wpa s ALA 308 Cb 0.18 -3.01 -0.10 0.00 0.00 0.00 0.00 23.12 20.18 2wpa s ALA 308 CO -0.08 0.25 1.56 -2.14 0.00 0.00 0.00 175.76 175.36 2wpa s PRO 309 N -1.96 4.21 0.33 0.00 0.02 -1.26 -4.99 135.00 131.35 2wpa s PRO 309 Ca 0.46 2.38 0.08 0.00 0.02 0.00 0.00 61.00 63.94 2wpa s PRO 309 Cb -0.18 -3.13 -0.06 0.00 0.02 0.00 0.00 34.50 31.14 2wpa s PRO 309 CO 0.23 -0.59 -0.06 0.95 -0.33 0.00 0.00 177.00 177.20 2wpa s THR 310 N 0.91 1.98 0.25 0.99 -4.23 -1.26 -4.96 115.64 109.32 2wpa s THR 310 Ca 0.68 -2.14 -0.03 0.00 -1.18 0.00 0.00 61.69 59.03 2wpa s THR 310 Cb -0.44 -2.65 0.23 0.00 1.34 0.00 0.00 72.50 70.97 2wpa s THR 310 CO 0.34 -0.19 1.79 0.58 -0.54 0.00 0.00 174.62 176.60 2wpa h VAL 311 N 2.06 0.83 -0.66 2.29 2.07 -1.96 -2.32 116.25 118.56 2wpa h VAL 311 Ca -0.42 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 66.95 2wpa h VAL 311 Cb 1.24 0.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 2wpa h VAL 311 CO 0.71 0.13 0.30 0.78 0.02 0.00 0.00 177.57 179.51 2wpa h ASN 312 N 0.72 0.36 -0.80 0.57 4.21 -1.96 -0.78 115.58 117.89 2wpa h ASN 312 Ca 0.43 0.07 -0.04 0.00 1.21 0.00 0.00 56.30 57.97 2wpa h ASN 312 Cb 0.50 0.01 -0.04 0.00 -1.12 0.00 0.00 38.32 37.68 2wpa h ASN 312 CO -0.30 0.21 0.35 1.56 -1.29 0.00 0.00 177.43 177.96 2wpa h GLN 313 N 0.52 1.18 -0.08 0.81 4.20 -1.82 -0.15 115.11 119.77 2wpa h GLN 313 Ca 0.32 -0.20 -0.18 0.00 0.06 0.00 0.00 58.65 58.66 2wpa h GLN 313 Cb 0.36 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2wpa h GLN 313 CO -0.28 0.94 -0.71 0.74 -0.67 0.00 0.00 178.83 178.85 2wpa h PHE 314 N 1.16 0.50 -0.31 2.96 0.04 -1.29 -2.82 116.94 117.18 2wpa h PHE 314 Ca 0.27 -0.22 -0.00 0.00 2.80 0.00 0.00 57.97 60.82 2wpa h PHE 314 Cb 0.17 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 2wpa h PHE 314 CO 0.02 0.96 0.18 -0.07 -0.60 0.00 0.00 178.31 178.79 2wpa h LEU 315 N 0.26 0.38 -0.81 1.54 3.38 -0.75 -0.90 115.31 118.41 2wpa h LEU 315 Ca -0.03 -0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.01 2wpa h LEU 315 Cb 1.27 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.83 2wpa h LEU 315 CO 0.12 0.35 0.40 0.74 0.09 0.00 0.00 178.44 180.14 2wpa h THR 316 N 0.39 0.73 -0.54 0.22 2.02 -1.00 0.17 112.91 114.90 2wpa h THR 316 Ca 0.11 -0.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.99 2wpa h THR 316 Cb 0.05 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 2wpa h THR 316 CO -0.02 0.11 -0.04 1.56 0.37 0.00 0.00 175.52 177.49 2wpa h GLN 317 N 0.58 0.99 -0.11 6.66 1.08 -1.22 -3.11 115.11 119.98 2wpa h GLN 317 Ca 0.44 -0.34 -0.15 0.00 -1.45 0.00 0.00 58.65 57.15 2wpa h GLN 317 Cb 0.61 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2wpa h GLN 317 CO -0.36 1.01 -0.58 1.88 -0.95 0.00 0.00 178.83 179.84 2wpa h TYR 318 N 0.87 0.45 -0.34 2.96 0.05 0.30 -3.13 116.97 118.13 2wpa h TYR 318 Ca 0.15 -0.17 0.09 0.00 0.05 0.00 0.00 58.73 58.85 2wpa h TYR 318 Cb 0.60 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.24 2wpa h TYR 318 CO 0.04 0.85 0.24 0.74 -1.05 0.00 0.00 178.16 178.98 2wpa h PHE 319 N 0.27 0.05 0.00 4.88 0.04 -0.66 0.45 116.94 121.97 2wpa h PHE 319 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2wpa h PHE 319 Cb 1.09 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.22 2wpa h PHE 319 CO 0.03 0.03 0.00 1.28 -0.60 0.00 0.00 178.31 179.05 2wpa n LEU 320 N -4.45 0.29 -1.85 1.54 4.77 -1.18 -1.68 117.00 114.44 2wpa n LEU 320 Ca 0.05 0.62 -0.09 0.00 -0.03 0.00 0.00 56.01 56.56 2wpa n LEU 320 Cb 0.38 -0.64 0.26 0.00 -2.33 0.00 0.00 43.42 41.08 2wpa n LEU 320 CO 0.35 -0.67 1.03 1.41 -1.33 0.00 0.00 177.39 178.19 2wpa n HIS 321 N -1.88 2.30 -2.86 -1.77 8.25 0.15 -4.97 115.22 114.44 2wpa n HIS 321 Ca -0.00 -1.40 -0.39 0.00 -0.26 0.00 0.00 57.72 55.67 2wpa n HIS 321 Cb 0.05 -0.70 -0.06 0.00 1.12 0.00 0.00 29.99 30.40 2wpa n HIS 321 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2wpa s GLN 322 N -3.10 4.63 -0.51 -0.41 -0.21 -0.67 -4.99 119.66 114.40 2wpa s GLN 322 Ca 0.53 1.28 0.04 0.00 0.02 0.00 0.00 55.36 57.23 2wpa s GLN 322 Cb 0.44 -3.10 0.16 0.00 1.00 0.00 0.00 33.01 31.51 2wpa s GLN 322 CO 0.11 0.45 0.36 -0.65 -2.12 0.00 0.00 175.29 173.44 2wpa s GLN 323 N -1.50 1.45 0.01 2.91 -0.21 -1.26 -4.03 119.66 117.03 2wpa s GLN 323 Ca 0.42 -2.43 -0.00 0.00 0.02 0.00 0.00 55.36 53.37 2wpa s GLN 323 Cb -0.22 -2.23 0.00 0.00 