#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pkd n PRO 176 N 0.00 0.00 0.22 5.55 -0.02 -1.26 -0.50 135.00 139.00 1pkd n PRO 176 Ca 0.00 0.09 0.16 0.00 -2.02 0.00 0.00 63.50 61.73 1pkd n PRO 176 Cb 0.00 -1.52 0.69 0.00 -0.02 0.00 0.00 33.50 32.65 1pkd n PRO 176 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1pkd h ASP 177 N 0.00 0.00 0.00 2.55 3.32 -2.08 -3.16 116.42 117.05 1pkd h ASP 177 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1pkd h ASP 177 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1pkd h ASP 177 CO 0.00 0.00 -1.06 -1.22 -1.72 0.00 0.00 179.24 175.24 1pkd n TYR 178 N -2.71 0.00 -0.36 4.55 4.01 0.35 -4.72 117.16 118.28 1pkd n TYR 178 Ca 0.00 0.00 0.26 0.00 -0.16 0.00 0.00 57.90 58.00 1pkd n TYR 178 Cb 0.21 -0.14 0.51 0.00 -0.31 0.00 0.00 39.34 39.62 1pkd n TYR 178 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1pkd h HIS 179 N 0.00 0.79 0.19 -0.72 3.86 -1.59 0.18 115.15 117.86 1pkd h HIS 179 Ca 0.00 0.03 -0.28 0.00 -1.16 0.00 0.00 60.37 58.96 1pkd h HIS 179 Cb 0.41 -0.21 0.03 0.00 1.06 0.00 0.00 27.41 28.69 1pkd h HIS 179 CO 0.00 -0.11 -1.26 1.49 0.86 0.00 0.00 177.93 178.91 1pkd h GLU 180 N 0.31 0.41 -0.81 2.45 4.57 -1.84 -2.46 114.58 117.21 1pkd h GLU 180 Ca 0.71 -0.70 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1pkd h GLU 180 Cb 1.79 0.26 -0.05 0.00 -0.16 0.00 0.00 28.75 30.60 1pkd h GLU 180 CO -0.48 1.34 0.53 -0.44 -1.18 0.00 0.00 179.01 178.77 1pkd h ASP 181 N -0.09 0.88 -0.11 1.04 3.32 -1.48 0.54 116.42 120.52 1pkd h ASP 181 Ca -0.23 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.79 1pkd h ASP 181 Cb 1.93 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 41.28 1pkd h ASP 181 CO 0.20 0.61 -0.02 0.40 -1.72 0.00 0.00 179.24 178.71 1pkd h ILE 182 N 1.04 1.28 -0.44 0.35 2.04 -1.12 -1.09 117.51 119.56 1pkd h ILE 182 Ca 0.32 -0.92 0.09 0.00 1.00 0.00 0.00 64.86 65.35 1pkd h ILE 182 Cb -0.02 1.67 -0.09 0.00 -0.74 0.00 0.00 36.82 37.64 1pkd h ILE 182 CO -0.10 0.26 -0.15 -0.74 0.00 0.00 0.00 178.15 177.42 1pkd h HIS 183 N -0.10 -0.35 -0.23 1.37 2.76 -1.02 -0.43 115.15 117.15 1pkd h HIS 183 Ca 0.03 0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.20 1pkd h HIS 183 Cb 0.42 0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.59 1pkd h HIS 183 CO 0.05 -0.23 -0.06 1.15 -1.30 0.00 0.00 177.93 177.54 1pkd h THR 184 N -0.05 1.18 -0.12 6.26 2.02 -0.83 -2.41 112.91 118.95 1pkd h THR 184 Ca 0.21 -0.74 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 1pkd h THR 184 Cb 0.38 1.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1pkd h THR 184 CO -0.48 0.24 -0.03 0.22 0.37 0.00 0.00 175.52 175.84 1pkd h TYR 185 N 0.35 0.26 -0.06 3.16 3.20 -0.11 -2.83 116.97 120.93 1pkd h TYR 185 Ca 0.07 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.84 1pkd h TYR 185 Cb 0.33 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1pkd h TYR 185 CO 0.01 0.53 -0.18 -0.07 -1.64 0.00 0.00 178.16 176.80 1pkd h LEU 186 N -0.08 0.09 -0.29 2.82 3.38 -0.97 0.69 115.31 120.95 1pkd h LEU 186 Ca 0.03 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1pkd h LEU 186 Cb 0.44 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1pkd h LEU 186 CO 0.01 0.29 -0.07 0.03 0.09 0.00 0.00 178.44 178.78 1pkd h ARG 187 N 0.09 0.57 -0.21 1.13 2.47 -1.42 0.21 114.38 117.22 1pkd h ARG 187 Ca 0.02 -0.22 0.04 0.00 -1.26 0.00 0.00 59.98 58.56 1pkd h ARG 187 Cb 0.39 -0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.64 1pkd h ARG 187 CO 0.03 0.77 -0.04 1.49 0.56 0.00 0.00 179.97 182.78 1pkd h GLU 188 N 0.33 0.02 -0.19 0.04 4.81 -1.19 -3.23 114.58 115.17 1pkd h GLU 188 Ca 0.07 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 1pkd h GLU 188 Cb 0.56 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1pkd h GLU 188 CO 0.03 0.01 -0.31 0.52 -0.73 0.00 0.00 179.01 178.54 1pkd h MET 189 N 0.02 0.38 0.00 1.92 2.86 -0.48 -3.12 114.93 116.50 1pkd h MET 189 Ca 0.10 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1pkd h MET 189 Cb 0.15 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1pkd h MET 189 CO -0.20 0.65 0.00 1.05 1.06 0.00 0.00 176.91 179.46 1pkd h GLU 190 N 0.33 0.00 0.06 1.72 4.11 -0.60 -1.58 114.58 118.63 1pkd h GLU 190 Ca 0.04 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.25 1pkd h GLU 190 Cb 0.71 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.98 1pkd h GLU 190 CO 0.05 0.00 -0.91 0.28 0.07 0.00 0.00 179.01 178.50 1pkd h VAL 191 N 0.00 1.37 0.00 -1.06 2.07 -1.62 -3.29 116.25 113.72 1pkd h VAL 191 Ca 0.00 -2.31 -0.05 0.00 0.82 0.00 0.00 66.70 65.16 1pkd h VAL 191 Cb 0.49 2.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.96 1pkd h VAL 191 CO 0.00 0.68 -0.23 0.11 0.02 0.00 0.00 177.57 178.15 1pkd h LYS 192 N 0.04 0.00 -0.62 1.57 1.57 -1.47 -3.10 116.57 114.56 1pkd h LYS 192 Ca -0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1pkd h LYS 192 Cb 1.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.93 1pkd h LYS 192 CO 0.18 0.23 0.00 0.00 -0.57 0.00 0.00 179.45 179.29 1pkd s LYS 194 N -2.21 4.36 0.81 0.00 2.20 -1.17 -4.96 119.74 118.77 1pkd s LYS 194 Ca 0.53 0.73 -0.11 0.00 -0.36 0.00 0.00 55.97 56.76 1pkd s LYS 194 Cb 0.36 -3.48 0.08 0.00 -1.51 0.00 0.00 37.83 33.29 1pkd s LYS 194 CO 0.21 0.01 1.11 -1.25 -0.36 0.00 0.00 175.35 175.07 1pkd s PRO 195 N 1.04 1.91 0.28 4.03 0.04 -1.26 -4.99 135.00 136.05 1pkd s PRO 195 Ca 0.33 1.31 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 1pkd s PRO 195 Cb -0.17 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 1pkd s PRO 195 CO 0.14 -1.93 1.21 -1.59 0.04 0.00 0.00 177.00 174.88 1pkd s LYS 196 N -4.76 4.49 0.28 4.56 -2.85 -1.26 -4.94 119.74 115.26 1pkd s LYS 196 Ca 0.63 1.99 0.03 0.00 -1.00 0.00 0.00 55.97 57.62 1pkd s LYS 196 Cb -0.19 -3.15 0.40 0.00 -2.06 0.00 0.00 37.83 32.82 1pkd s LYS 196 CO 0.56 -0.01 1.70 0.28 0.10 0.00 0.00 175.35 177.97 1pkd h VAL 197 N 3.21 1.28 -0.00 1.79 2.07 -1.94 -3.11 116.25 119.55 1pkd h VAL 197 Ca -0.47 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 65.69 1pkd h VAL 197 Cb 1.22 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 1pkd h VAL 197 CO 0.68 0.43 -0.06 0.61 0.02 0.00 0.00 177.57 179.24 1pkd n GLY 198 N -0.29 -1.10 0.32 2.17 0.00 -1.26 -4.65 105.19 100.38 1pkd n GLY 198 Ca -0.01 -0.21 0.19 0.00 0.00 0.00 0.00 46.02 45.99 1pkd n GLY 198 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1pkd h TYR 199 N 0.28 0.68 -0.36 1.61 -0.00 -1.92 -0.52 116.97 116.75 1pkd h TYR 199 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 58.73 58.76 1pkd h TYR 199 Cb 0.32 -0.15 -0.02 0.00 0.00 0.00 0.00 36.73 36.88 1pkd h TYR 199 CO 0.00 -0.18 0.18 0.52 -0.00 0.00 0.00 178.16 178.68 1pkd h MET 200 N 0.29 0.49 -0.75 0.10 2.86 -1.88 -0.33 114.93 115.71 1pkd h MET 200 Ca 0.65 -0.05 0.10 0.00 -2.06 0.00 0.00 59.70 58.34 1pkd h MET 200 Cb 1.39 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 32.90 1pkd h MET 200 CO -0.62 0.38 0.49 0.87 1.06 0.00 0.00 176.91 179.09 1pkd h LYS 201 N 0.50 0.61 -0.01 1.72 1.57 -1.44 -2.29 116.57 117.23 1pkd h LYS 201 Ca 0.13 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1pkd h LYS 201 Cb 0.05 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1pkd h LYS 201 CO -0.02 0.41 -0.18 1.63 -0.57 0.00 0.00 179.45 180.72 1pkd n LYS 202 N -4.50 1.10 -3.21 3.15 4.76 -0.15 -4.75 118.16 114.55 1pkd n LYS 202 Ca 0.13 -0.65 -0.43 0.00 -2.87 0.00 0.00 58.31 54.48 1pkd n LYS 202 Cb 0.35 -1.49 -0.07 0.00 -1.84 0.00 0.00 35.03 31.98 1pkd n LYS 202 