1.00 0.00 0.00 33.01 31.56 2wpa s GLN 323 CO 0.27 -1.30 0.01 -0.35 -2.12 0.00 0.00 175.29 171.80 2wpa n PRO 324 N 2.78 0.08 -1.98 2.91 -0.04 -1.26 -5.07 135.00 132.42 2wpa n PRO 324 Ca 0.21 -0.02 -0.41 0.00 -0.04 0.00 0.00 63.50 63.24 2wpa n PRO 324 Cb 0.40 -0.01 -0.01 0.00 -0.04 0.00 0.00 33.50 33.84 2wpa n PRO 324 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wpa s ALA 325 N -3.82 3.51 -0.16 0.55 0.00 -1.26 -5.01 121.76 115.57 2wpa s ALA 325 Ca 0.01 1.39 -0.02 0.00 0.00 0.00 0.00 51.96 53.34 2wpa s ALA 325 Cb -0.00 -3.54 0.05 0.00 0.00 0.00 0.00 23.12 19.63 2wpa s ALA 325 CO 0.01 -0.83 0.01 1.21 0.00 0.00 0.00 175.76 176.15 2wpa s ASN 326 N -0.36 2.62 0.49 0.00 3.84 -1.26 -5.02 114.94 115.26 2wpa s ASN 326 Ca 0.51 -0.64 0.14 0.00 0.21 0.00 0.00 52.86 53.09 2wpa s ASN 326 Cb -0.43 -0.64 1.15 0.00 -0.55 0.00 0.00 41.25 40.79 2wpa s ASN 326 CO 0.57 -0.26 2.10 0.00 -2.79 0.00 0.00 177.10 176.72 2wpa h LYS 328 N 0.08 0.14 -0.63 0.00 3.64 -1.95 -1.11 116.57 116.73 2wpa h LYS 328 Ca 0.02 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 2wpa h LYS 328 Cb 0.07 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 2wpa h LYS 328 CO 0.00 0.29 0.38 0.28 -2.27 0.00 0.00 179.45 178.14 2wpa h VAL 329 N -0.04 1.05 -0.50 2.00 2.07 -1.59 -0.83 116.25 118.41 2wpa h VAL 329 Ca 0.03 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 2wpa h VAL 329 Cb 0.21 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 2wpa h VAL 329 CO -0.00 0.13 0.25 -0.33 0.02 0.00 0.00 177.57 177.65 2wpa h GLU 330 N 0.74 0.72 -0.60 1.57 5.08 -1.19 -1.42 114.58 119.47 2wpa h GLU 330 Ca 0.26 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 2wpa h GLU 330 Cb 0.06 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2wpa h GLU 330 CO -0.12 0.58 0.23 0.77 -1.00 0.00 0.00 179.01 179.48 2wpa h SER 331 N 0.67 0.83 -0.29 1.42 0.02 -0.82 -1.98 113.55 113.40 2wpa h SER 331 Ca 0.17 -0.17 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 2wpa h SER 331 Cb 0.09 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2wpa h SER 331 CO -0.02 0.78 -0.31 0.25 -1.14 0.00 0.00 176.83 176.38 2wpa h LEU 332 N 0.83 0.85 -0.53 5.07 5.85 -0.91 -1.41 115.31 125.06 2wpa h LEU 332 Ca 0.20 -0.35 -0.07 0.00 0.84 0.00 0.00 57.88 58.50 2wpa h LEU 332 Cb 0.21 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2wpa h LEU 332 CO -0.02 1.09 0.06 0.00 -0.34 0.00 0.00 178.44 179.24 2wpa h ALA 333 N 0.95 0.71 -0.71 1.25 0.00 -1.14 -0.60 119.26 119.71 2wpa h ALA 333 Ca 0.07 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.80 2wpa h ALA 333 Cb 0.86 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 2wpa h ALA 333 CO 0.08 0.47 0.39 0.52 0.00 0.00 0.00 179.25 180.70 2wpa h MET 334 N 0.77 0.67 -0.27 0.00 2.86 -1.18 -0.73 114.93 117.06 2wpa h MET 334 Ca 0.16 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 2wpa h MET 334 Cb 0.44 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2wpa h MET 334 CO 0.02 0.44 0.13 0.35 1.06 0.00 0.00 176.91 178.91 2wpa h PHE 335 N 0.69 0.39 -0.59 -0.22 3.57 -0.63 -0.28 116.94 119.87 2wpa h PHE 335 Ca 0.33 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.73 2wpa h PHE 335 Cb 0.26 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 2wpa h PHE 335 CO -0.08 0.36 0.06 -0.07 -2.23 0.00 0.00 178.31 176.34 2wpa h LEU 336 N 0.31 0.96 -1.26 0.59 3.38 -0.84 -1.70 115.31 116.75 2wpa h LEU 336 Ca 0.09 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2wpa h LEU 336 Cb 0.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2wpa h LEU 336 CO -0.01 1.00 0.01 1.23 0.09 0.00 0.00 178.44 180.76 2wpa h GLY 337 N 0.89 0.55 1.27 0.83 0.00 -0.91 -2.70 103.07 103.00 2wpa h GLY 337 Ca 0.17 -0.32 -0.21 0.00 0.00 0.00 0.00 47.33 46.97 2wpa h GLY 337 CO 0.02 0.30 -0.74 -2.09 0.00 0.00 0.00 176.54 174.03 2wpa h GLU 338 N 0.50 0.73 -0.54 4.80 4.81 -0.56 -2.79 114.58 121.52 2wpa h GLU 338 Ca 0.11 -0.57 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 2wpa h GLU 338 Cb 0.30 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 2wpa h GLU 338 CO 0.01 1.19 0.27 -0.07 -0.73 0.00 0.00 179.01 179.68 2wpa h LEU 339 N 0.51 0.67 -2.19 1.64 3.38 -1.13 -2.36 115.31 115.82 2wpa h LEU 339 Ca -0.04 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2wpa h LEU 339 Cb 1.35 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2wpa