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1pkd s GLN 203 N -2.35 3.16 0.14 1.97 -1.52 -0.86 -4.97 119.66 115.22 1pkd s GLN 203 Ca 0.28 -0.68 -0.17 0.00 -1.95 0.00 0.00 55.36 52.85 1pkd s GLN 203 Cb 0.20 -4.00 -0.01 0.00 -0.22 0.00 0.00 33.01 28.98 1pkd s GLN 203 CO 0.46 -1.00 1.73 -1.35 -0.25 0.00 0.00 175.29 174.88 1pkd h PRO 204 N 8.85 0.52 0.00 2.91 0.11 -1.85 -3.30 132.00 139.23 1pkd h PRO 204 Ca -0.26 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1pkd h PRO 204 Cb 1.10 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1pkd h PRO 204 CO 0.87 0.44 -1.01 -3.47 -0.21 0.00 0.00 178.00 174.62 1pkd n ASP 205 N -4.74 0.69 -4.42 -2.05 2.03 -1.26 -4.93 116.55 101.85 1pkd n ASP 205 Ca -0.00 0.12 -0.27 0.00 0.52 0.00 0.00 54.79 55.15 1pkd n ASP 205 Cb 0.09 0.60 -0.12 0.00 -0.72 0.00 0.00 41.12 40.97 1pkd n ASP 205 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1pkd s ILE 206 N -3.29 2.38 0.39 5.18 -4.36 -1.25 -4.47 121.20 115.78 1pkd s ILE 206 Ca 0.01 -1.94 0.04 0.00 -0.26 0.00 0.00 60.65 58.51 1pkd s ILE 206 Cb 0.12 -2.12 -0.05 0.00 1.25 0.00 0.00 42.46 41.66 1pkd s ILE 206 CO 0.79 -0.06 0.06 0.42 0.24 0.00 0.00 174.94 176.39 1pkd s THR 207 N -1.51 1.17 0.49 8.37 -4.23 -1.26 -4.74 115.64 113.93 1pkd s THR 207 Ca 0.19 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.90 1pkd s THR 207 Cb -0.09 -2.61 0.26 0.00 1.34 0.00 0.00 72.50 71.40 1pkd s THR 207 CO 0.09 0.00 2.10 0.78 -0.54 0.00 0.00 174.62 177.05 1pkd h ASN 208 N 1.85 0.00 -0.08 3.99 2.35 -1.99 -2.24 115.58 119.46 1pkd h ASN 208 Ca -0.40 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.14 1pkd h ASN 208 Cb 1.26 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.65 1pkd h ASN 208 CO 0.69 0.09 -0.76 -1.28 -1.65 0.00 0.00 177.43 174.52 1pkd h SER 209 N 0.00 0.80 -0.65 5.81 0.87 -1.96 -1.58 113.55 116.84 1pkd h SER 209 Ca -0.00 -0.68 -0.00 0.00 -1.23 0.00 0.00 61.79 59.88 1pkd h SER 209 Cb 0.17 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.86 1pkd h SER 209 CO 0.01 1.36 0.40 0.24 -0.53 0.00 0.00 176.83 178.32 1pkd h MET 210 N 0.30 0.87 -0.98 2.24 2.86 -1.92 -1.24 114.93 117.07 1pkd h MET 210 Ca -0.07 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1pkd h MET 210 Cb 1.41 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 32.84 1pkd h MET 210 CO 0.15 0.61 0.65 -0.09 1.06 0.00 0.00 176.91 179.29 1pkd h ARG 211 N 0.88 1.28 -0.59 1.72 2.43 -1.35 -1.92 114.38 116.82 1pkd h ARG 211 Ca 0.23 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 59.23 1pkd h ARG 211 Cb -0.05 -0.29 -0.02 0.00 -0.42 0.00 0.00 29.97 29.19 1pkd h ARG 211 CO -0.05 0.85 -0.01 0.00 -1.51 0.00 0.00 179.97 179.25 1pkd h ALA 212 N 1.36 0.79 -0.07 2.80 0.00 -0.64 -1.24 119.26 122.26 1pkd h ALA 212 Ca 0.36 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1pkd h ALA 212 Cb -0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 1pkd h ALA 212 CO -0.08 0.64 -0.05 0.82 0.00 0.00 0.00 179.25 180.58 1pkd h ILE 213 N 0.94 0.84 -0.02 0.00 2.04 -1.00 -1.78 117.51 118.53 1pkd h ILE 213 Ca 0.17 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.04 1pkd h ILE 213 Cb 0.56 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1pkd h ILE 213 CO 0.03 0.00 -0.09 0.25 0.00 0.00 0.00 178.15 178.34 1pkd h LEU 214 N -0.06 -0.26 -0.80 1.44 5.85 -1.01 0.61 115.31 121.09 1pkd h LEU 214 Ca 0.05 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1pkd h LEU 214 Cb 0.13 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1pkd h LEU 214 CO -0.11 -0.13 0.52 0.58 -0.34 0.00 0.00 178.44 178.97 1pkd h VAL 215 N -0.14 1.16 -0.54 1.05 2.07 -1.22 -0.84 116.25 117.79 1pkd h VAL 215 Ca 0.04 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1pkd h VAL 215 Cb 0.20 