h LEU 339 CO 0.15 0.57 -0.04 0.77 0.09 0.00 0.00 178.44 179.98 2wpa h SER 340 N 0.76 0.00 -0.19 -0.43 4.64 -1.19 0.28 113.55 117.41 2wpa h SER 340 Ca 0.19 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.48 2wpa h SER 340 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2wpa h SER 340 CO -0.03 0.04 0.05 -0.07 -0.87 0.00 0.00 176.83 175.95 2wpa h LEU 341 N 0.00 0.35 -0.99 5.97 3.38 -1.46 -3.28 115.31 119.28 2wpa h LEU 341 Ca -0.00 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 2wpa h LEU 341 Cb 0.26 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2wpa h LEU 341 CO 0.00 0.37 -0.40 0.40 0.09 0.00 0.00 178.44 178.90 2wpa h ILE 342 N 0.38 1.30 -3.65 1.22 1.08 -1.07 -3.41 117.51 113.36 2wpa h ILE 342 Ca 0.09 -1.48 -0.67 0.00 -0.39 0.00 0.00 64.86 62.41 2wpa h ILE 342 Cb 0.17 1.68 -0.38 0.00 -3.07 0.00 0.00 36.82 35.23 2wpa h ILE 342 CO -0.00 0.44 -0.68 -1.81 -0.69 0.00 0.00 178.15 175.41 2wpa s ASP 343 N -6.88 4.88 0.30 1.72 1.01 -1.24 -4.06 116.67 112.40 2wpa s ASP 343 Ca -0.04 -2.03 0.00 0.00 0.71 0.00 0.00 52.55 51.19 2wpa s ASP 343 Cb 0.14 -1.68 0.51 0.00 1.01 0.00 0.00 42.92 42.89 2wpa s ASP 343 CO 0.76 -0.40 1.91 0.00 0.21 0.00 0.00 175.17 177.65 2wpa h ALA 344 N 7.76 1.49 -2.96 5.23 0.00 -1.85 -2.91 119.26 126.02 2wpa h ALA 344 Ca -0.08 -0.03 -0.61 0.00 0.00 0.00 0.00 54.91 54.19 2wpa h ALA 344 Cb 1.03 -0.28 -0.13 0.00 0.00 0.00 0.00 17.79 18.41 2wpa h ALA 344 CO 0.56 0.38 -0.35 0.34 0.00 0.00 0.00 179.25 180.19 2wpa s ASP 345 N -6.03 6.27 0.00 0.00 2.15 -1.26 -0.21 116.67 117.59 2wpa s ASP 345 Ca -0.12 0.31 0.23 0.00 0.43 0.00 0.00 52.55 53.41 2wpa s ASP 345 Cb 0.20 -2.17 0.45 0.00 -0.30 0.00 0.00 42.92 41.10 2wpa s ASP 345 CO 0.80 -0.02 1.41 -0.81 -0.17 0.00 0.00 175.17 176.39 2wpa n PRO 346 N 4.43 2.34 0.13 4.34 -0.04 -1.24 -4.97 135.00 140.00 2wpa n PRO 346 Ca -0.12 -2.01 0.13 0.00 -0.04 0.00 0.00 63.50 61.46 2wpa n PRO 346 Cb 0.51 -1.49 0.32 0.00 -0.04 0.00 0.00 33.50 32.80 2wpa n PRO 346 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2wpa h TYR 347 N 4.13 0.00 -0.11 0.54 0.05 -1.15 -3.08 116.97 117.36 2wpa h TYR 347 Ca 0.00 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.81 2wpa h TYR 347 Cb 0.90 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.64 2wpa h TYR 347 CO 0.18 0.00 0.08 1.25 -1.05 0.00 0.00 178.16 178.62 2wpa h LEU 348 N 0.00 0.00 -0.80 3.88 5.85 -0.80 -2.74 115.31 120.71 2wpa h LEU 348 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2wpa h LEU 348 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.84 2wpa h LEU 348 CO 0.00 0.00 0.00 2.29 -0.34 0.00 0.00 178.44 180.39 2wpa n LYS 349 N -4.31 1.53 -4.75 1.25 2.85 -1.16 -4.82 118.16 108.75 2wpa n LYS 349 Ca -0.00 -0.79 -0.33 0.00 -1.05 0.00 0.00 58.31 56.14 2wpa n LYS 349 Cb 0.20 -1.39 -0.12 0.00 -0.65 0.00 0.00 35.03 33.06 2wpa n LYS 349 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2wpa s TYR 350 N -1.88 2.76 0.46 5.58 2.02 -1.03 -5.11 117.35 120.15 2wpa s TYR 350 Ca 0.33 -0.11 -0.22 0.00 -0.37 0.00 0.00 57.07 56.70 2wpa s TYR 350 Cb 0.17 -1.62 -0.08 0.00 -0.40 0.00 0.00 41.96 40.03 2wpa s TYR 350 CO 0.27 0.25 1.07 -0.51 -1.57 0.00 0.00 175.55 175.06 2wpa s LEU 351 N -0.93 3.95 0.26 -1.29 1.43 -1.26 -4.85 118.68 115.99 2wpa s LEU 351 Ca 0.13 2.05 -0.01 0.00 -1.03 0.00 0.00 54.13 55.27 2wpa s LEU 351 Cb -0.11 -4.40 0.56 0.00 0.03 0.00 0.00 46.19 42.27 2wpa s LEU 351 CO 0.02 -0.77 1.74 -0.65 0.23 0.00 0.00 176.35 176.92 2wpa h PRO 352 N 1.88 0.51 -0.23 1.29 0.11 -1.92 0.78 132.00 134.40 2wpa h PRO 352 Ca -0.49 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.64 2wpa h PRO 352 Cb 1.23 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2wpa h PRO 352 CO 0.60 0.34 0.16 0.66 -0.21 0.00 0.00 178.00 179.55 2wpa h SER 353 N 0.52 0.06 0.06 -2.05 4.64 -1.92 0.21 113.55 115.08 2wpa h SER 353 Ca 0.47 -0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.69 2wpa h SER 353 Cb 0.74 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.82 2wpa h SER 353 CO -0.41 0.04 -0.49 0.58 -0.87 0.00 0.00 176.83 175.68 2wpa h VAL 354 N 0.07 1.59 -0.51 0.95 2.07 -1.26 -2.07 116.25 117.09 2wpa h VAL 354 Ca 0.11 -2.42 0.07 0.00 0.82 0.00 0.00 66.70 65.27 2wpa h VAL 354 Cb 0.33 3.21 -0.06 0.00 -1.52 0.00 0.00 31.29 33.26 2wpa h VAL 354 CO -0.01 0.64 0.20 0.40 0.02 0.00 0.00 177.57 