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 1pkd h VAL 215 CO -0.11 0.19 0.29 -0.78 0.02 0.00 0.00 177.57 177.18 1pkd h ASP 216 N 1.03 0.68 -0.57 0.57 1.82 -0.71 -1.40 116.42 117.84 1pkd h ASP 216 Ca 0.31 -0.10 0.01 0.00 -0.39 0.00 0.00 57.03 56.86 1pkd h ASP 216 Cb -0.05 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 39.76 1pkd h ASP 216 CO -0.09 0.58 0.38 -0.25 -1.61 0.00 0.00 179.24 178.25 1pkd h TRP 217 N 0.72 0.72 0.00 0.28 7.01 -0.36 -1.78 115.95 122.55 1pkd h TRP 217 Ca 0.19 0.02 -0.11 0.00 2.11 0.00 0.00 58.89 61.09 1pkd h TRP 217 Cb 0.06 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 26.85 1pkd h TRP 217 CO -0.01 0.46 -0.55 -0.07 -2.79 0.00 0.00 178.44 175.48 1pkd h LEU 218 N 0.78 0.00 -0.37 0.65 3.38 -0.66 -0.63 115.31 118.46 1pkd h LEU 218 Ca 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1pkd h LEU 218 Cb -0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1pkd h LEU 218 CO -0.05 0.55 0.10 0.58 0.09 0.00 0.00 178.44 179.72 1pkd h VAL 219 N 0.00 1.22 -0.35 1.22 2.07 -0.56 0.94 116.25 120.79 1pkd h VAL 219 Ca -0.01 -0.73 0.06 0.00 0.82 0.00 0.00 66.70 66.85 1pkd h VAL 219 Cb 1.00 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.70 1pkd h VAL 219 CO 0.07 0.25 -0.02 -0.33 0.02 0.00 0.00 177.57 177.57 1pkd h GLU 220 N 0.45 0.08 -0.01 1.57 5.08 -0.97 -0.87 114.58 119.90 1pkd h GLU 220 Ca 0.12 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1pkd h GLU 220 Cb 0.28 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1pkd h GLU 220 CO -0.00 0.05 0.01 0.28 -1.00 0.00 0.00 179.01 178.35 1pkd h VAL 221 N 0.08 1.06 -0.91 3.13 2.07 -0.94 0.79 116.25 121.52 1pkd h VAL 221 Ca 0.17 -0.17 0.21 0.00 0.82 0.00 0.00 66.70 67.73 1pkd h VAL 221 Cb 0.24 1.15 -0.12 0.00 -1.52 0.00 0.00 31.29 31.04 1pkd h VAL 221 CO -0.30 0.05 0.45 1.23 0.02 0.00 0.00 177.57 179.02 1pkd h GLY 222 N -0.05 1.58 0.55 2.17 0.00 -0.55 -0.54 103.07 106.23 1pkd h GLY 222 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 1pkd h GLY 222 CO -0.00 -0.20 -0.18 0.83 0.00 0.00 0.00 176.54 176.99 1pkd h GLU 223 N 0.51 -0.49 -1.02 4.80 4.39 -0.61 0.20 114.58 122.35 1pkd h GLU 223 Ca 0.55 0.03 0.25 0.00 0.34 0.00 0.00 59.36 60.54 1pkd h GLU 223 Cb 0.99 0.11 -0.10 0.00 -0.10 0.00 0.00 28.75 29.65 1pkd h GLU 223 CO -0.47 -0.18 0.65 1.49 -1.16 0.00 0.00 179.01 179.33 1pkd h GLU 224 N -0.96 0.45 -0.50 2.33 4.57 -0.51 -1.33 114.58 118.63 1pkd h GLU 224 Ca -0.05 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1pkd h GLU 224 Cb 0.54 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 1pkd h GLU 224 CO 0.09 0.30 0.00 0.66 -1.18 0.00 0.00 179.01 178.87 1pkd n TYR 225 N -4.68 0.66 -3.69 0.92 4.02 -0.24 -4.99 117.16 109.15 1pkd n TYR 225 Ca 0.25 -0.43 -0.24 0.00 -0.01 0.00 0.00 57.90 57.47 1pkd n TYR 225 Cb 0.82 -0.01 0.03 0.00 -0.02 0.00 0.00 39.34 40.16 1pkd n TYR 225 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1pkd n LYS 226 N 1.17 -3.37 -3.49 -0.72 5.02 -0.50 -4.96 118.16 111.30 1pkd n LYS 226 Ca 0.18 0.56 -0.35 0.00 -2.02 0.00 0.00 58.31 56.69 1pkd n LYS 226 Cb 0.53 -4.85 -0.06 0.00 -0.02 0.00 0.00 35.03 30.64 1pkd n LYS 226 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1pkd s LEU 227 N -6.54 4.33 0.48 -0.35 1.43 0.59 -5.04 118.68 113.59 1pkd s LEU 227 Ca 0.18 0.90 -0.22 0.00 -1.03 0.00 0.00 54.13 53.96 1pkd s LEU 227 Cb -0.05 -3.13 -0.09 0.00 0.03 0.00 0.00 46.19 42.95 1pkd s LEU 227 CO 0.83 0.13 0.87 0.00 0.23 0.00 0.00 176.35 178.41 1pkd n GLN 228 N 0.80 1.02 -0.19 1.70 1.13 -1.26 -4.82 117.38 115.76 1pkd n GLN 228 Ca -0.06 0.38 -0.02 0.00 -1.94 0.00 0.00 57.00 55.35 1pkd n GLN 228 Cb 0.52 -1.95 0.19 0.00 0.11 0.00 0.00 30.24 29.11 1pkd n GLN 228 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 1pkd h ASN 229 N 