178.83 2wpa h ILE 355 N -0.70 0.85 -0.84 4.57 2.04 -1.01 -0.48 117.51 121.94 2wpa h ILE 355 Ca -0.10 -0.13 0.08 0.00 1.00 0.00 0.00 64.86 65.70 2wpa h ILE 355 Cb 1.32 0.42 -0.07 0.00 -0.74 0.00 0.00 36.82 37.76 2wpa h ILE 355 CO 0.05 0.07 0.51 0.00 0.00 0.00 0.00 178.15 178.78 2wpa h ALA 356 N 1.33 1.18 -0.50 1.87 0.00 -0.66 0.16 119.26 122.64 2wpa h ALA 356 Ca 0.24 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2wpa h ALA 356 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2wpa h ALA 356 CO -0.23 0.20 0.20 0.78 0.00 0.00 0.00 179.25 180.20 2wpa h GLY 357 N 0.90 0.80 0.94 0.00 0.00 -0.42 -1.27 103.07 104.02 2wpa h GLY 357 Ca 0.38 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 47.21 2wpa h GLY 357 CO -0.20 0.41 -0.02 0.00 0.00 0.00 0.00 176.54 176.73 2wpa h ALA 358 N 1.05 0.51 -0.60 3.60 0.00 -0.72 -1.94 119.26 121.16 2wpa h ALA 358 Ca 0.17 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2wpa h ALA 358 Cb 0.19 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2wpa h ALA 358 CO -0.01 0.31 0.15 0.00 0.00 0.00 0.00 179.25 179.70 2wpa h ALA 359 N 0.87 1.14 0.05 0.00 0.00 -0.80 -0.59 119.26 119.93 2wpa h ALA 359 Ca 0.11 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wpa h ALA 359 Cb 0.50 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2wpa h ALA 359 CO 0.02 0.58 -0.02 0.35 0.00 0.00 0.00 179.25 180.18 2wpa h PHE 360 N 0.89 -0.06 -0.50 0.00 3.57 -1.12 -1.68 116.94 118.03 2wpa h PHE 360 Ca 0.19 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.70 2wpa h PHE 360 Cb 0.31 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2wpa h PHE 360 CO 0.02 0.23 0.33 1.25 -2.23 0.00 0.00 178.31 177.91 2wpa h HIS 361 N -0.36 0.63 -0.54 0.41 2.76 -1.12 -0.33 115.15 116.61 2wpa h HIS 361 Ca -0.01 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.16 2wpa h HIS 361 Cb 0.32 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.04 2wpa h HIS 361 CO 0.02 0.40 0.25 1.25 -1.30 0.00 0.00 177.93 178.55 2wpa h LEU 362 N 0.68 0.71 -0.38 0.26 5.85 -1.10 0.36 115.31 121.69 2wpa h LEU 362 Ca 0.18 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 2wpa h LEU 362 Cb -0.08 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 2wpa h LEU 362 CO -0.04 0.65 -0.05 0.00 -0.34 0.00 0.00 178.44 178.67 2wpa h ALA 363 N 1.09 0.52 -0.00 1.25 0.00 -1.08 -1.54 119.26 119.49 2wpa h ALA 363 Ca 0.18 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2wpa h ALA 363 Cb 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2wpa h ALA 363 CO -0.02 0.33 -0.12 1.25 0.00 0.00 0.00 179.25 180.69 2wpa h LEU 364 N 0.51 -0.36 -0.89 0.00 5.85 -0.81 -2.01 115.31 117.61 2wpa h LEU 364 Ca 0.10 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 2wpa h LEU 364 Cb 0.54 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2wpa h LEU 364 CO 0.03 -0.18 0.54 0.22 -0.34 0.00 0.00 178.44 178.71 2wpa h TYR 365 N -0.21 1.17 -0.27 1.25 3.20 -0.46 0.16 116.97 121.81 2wpa h TYR 365 Ca 0.05 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 2wpa h TYR 365 Cb 0.27 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2wpa h TYR 365 CO -0.18 0.77 0.00 1.15 -1.64 0.00 0.00 178.16 178.26 2wpa h THR 366 N 1.22 1.25 0.11 1.81 2.02 -1.14 -0.85 112.91 117.33 2wpa h THR 366 Ca 0.32 -0.90 -0.30 0.00 0.77 0.00 0.00 66.41 66.30 2wpa h THR 366 Cb -0.06 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 2wpa h THR 366 CO -0.06 0.29 -1.48 0.58 0.37 0.00 0.00 175.52 175.21 2wpa h VAL 367 N 0.26 1.20 0.00 3.16 2.07 -1.24 -3.41 116.25 118.28 2wpa h VAL 367 Ca 0.08 -2.85 0.00 0.00 0.82 0.00 0.00 66.70 64.75 2wpa h VAL 367 Cb 0.41 2.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2wpa h VAL 367 CO 0.01 0.82 -0.06 0.35 0.02 0.00 0.00 177.57 178.71 2wpa n THR 368 N -3.43 0.00 -0.96 2.57 -2.24 0.02 -5.01 114.28 105.23 2wpa n THR 368 Ca -0.15 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2wpa n THR 368 Cb 1.04 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 70.20 2wpa n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wpa n GLY 369 N 0.71 0.36 3.93 3.38 0.00 -0.32 -4.97 105.19 108.28 2wpa n GLY 369 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2wpa n GLY 369 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wpa s GLN 370 N -0.72 3.15 0.19 1.61 -0.21 -1.25 -4.87 119.66 117.56 2wpa s GLN 370 Ca 0.00 -0.20 0.09 0.00 0.02 0.00 0.00 55.36 55.26 2wpa s GLN 370 Cb 0.00 -2.45 -0.04 0.00 1.00 0.00 0.00 33.01 31.52 2wpa s GLN 370 CO 0.00 -0.35 -0.17 -1.12 -2.12 0.00 0.00 175.29 171.54 2wpa s SER 371 N -4.21 2.73 0.00 5.90 0.01 -1.26 -2.23 113.70 114.65 2wpa s SER 371 Ca 0.49 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2wpa s SER 371 Cb -0.10 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 65.96 2wpa s SER 371 CO 0.41 -0.08 0.00 1.87 0.41 0.00 0.00 173.24 175.85 2wpa n TRP 372 N -0.08 0.00 -2.07 2.43 -0.00 -1.26 -4.81 117.44 111.65 2wpa n TRP 372 Ca -0.10 0.00 -0.34 0.00 -0.00 0.00 0.00 57.50 57.06 2wpa n TRP 372 Cb 0.59 0.00 0.01 0.00 -0.00 0.00 0.00 31.31 31.91 2wpa n TRP 372 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2wpa s PRO 373 N 0.00 3.22 0.42 5.87 0.04 -1.26 -4.92 135.00 138.37 2wpa s PRO 373 Ca 0.00 1.39 0.12 0.00 0.04 0.00 0.00 61.00 62.55 2wpa s PRO 373 Cb 0.00 -2.01 0.91 0.00 0.04 0.00 0.00 34.50 33.45 2wpa s PRO 373 CO 0.00 -0.92 1.97 1.49 0.04 0.00 0.00 177.00 179.58 2wpa h GLU 374 N 0.64 0.13 -0.66 4.56 4.57 -1.99 -1.93 114.58 119.90 2wpa h GLU 374 Ca -0.48 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 57.64 2wpa h GLU 374 Cb 1.24 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.78 2wpa h GLU 374 CO 0.56 0.27 0.29 0.66 -1.18 0.00 0.00 179.01 179.61 2wpa h SER 375 N 0.13 0.87 1.43 1.04 4.64 -1.97 -2.25 113.55 117.44 2wpa h SER 375 Ca 0.03 -0.11 -0.08 0.00 -0.47 0.00 0.00 61.79 61.16 2wpa h SER 375 Cb 0.31 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 2wpa h SER 375 CO 0.02 0.76 -0.39 -0.07 -0.87 0.00 0.00 176.83 176.28 2wpa h LEU 376 N 0.95 0.00 -0.72 5.97 3.38 -1.73 -1.11 115.31 122.04 2wpa h LEU 376 Ca 0.23 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 2wpa h LEU 376 Cb 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2wpa h LEU 376 CO -0.02 0.39 -0.20 0.40 0.09 0.00 0.00 178.44 179.09 2wpa h ILE 377 N 0.00 1.27 -0.25 1.22 2.04 -1.19 -0.22 117.51 120.37 2wpa h ILE 377 Ca -0.00 -1.30 -0.18 0.00 1.00 0.00 0.00 64.86 64.38 2wpa h ILE 377 Cb 1.21 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 38.46 2wpa h ILE 377 CO 0.05 0.43 -0.57 0.03 0.00 0.00 0.00 178.15 178.10 2wpa h ARG 378 N 0.68 0.79 -0.38 2.37 3.08 -1.24 -0.75 114.38 118.92 2wpa h ARG 378 Ca 0.10 -0.51 -0.10 0.00 0.07 0.00 0.00 59.98 59.54 2wpa h ARG 378 Cb 0.70 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 2wpa h ARG 378 CO 0.05 1.14 -0.14 -0.22 -1.07 0.00 0.00 179.97 179.72 2wpa h LYS 379 N 0.60 0.77 0.00 0.04 3.64 -0.99 -3.36 116.57 117.26 2wpa h LYS 379 Ca 0.01 -0.32 -0.13 0.00 -1.27 0.00 0.00 60.65 58.94 2wpa h LYS 379 Cb 1.16 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 2wpa h LYS 379 CO 0.12 0.93 -1.81 0.25 -2.27 0.00 0.00 179.45 176.68 2wpa n THR 380 N -4.31 0.49 -0.29 1.00 -2.24 -0.11 -4.98 114.28 103.84 2wpa n THR 380 Ca -0.02 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2wpa n THR 380 Cb 0.39 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2wpa n THR 380 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wpa n GLY 381 N 1.94 1.98 3.68 3.38 0.00 -0.29 -5.02 105.19 110.86 2wpa n GLY 381 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 2wpa n GLY 381 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wpa s TYR 382 N -3.14 3.42 0.40 1.61 2.02 -1.26 -5.02 117.35 115.39 2wpa s TYR 382 Ca 0.00 1.51 0.04 0.00 -0.37 0.00 0.00 57.07 58.25 2wpa s TYR 382 Cb 0.00 -3.24 -0.00 0.00 -0.40 0.00 0.00 41.96 38.32 2wpa s TYR 382 CO 0.00 -0.45 0.57 0.95 -1.57 0.00 0.00 175.55 175.06 2wpa s THR 383 N 2.29 3.80 0.36 -0.71 -4.23 -1.26 -4.37 115.64 111.53 2wpa s THR 383 Ca 0.49 -0.81 0.03 0.00 -1.18 0.00 0.00 61.69 60.22 2wpa s THR 383 Cb -0.19 -3.35 0.27 0.00 1.34 0.00 0.00 72.50 70.57 2wpa s THR 383 CO 0.16 -0.18 2.02 0.25 -0.54 0.00 0.00 174.62 176.33 2wpa h LEU 384 N 0.63 0.67 -0.03 4.79 5.85 -1.96 -1.46 115.31 123.79 2wpa h LEU 384 Ca -0.45 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.29 2wpa h LEU 384 Cb 1.26 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 2wpa h LEU 384 CO 0.53 0.48 -0.28 -0.08 -0.34 0.00 0.00 178.44 178.76 2wpa h GLU 385 N 0.79 -0.39 0.00 1.25 4.57 -2.00 -1.88 114.58 116.92 2wpa h GLU 385 Ca 0.22 0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.38 2wpa h GLU 385 Cb -0.08 