1.02 0.86 -0.52 1.08 2.35 -1.97 -2.24 115.58 116.17 1pkd h ASN 229 Ca -0.45 -0.10 0.04 0.00 -0.55 0.00 0.00 56.30 55.24 1pkd h ASN 229 Cb 1.36 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.48 1pkd h ASN 229 CO 0.53 0.75 0.34 -0.08 -1.65 0.00 0.00 177.43 177.32 1pkd h GLU 230 N 0.95 0.55 -0.63 0.81 4.57 -1.99 -1.92 114.58 116.92 1pkd h GLU 230 Ca 0.23 -0.03 0.04 0.00 -1.18 0.00 0.00 59.36 58.42 1pkd h GLU 230 Cb 0.12 -0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 1pkd h GLU 230 CO -0.03 0.37 0.37 1.15 -1.18 0.00 0.00 179.01 179.69 1pkd h THR 231 N 0.57 1.03 -0.68 0.32 2.02 -1.74 -1.38 112.91 113.05 1pkd h THR 231 Ca 0.21 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1pkd h THR 231 Cb 0.13 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 66.76 1pkd h THR 231 CO -0.06 0.13 0.36 0.25 0.37 0.00 0.00 175.52 176.58 1pkd h LEU 232 N 0.72 0.86 -0.26 2.58 6.46 -1.37 -1.44 115.31 122.86 1pkd h LEU 232 Ca 0.27 -0.11 -0.06 0.00 -0.12 0.00 0.00 57.88 57.86 1pkd h LEU 232 Cb 0.09 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 39.79 1pkd h LEU 232 CO -0.14 0.72 -0.07 0.45 -0.62 0.00 0.00 178.44 178.79 1pkd h HIS 233 N 0.94 0.56 -0.39 1.25 3.86 -1.05 -1.77 115.15 118.55 1pkd h HIS 233 Ca 0.24 -0.12 0.06 0.00 -1.16 0.00 0.00 60.37 59.38 1pkd h HIS 233 Cb 0.06 -0.14 -0.05 0.00 1.06 0.00 0.00 27.41 28.35 1pkd h HIS 233 CO -0.00 0.72 0.10 -0.07 0.86 0.00 0.00 177.93 179.54 1pkd h LEU 234 N 0.25 0.06 -0.50 2.43 3.38 -1.19 -0.87 115.31 118.88 1pkd h LEU 234 Ca 0.07 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1pkd h LEU 234 Cb 0.54 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1pkd h LEU 234 CO 0.03 0.07 0.33 0.00 0.09 0.00 0.00 178.44 178.96 1pkd h ALA 235 N 1.28 0.63 -0.59 1.53 0.00 -0.97 -0.11 119.26 121.03 1pkd h ALA 235 Ca 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1pkd h ALA 235 Cb 0.20 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1pkd h ALA 235 CO -0.22 0.07 0.30 0.28 0.00 0.00 0.00 179.25 179.68 1pkd h VAL 236 N 0.67 1.20 -0.60 0.00 2.07 -1.08 -1.83 116.25 116.69 1pkd h VAL 236 Ca 0.18 -0.55 0.10 0.00 0.82 0.00 0.00 66.70 67.26 1pkd h VAL 236 Cb -0.07 0.48 -0.08 0.00 -1.52 0.00 0.00 31.29 30.10 1pkd h VAL 236 CO -0.04 0.23 0.18 -1.13 0.02 0.00 0.00 177.57 176.82 1pkd h ASN 237 N 0.80 0.12 -0.44 0.57 -0.73 -0.22 -1.73 115.58 113.94 1pkd h ASN 237 Ca 0.20 0.09 -0.06 0.00 1.87 0.00 0.00 56.30 58.41 1pkd h ASN 237 Cb 0.09 0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.76 1pkd h ASN 237 CO -0.03 0.07 0.05 1.88 -0.37 0.00 0.00 177.43 179.03 1pkd h TYR 238 N 0.33 0.81 0.14 0.67 0.05 -0.72 -1.94 116.97 116.31 1pkd h TYR 238 Ca 0.31 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.97 1pkd h TYR 238 Cb 0.42 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 1pkd h TYR 238 CO -0.20 0.78 -0.13 0.82 -1.05 0.00 0.00 178.16 178.37 1pkd h ILE 239 N 0.61 0.71 -0.91 -2.88 2.04 -1.09 0.10 117.51 116.08 1pkd h ILE 239 Ca 0.13 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.03 1pkd h ILE 239 Cb 0.42 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 1pkd h ILE 239 CO 0.01 0.00 0.58 0.44 0.00 0.00 0.00 178.15 179.19 1pkd h ASP 240 N -0.29 0.96 -0.25 1.72 3.32 -1.26 0.83 116.42 121.45 1pkd h ASP 240 Ca 0.00 -0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1pkd h ASP 240 Cb 0.27 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1pkd h ASP 240 CO -0.03 0.64 -0.49 0.03 -1.72 0.00 0.00 179.24 177.67 1pkd h ARG 241 N 1.11 0.82 -0.29 3.56 3.08 -1.15 -2.04 114.38 119.48 1pkd h ARG 241 Ca 0.37 -0.48 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1pkd h ARG 241 Cb 0.06 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1pkd h ARG 241 CO -0.14 1.12 