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.59 2wpa h GLU 385 CO -0.05 -0.26 -0.22 0.66 -1.18 0.00 0.00 179.01 177.96 2wpa h SER 386 N -0.40 0.00 1.34 1.04 4.64 -1.73 -1.81 113.55 116.63 2wpa h SER 386 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2wpa h SER 386 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2wpa h SER 386 CO -0.26 0.22 0.00 0.18 -0.87 0.00 0.00 176.83 176.10 2wpa n LEU 387 N -3.98 0.78 -0.04 5.97 4.77 -0.63 -4.39 117.00 119.49 2wpa n LEU 387 Ca -0.02 0.59 -0.09 0.00 -0.03 0.00 0.00 56.01 56.47 2wpa n LEU 387 Cb 0.30 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2wpa n LEU 387 CO 0.35 -0.25 0.70 0.50 -1.33 0.00 0.00 177.39 177.36 2wpa h LYS 388 N 0.00 -0.25 -0.53 3.23 3.64 -0.50 -0.29 116.57 121.87 2wpa h LYS 388 Ca 0.00 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.46 2wpa h LYS 388 Cb 0.67 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.50 2wpa h LYS 388 CO 0.00 -0.16 0.24 -1.35 -2.27 0.00 0.00 179.45 175.90 2wpa h PRO 389 N -0.26 0.44 -0.39 1.90 0.11 -1.79 0.24 132.00 132.26 2wpa h PRO 389 Ca 0.13 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.12 2wpa h PRO 389 Cb 0.45 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.45 2wpa h PRO 389 CO -0.36 0.29 -0.12 0.00 -0.21 0.00 0.00 178.00 177.60 2wpa h LEU 391 N 0.64 -0.44 -0.83 0.00 5.85 0.59 0.28 115.31 121.39 2wpa h LEU 391 Ca 0.11 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.94 2wpa h LEU 391 Cb 0.57 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.65 2wpa h LEU 391 CO 0.04 -0.32 0.47 0.24 -0.34 0.00 0.00 178.44 178.53 2wpa h MET 392 N -0.52 0.77 -0.47 1.25 2.86 -0.56 0.40 114.93 118.66 2wpa h MET 392 Ca -0.05 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.48 2wpa h MET 392 Cb 0.40 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2wpa h MET 392 CO 0.09 0.51 0.06 -0.44 1.06 0.00 0.00 176.91 178.18 2wpa h ASP 393 N 0.79 0.76 -0.02 1.22 3.32 -1.16 -2.31 116.42 119.02 2wpa h ASP 393 Ca 0.40 -0.27 -0.16 0.00 0.02 0.00 0.00 57.03 57.02 2wpa h ASP 393 Cb 0.37 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2wpa h ASP 393 CO -0.25 0.85 -0.52 0.25 -1.72 0.00 0.00 179.24 177.85 2wpa h LEU 394 N 0.65 0.65 -0.22 1.55 5.85 0.51 -2.08 115.31 122.24 2wpa h LEU 394 Ca 0.14 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 2wpa h LEU 394 Cb 0.42 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2wpa h LEU 394 CO 0.01 1.05 0.12 -0.74 -0.34 0.00 0.00 178.44 178.54 2wpa h HIS 395 N 0.46 0.30 -0.59 1.25 2.76 -0.14 -0.46 115.15 118.73 2wpa h HIS 395 Ca 0.02 -0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.27 2wpa h HIS 395 Cb 1.06 -0.10 -0.07 0.00 1.55 0.00 0.00 27.41 29.85 2wpa h HIS 395 CO 0.05 0.27 0.22 1.96 -1.30 0.00 0.00 177.93 179.12 2wpa h GLN 396 N 0.24 0.38 -0.00 5.26 1.08 -1.26 0.75 115.11 121.56 2wpa h GLN 396 Ca 0.08 -0.02 -0.06 0.00 -1.45 0.00 0.00 58.65 57.19 2wpa h GLN 396 Cb 0.07 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 2wpa h GLN 396 CO -0.01 0.25 -0.28 1.15 -0.95 0.00 0.00 178.83 178.99 2wpa h THR 397 N 0.40 1.20 -0.06 -0.54 2.02 -0.79 0.18 112.91 115.32 2wpa h THR 397 Ca 0.30 -0.96 -0.07 0.00 0.77 0.00 0.00 66.41 66.45 2wpa h THR 397 Cb 0.36 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2wpa h THR 397 CO -0.30 0.27 -0.22 0.22 0.37 0.00 0.00 175.52 175.86 2wpa h TYR 398 N 0.01 0.34 0.04 3.16 3.20 -0.16 -2.27 116.97 121.28 2wpa h TYR 398 Ca -0.00 -0.14 0.02 0.00 3.14 0.00 0.00 58.73 61.75 2wpa h TYR 398 Cb 0.50 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 2wpa h TYR 398 CO 0.00 0.84 -0.21 -0.07 -1.64 0.00 0.00 178.16 177.08 2wpa h LEU 399 N -0.25 -0.61 -0.60 2.82 3.38 -0.34 -2.85 115.31 116.86 2wpa h LEU 399 Ca -0.01 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2wpa h LEU 399 Cb 0.86 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2wpa h LEU 399 CO 0.05 -0.28 0.00 0.29 0.09 0.00 0.00 178.44 178.58 2wpa n LYS 400 N -5.34 1.39 -0.22 1.13 5.02 0.59 -4.39 118.16 116.34 2wpa n LYS 400 Ca -0.05 -0.59 0.01 0.00 -2.02 0.00 0.00 58.31 55.66 2wpa n LYS 400 Cb 0.25 -1.26 0.13 0.00 -0.02 0.00 0.00 35.03 34.13 2wpa n LYS 400 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wpa h ALA 401 N 3.61 0.87 0.00 7.82 0.00 -1.16 -2.12 119.26 128.29 2wpa h ALA 401 Ca 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2wpa h ALA 401 Cb 0.24 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2wpa h ALA 401 CO 0.00 -0.18 -0.04 -1.35 0.00 0.00 0.00 179.25 177.68 2wpa h PRO 402 N 0.44 0.00 0.00 0.00 0.11 -1.82 -2.66 132.00 128.07 2wpa h PRO 402 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 2wpa h PRO 402 Cb 0.