0.16 0.35 -1.07 0.00 0.00 179.97 180.39 1pkd h PHE 242 N 0.65 0.41 0.00 3.04 3.57 -0.15 -2.37 116.94 122.09 1pkd h PHE 242 Ca 0.03 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1pkd h PHE 242 Cb 1.07 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.69 1pkd h PHE 242 CO 0.06 0.34 0.00 1.28 -2.23 0.00 0.00 178.31 177.76 1pkd n LEU 243 N -4.81 0.43 0.19 0.59 4.77 0.23 -0.94 117.00 117.46 1pkd n LEU 243 Ca -0.02 0.59 0.13 0.00 -0.03 0.00 0.00 56.01 56.68 1pkd n LEU 243 Cb 0.08 -0.50 0.34 0.00 -2.33 0.00 0.00 43.42 41.01 1pkd n LEU 243 CO 0.35 -0.34 0.86 0.28 -1.33 0.00 0.00 177.39 177.21 1pkd h SER 244 N 0.00 0.00 0.00 -1.43 0.02 -0.83 -3.37 113.55 107.95 1pkd h SER 244 Ca 0.00 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.79 1pkd h SER 244 Cb 0.41 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1pkd h SER 244 CO 0.00 0.00 -1.60 -1.20 -1.14 0.00 0.00 176.83 172.89 1pkd n SER 245 N -2.82 2.82 -4.15 3.07 7.64 -0.78 -4.93 113.62 114.47 1pkd n SER 245 Ca 0.04 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.64 1pkd n SER 245 Cb 0.45 0.74 -0.16 0.00 -1.01 0.00 0.00 64.21 64.22 1pkd n SER 245 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1pkd s MET 246 N -2.22 2.06 0.19 1.43 -1.94 -0.12 -5.10 119.30 113.60 1pkd s MET 246 Ca -0.04 -0.67 -0.30 0.00 -1.71 0.00 0.00 55.69 52.97 1pkd s MET 246 Cb 0.03 -1.73 -0.08 0.00 2.01 0.00 0.00 34.83 35.06 1pkd s MET 246 CO 0.36 0.23 1.05 -1.54 -0.01 0.00 0.00 175.02 175.11 1pkd s SER 247 N 0.13 7.36 -0.02 3.03 1.04 -1.26 -4.44 113.70 119.54 1pkd s SER 247 Ca -0.07 2.05 0.02 0.00 0.48 0.00 0.00 55.95 58.42 1pkd s SER 247 Cb -0.13 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.39 1pkd s SER 247 CO 0.04 -0.12 -0.06 -0.69 0.98 0.00 0.00 173.24 173.38 1pkd s VAL 248 N -0.50 0.52 0.56 5.02 1.01 -1.26 -5.13 120.40 120.62 1pkd s VAL 248 Ca 0.47 -0.21 -0.18 0.00 0.00 0.00 0.00 61.98 62.06 1pkd s VAL 248 Cb -0.28 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 1pkd s VAL 248 CO 0.35 0.18 1.08 -0.76 0.00 0.00 0.00 175.10 175.95 1pkd s LEU 249 N 0.29 3.64 0.21 3.92 1.43 -1.26 -4.48 118.68 122.43 1pkd s LEU 249 Ca -0.03 1.98 -0.19 0.00 -1.03 0.00 0.00 54.13 54.86 1pkd s LEU 249 Cb -0.08 -4.56 0.20 0.00 0.03 0.00 0.00 46.19 41.78 1pkd s LEU 249 CO -0.00 -1.17 1.57 -0.09 0.23 0.00 0.00 176.35 176.89 1pkd h ARG 250 N 0.86 -0.07 0.00 1.70 2.43 -2.01 -1.38 114.38 115.91 1pkd h ARG 250 Ca -0.48 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1pkd h ARG 250 Cb 1.24 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1pkd h ARG 250 CO 0.57 -0.05 0.00 0.41 -1.51 0.00 0.00 179.97 179.39 1pkd n GLY 251 N -1.46 -0.94 0.33 2.80 0.00 -1.26 -2.29 105.19 102.37 1pkd n GLY 251 Ca 0.08 0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.18 1pkd n GLY 251 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pkd n LYS 252 N -1.73 1.78 -0.21 1.61 4.76 -0.54 -4.58 118.16 119.24 1pkd n LYS 252 Ca 0.02 -0.76 -0.04 0.00 -2.87 0.00 0.00 58.31 54.66 1pkd n LYS 252 Cb 0.13 -1.22 0.07 0.00 -1.84 0.00 0.00 35.03 32.17 1pkd n LYS 252 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1pkd h LEU 253 N 1.62 0.58 -1.32 -0.35 5.85 -1.18 -1.79 115.31 118.71 1pkd h LEU 253 Ca 0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1pkd h LEU 253 Cb 0.49 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1pkd h LEU 253 CO 0.00 0.40 -0.30 -0.61 -0.34 0.00 0.00 178.44 177.59 1pkd h GLN 254 N 0.71 0.06 -0.60 1.25 4.15 -1.81 -2.31 115.11 116.56 1pkd h GLN 254 Ca 0.25 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.60 1pkd h GLN 254 Cb 0.06 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 1pkd h GLN 254 CO -0.12 0.36 0.17 1.25 -1.93 0.00 0.00 178.83 178.56 1pkd h LEU 255 N 0.05 0.88 -0.34 -2.39 5.85 -1.62 -0.17 115.31 117.56 1pkd h LEU 255 Ca 0.01 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1pkd h LEU 255 Cb 0.56 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1pkd h LEU 255 CO 0.04 0.87 0.18 0.58 -0.34 0.00 0.00 178.44 179.76 1pkd h VAL 256 N 0.85 1.15 -0.65 1.05 2.07 -1.05 -2.14 116.25 117.54 1pkd h VAL 256 Ca 0.19 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1pkd h VAL 256 Cb 0.31 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1pkd h VAL 256 CO -0.00 0.16 0.36 1.23 0.02 0.00 0.00 177.57 179.34 1pkd h GLY 257 N 0.43 0.97 0.92 2.17 0.00 -1.20 -0.63 103.07 105.72 1pkd h GLY 257 Ca 0.12 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 1pkd h GLY 257 CO -0.02 0.41 0.00 -0.84 0.00 0.00 0.00 176.54 176.10 1pkd h THR 258 N 0.89 1.06 -0.45 4.70 2.02 -0.97 -0.84 112.91 119.32 1pkd h THR 258 Ca 0.23 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 1pkd h THR 258 Cb 0.03 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1pkd h THR 258 CO -0.04 0.05 0.21 0.00 0.37 0.00 0.00 175.52 176.10 1pkd h ALA 259 N 0.93 1.52 -0.47 6.16 0.00 -1.33 -0.37 119.26 125.70 1pkd h ALA 259 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1pkd h ALA 259 Cb 0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1pkd h ALA 259 CO -0.00 0.38 0.13 0.00 0.00 0.00 0.00 179.25 179.76 1pkd h ALA 260 N 1.60 0.62 -0.26 0.00 0.00 -0.82 -0.92 119.26 119.48 1pkd h ALA 260 Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1pkd h ALA 260 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1pkd h ALA 260 CO -0.02 0.29 0.08 1.98 0.00 0.00 0.00 179.25 181.58 1pkd h MET 261 N 0.63 0.40 -0.18 0.00 -1.53 -0.83 0.80 114.93 114.21 1pkd h MET 261 Ca 0.15 -0.08 0.05 0.00 -3.44 0.00 0.00 59.70 56.38 1pkd h MET 261 Cb 0.30 -0.06 -0.06 0.00 -0.55 0.00 0.00 31.60 31.23 1pkd h MET 261 CO -0.00 0.47 -0.26 1.25 0.14 0.00 0.00 176.91 178.51 1pkd h LEU 262 N 0.25 -0.81 -0.63 3.39 5.85 -0.95 0.16 115.31 122.58 1pkd h LEU 262 Ca 0.08 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1pkd h LEU 262 Cb 0.23 0.36 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1pkd h LEU 262 CO -0.00 -0.30 0.37 -0.07 -0.34 0.00 0.00 178.44 178.10 1pkd h LEU 263 N -0.29 0.77 -0.69 2.25 3.38 -1.01 -0.71 115.31 119.00 1pkd h LEU 263 Ca 0.12 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1pkd h LEU 263 Cb 0.47 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1pkd h LEU 263 CO -0.35 0.61 0.42 0.00 0.09 0.00 0.00 178.44 179.21 1pkd h ALA 264 N 1.19 0.89 -0.26 1.53 0.00 -0.49 -0.90 119.26 121.21 1pkd h ALA 264 Ca 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1pkd h ALA 264 Cb -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1pkd h ALA 264 CO -0.04 0.36 0.13 0.77 0.00 0.00 0.00 179.25 180.46 1pkd h SER 265 N 0.95 0.33 -0.53 0.00 0.02 -0.34 -0.70 113.55 113.28 1pkd h SER 265 Ca 0.25 -0.12 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1pkd h SER 265 Cb -0.03 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1pkd h SER 265 CO -0.05 0.35 0.35 0.11 -1.14 0.00 0.00 176.83 176.46 1pkd h LYS 266 N 0.28 0.65 -0.01 3.45 1.57 -0.92 -0.77 116.57 120.82 1pkd h LYS 266 Ca 0.09 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1pkd h LYS 266 Cb 0.11 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1pkd h LYS 266 CO -0.01 0.43 -0.04 0.35 -0.57 0.00 0.00 179.45 179.61 1pkd h PHE 267 N 0.67 0.06 0.04 -1.35 3.57 -0.73 -3.41 116.94 115.79 1pkd h PHE 267 Ca 0.21 -0.02 -0.38 0.00 3.53 0.00 0.00 57.97 61.30 1pkd h PHE 267 Cb 0.01 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 1pkd h PHE 267 CO -0.00 0.67 -2.28 -1.91 -2.23 0.00 0.00 178.31 172.57 1pkd n GLU 268 N -4.74 0.68 -2.89 1.11 4.07 -0.31 -4.98 