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.54 2wpa h PRO 402 CO -0.33 0.04 -0.40 1.96 -0.21 0.00 0.00 178.00 179.07 2wpa h GLN 403 N 0.00 0.00 -7.00 1.05 1.08 -1.71 -3.48 115.11 105.04 2wpa h GLN 403 Ca -0.00 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.66 2wpa h GLN 403 Cb 0.63 0.00 0.12 0.00 -0.05 0.00 0.00 27.48 28.18 2wpa h GLN 403 CO 0.01 0.00 0.67 -1.58 -0.95 0.00 0.00 178.83 176.98 2wpa s HIS 404 N -3.21 2.43 0.45 2.96 2.46 -1.01 -4.89 115.29 114.49 2wpa s HIS 404 Ca 0.06 1.30 0.17 0.00 0.47 0.00 0.00 55.06 57.06 2wpa s HIS 404 Cb 0.10 -3.87 1.10 0.00 -0.13 0.00 0.00 32.58 29.78 2wpa s HIS 404 CO 0.70 -2.87 2.02 0.00 -2.47 0.00 0.00 174.74 172.12 2wpa h ALA 405 N 2.11 1.66 -3.14 1.58 0.00 -1.92 -3.40 119.26 116.14 2wpa h ALA 405 Ca -0.51 -0.14 -0.60 0.00 0.00 0.00 0.00 54.91 53.66 2wpa h ALA 405 Cb 1.27 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 2wpa h ALA 405 CO 0.60 0.20 -0.39 -0.65 0.00 0.00 0.00 179.25 179.01 2wpa s GLN 406 N -4.61 4.21 0.00 0.00 1.11 -1.26 -4.98 119.66 114.13 2wpa s GLN 406 Ca -0.04 -0.05 0.00 0.00 0.01 0.00 0.00 55.36 55.28 2wpa s GLN 406 Cb 0.15 -3.44 0.00 0.00 -1.01 0.00 0.00 33.01 28.71 2wpa s GLN 406 CO 0.68 0.22 0.11 1.04 0.01 0.00 0.00 175.29 177.35 2wpa n GLN 407 N 3.70 2.76 -0.16 2.91 1.13 -1.26 -4.81 117.38 121.65 2wpa n GLN 407 Ca -0.13 -0.11 0.11 0.00 -1.94 0.00 0.00 57.00 54.93 2wpa n GLN 407 Cb 0.52 -0.49 0.44 0.00 0.11 0.00 0.00 30.24 30.82 2wpa n GLN 407 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2wpa h SER 408 N 0.00 0.51 -0.01 1.08 0.02 -1.93 -2.24 113.55 110.97 2wpa h SER 408 Ca 0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2wpa h SER 408 Cb 0.06 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 2wpa h SER 408 CO 0.00 0.30 -0.02 0.40 -1.14 0.00 0.00 176.83 176.37 2wpa h ILE 409 N 0.56 1.43 -0.68 3.27 2.04 -1.91 -1.70 117.51 120.52 2wpa h ILE 409 Ca 0.33 -1.28 0.10 0.00 1.00 0.00 0.00 64.86 65.01 2wpa h ILE 409 Cb 0.55 2.27 -0.04 0.00 -0.74 0.00 0.00 36.82 38.85 2wpa h ILE 409 CO -0.11 0.34 0.45 0.03 0.00 0.00 0.00 178.15 178.85 2wpa h ARG 410 N -0.50 0.52 -0.03 2.37 3.08 -1.82 -1.22 114.38 116.78 2wpa h ARG 410 Ca 0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2wpa h ARG 410 Cb 0.56 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 2wpa h ARG 410 CO 0.00 0.34 -0.02 0.93 -1.07 0.00 0.00 179.97 180.15 2wpa h GLU 411 N 0.53 0.07 -0.89 0.04 4.39 -1.33 -2.91 114.58 114.47 2wpa h GLU 411 Ca 0.31 -0.03 0.24 0.00 0.34 0.00 0.00 59.36 60.21 2wpa h GLU 411 Cb 0.51 -0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.02 2wpa h GLU 411 CO -0.10 0.50 0.32 -0.22 -1.16 0.00 0.00 179.01 178.36 2wpa h LYS 412 N -0.37 0.28 -0.60 2.33 3.64 -0.60 -2.65 116.57 118.62 2wpa h LYS 412 Ca 0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2wpa h LYS 412 Cb 0.49 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2wpa h LYS 412 CO 0.01 0.19 0.00 0.66 -2.27 0.00 0.00 179.45 178.03 2wpa n TYR 413 N -5.14 0.80 0.87 1.91 4.02 -0.53 -3.22 117.16 115.87 2wpa n TYR 413 Ca 0.22 -0.40 0.11 0.00 -0.01 0.00 0.00 57.90 57.82 2wpa n TYR 413 Cb 0.70 -0.01 0.03 0.00 -0.02 0.00 0.00 39.34 40.04 2wpa n TYR 413 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 2wpa n LYS 414 N 1.23 0.09 -1.16 -0.72 2.85 -1.00 -2.33 118.16 117.11 2wpa n LYS 414 Ca 0.20 -0.01 -0.35 0.00 -1.05 0.00 0.00 58.31 57.10 2wpa n LYS 414 Cb 0.51 -1.52 0.10 0.00 -0.65 0.00 0.00 35.03 33.47 2wpa n LYS 414 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2wpa n ASN 415 N -1.63 -0.12 0.05 -5.58 2.85 -1.20 -4.03 115.26 105.60 2wpa n ASN 415 Ca 0.04 0.57 -0.03 0.00 -0.11 0.00 0.00 54.58 55.05 2wpa n ASN 415 Cb 0.36 -1.37 0.22 0.00 1.24 0.00 0.00 39.78 40.24 2wpa n ASN 415 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 2wpa h SER 416 N -0.70 0.38 -0.65 1.20 4.64 -1.92 -2.21 113.55 114.29 2wpa h SER 416 Ca -0.46 -0.14 0.19 0.00 -0.47 0.00 0.00 61.79 60.91 2wpa h SER 416 Cb 1.32 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 63.28 2wpa h SER 416 CO 0.44 0.67 0.88 0.50 -0.87 0.00 0.00 176.83 178.44 2wpa h LYS 417 N 0.33 0.00 0.00 4.77 3.64 -1.94 0.20 116.57 123.57 2wpa h LYS 417 Ca 0.04 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2wpa h LYS 417 Cb 0.70 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.51 2wpa h LYS 417 CO 0.05 0.00 -0.16 0.66 -2.27 0.00 0.00 179.45 177.73 2wpa n TYR 418 N -3.30 0.00 -1.97 1.91 4.01 -0.86 -4.97 117.16 111.98 2wpa n TYR 418 Ca 0.14 -1.09 -0.20 0.00 -0.16 0.00 0.00 57.90 56.59 2wpa n TYR 418 Cb 1.09 -0.17 -0.05 0.00 -0.31 0.00 0.00 39.34 39.90 2wpa n TYR 418 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2wpa n HIS 419 N -1.28 -0.53 -2.37 -0.72 8.25 0.70 -2.47 115.22 116.81 2wpa n HIS 419 Ca 0.16 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.46 2wpa n HIS 419 Cb 0.66 -3.60 -0.01 0.00 1.12 0.00 0.00 29.99 28.16 2wpa n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wpa n GLY 420 N -0.67 -0.39 0.16 -1.41 0.00 -1.03 -4.84 105.19 97.01 2wpa n GLY 420 Ca -0.22 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2wpa n GLY 420 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2wpa h VAL 421 N 0.00 0.00 0.00 1.61 -1.51 -1.31 -1.03 116.25 114.00 2wpa h VAL 421 Ca -0.38 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 64.91 2wpa h VAL 421 Cb 1.27 0.88 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 2wpa h VAL 421 CO 0.45 0.00 0.00 -1.54 -1.23 0.00 0.00 177.57 175.25 2wpa n SER 422 N -2.36 0.00 -0.00 4.19 3.41 -0.99 -2.72 113.62 115.16 2wpa n SER 422 Ca 0.01 -1.31 0.03 0.00 -0.26 0.00 0.00 58.87 57.34 2wpa n SER 422 Cb 0.18 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.08 2wpa n SER 422 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wpa n LEU 423 N -0.69 0.09 -4.75 1.04 4.77 -0.39 -4.92 117.00 112.15 2wpa n LEU 423 Ca 0.08 -0.15 -0.40 0.00 -0.03 0.00 0.00 56.01 55.50 2wpa n LEU 423 Cb 0.03 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.14 2wpa n LEU 423 CO 0.06 0.02 1.03 0.18 -1.33 0.00 0.00 177.39 177.35 2wpa n LEU 424 N -1.56 4.74 -4.67 2.23 4.77 -1.10 -4.96 117.00 116.45 2wpa n LEU 424 Ca -0.01 1.14 -0.41 0.00 -0.03 0.00 0.00 56.01 56.70 2wpa n LEU 424 Cb 0.15 -1.58 -0.04 0.00 -2.33 0.00 0.00 43.42 39.62 2wpa n LEU 424 CO 0.14 -0.24 0.55 0.20 -1.33 0.00 0.00 177.39 176.71 2wpa s ASN 425 N -0.42 6.89 0.67 -1.43 -0.87 -1.26 -5.04 114.94 113.47 2wpa s ASN 425 Ca 0.60 1.09 -0.17 0.00 -1.57 0.00 0.00 52.86 52.81 2wpa s ASN 425 Cb -0.47 -2.43 0.00 0.00 -0.02 0.00 0.00 41.25 38.33 2wpa s ASN 425 CO 0.59 -0.36 1.25 -2.16 -2.57 0.00 0.00 177.10 173.85 2wpa s PRO 426 N 2.04 2.47 0.93 -0.60 0.04 -1.26 -4.99 135.00 133.62 2wpa s PRO 426 Ca 0.36 1.93 -0.11 0.00 0.04 0.00 0.00 61.00 63.22 2wpa s PRO 426 Cb -0.16 -1.85 0.09 0.00 0.04 0.00 0.00 34.50 32.62 2wpa s PRO 426 CO 0.12 -1.62 0.81 -2.30 0.04 0.00 0.00 177.00 174.05 2wpa n PRO 427 N -2.13 -0.35 0.05 0.56 -0.02 -1.26 -4.93 135.00 126.91 2wpa n PRO 427 Ca 0.15 -0.05 0.02 0.00 -2.02 0.00 0.00 63.50 61.60 2wpa n PRO 427 Cb 0.49 -2.14 -0.07 0.00 -0.02 0.00 0.00 33.50 31.76 2wpa n PRO 427 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2wpa h GLU 428 N -1.69 0.00 -4.07 -0.52 4.11 -2.02 -3.46 114.58 106.92 2wpa h GLU 428 Ca -0.43 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 58.82 2wpa h GLU 428 Cb 1.28 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.32 2wpa h GLU 428 CO 0.38 0.25 -0.70 0.95 0.07 0.00 0.00 179.01 179.96 2wpa s THR 429 N -2.99 0.17 -0.10 -1.06 -4.23 -1.26 -5.13 115.64 101.03 2wpa s THR 429 Ca -0.02 -1.04 -0.14 0.00 -1.18 0.00 0.00 61.69 59.31 2wpa s THR 429 Cb 0.09 -0.45 -0.05 0.00 1.34 0.00 0.00 72.50 73.43 2wpa s THR 429 CO 0.81 -0.55 0.35 -0.76 -0.54 0.00 0.00 174.62 173.92 2wpa s LEU 430 N -1.65 4.33 -0.94 4.79 1.43 -1.26 -5.03 118.68 120.35 2wpa s LEU 430 Ca -0.13 0.70 -0.17 0.00 -1.03 0.00 0.00 54.13 53.50 2wpa s LEU 430 Cb -0.08 -2.47 0.15 0.00 0.03 0.00 0.00 46.19 43.83 2wpa s LEU 430 CO -0.02 0.18 1.09 0.21 0.23 0.00 0.00 176.35 178.04 2wpa s ASN 431 N -0.11 6.71 0.00 2.29 2.47 -1.26 -5.20 114.94 119.84 2wpa s ASN 431 Ca 0.20 -2.28 0.25 0.00 0.42 0.00 0.00 52.86 51.45 2wpa s ASN 431 Cb -0.14 -2.36 0.32 0.00 -1.45 0.00 0.00 41.25 37.61 2wpa s ASN 431 CO 0.08 -0.93 1.33 0.18 -3.72 0.00 0.00 177.10 174.04