120.64 113.58 1pkd n GLU 268 Ca -0.09 0.21 -0.37 0.00 -0.06 0.00 0.00 57.16 56.85 1pkd n GLU 268 Cb 0.34 -1.59 -0.06 0.00 -0.06 0.00 0.00 31.44 30.06 1pkd n GLU 268 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1pkd s GLU 269 N -2.53 4.51 0.05 5.31 0.41 -0.31 -4.99 118.70 121.16 1pkd s GLU 269 Ca -0.31 1.19 -0.26 0.00 -0.41 0.00 0.00 54.97 55.19 1pkd s GLU 269 Cb 0.08 -2.92 -0.17 0.00 -1.78 0.00 0.00 34.13 29.35 1pkd s GLU 269 CO 0.65 0.37 1.56 0.82 -0.49 0.00 0.00 175.26 178.17 1pkd h ILE 270 N 2.78 0.89 -3.18 -1.63 2.04 -1.94 -3.38 117.51 113.09 1pkd h ILE 270 Ca -0.47 -0.28 -0.63 0.00 1.00 0.00 0.00 64.86 64.48 1pkd h ILE 270 Cb 1.19 1.06 -0.41 0.00 -0.74 0.00 0.00 36.82 37.92 1pkd h ILE 270 CO 0.65 0.07 -0.62 -0.31 0.00 0.00 0.00 178.15 177.94 1pkd s TYR 271 N -5.60 3.26 0.63 1.37 2.02 -1.26 -5.11 117.35 112.66 1pkd s TYR 271 Ca -0.15 -3.20 -0.18 0.00 -0.37 0.00 0.00 57.07 53.18 1pkd s TYR 271 Cb 0.04 -2.65 -0.02 0.00 -0.40 0.00 0.00 41.96 38.93 1pkd s TYR 271 CO 0.64 -0.64 1.21 -1.25 -1.57 0.00 0.00 175.55 173.93 1pkd s PRO 272 N -0.85 2.75 0.60 -1.71 0.04 -1.26 -4.97 135.00 129.60 1pkd s PRO 272 Ca 0.22 1.79 -0.19 0.00 0.04 0.00 0.00 61.00 62.85 1pkd s PRO 272 Cb -0.14 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 1pkd s PRO 272 CO -0.09 -1.37 1.27 -2.14 0.04 0.00 0.00 177.00 174.71 1pkd s PRO 273 N -3.52 2.87 0.89 0.56 0.02 -1.26 -5.01 135.00 129.54 1pkd s PRO 273 Ca 0.76 2.01 -0.12 0.00 0.02 0.00 0.00 61.00 63.68 1pkd s PRO 273 Cb -0.30 -1.98 0.12 0.00 0.02 0.00 0.00 34.50 32.36 1pkd s PRO 273 CO 0.37 -1.34 1.10 -1.83 -0.33 0.00 0.00 177.00 174.97 1pkd s GLU 274 N -3.23 1.35 0.27 5.54 -1.05 -1.26 -4.91 118.70 115.41 1pkd s GLU 274 Ca 0.78 0.61 -0.02 0.00 -0.15 0.00 0.00 54.97 56.19 1pkd s GLU 274 Cb -0.35 -1.84 0.43 0.00 -0.44 0.00 0.00 34.13 31.93 1pkd s GLU 274 CO 0.39 -2.12 1.88 0.28 0.95 0.00 0.00 175.26 176.64 1pkd h VAL 275 N -1.45 1.07 -0.95 1.83 2.07 -1.99 -1.31 116.25 115.52 1pkd h VAL 275 Ca -0.50 -0.40 0.06 0.00 0.82 0.00 0.00 66.70 66.68 1pkd h VAL 275 Cb 1.30 -0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 1pkd h VAL 275 CO 0.58 0.21 0.61 0.00 0.02 0.00 0.00 177.57 178.99 1pkd h ALA 276 N 1.47 1.30 -0.87 1.67 0.00 -1.99 0.27 119.26 121.12 1pkd h ALA 276 Ca 0.44 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.39 1pkd h ALA 276 Cb 0.20 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1pkd h ALA 276 CO -0.18 0.41 0.54 0.93 0.00 0.00 0.00 179.25 180.95 1pkd h GLU 277 N 1.12 0.96 -0.44 0.00 5.08 -1.61 -0.74 114.58 118.95 1pkd h GLU 277 Ca 0.40 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.56 1pkd h GLU 277 Cb 0.13 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1pkd h GLU 277 CO -0.16 0.63 -0.29 0.74 -1.00 0.00 0.00 179.01 178.94 1pkd h PHE 278 N 0.99 1.14 -0.20 4.33 0.04 -0.66 -2.79 116.94 119.79 1pkd h PHE 278 Ca 0.38 -0.30 -0.05 0.00 2.80 0.00 0.00 57.97 60.79 1pkd h PHE 278 Cb 0.16 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 1pkd h PHE 278 CO -0.03 1.14 -0.08 0.28 -0.60 0.00 0.00 178.31 179.01 1pkd h VAL 279 N 0.82 1.18 0.47 -0.55 2.07 -0.26 -3.18 116.25 116.79 1pkd h VAL 279 Ca 0.09 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1pkd h VAL 279 Cb 0.88 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1pkd h VAL 279 CO 0.08 0.24 -0.23 0.22 0.02 0.00 0.00 177.57 177.90 1pkd h TYR 280 N 0.30 -0.58 0.00 1.57 3.20 -0.93 -3.16 116.97 117.37 1pkd h TYR 280 Ca 0.06 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1pkd h TYR 280 Cb 0.34 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1pkd h TYR 280 CO 0.01 -0.28 0.00 0.44 -1.64 0.00 0.00 178.16 176.68 1pkd n ILE 281 N -5.29 1.06 -0.72 1.81 -6.64 -1.07 -2.54 119.36 105.97 1pkd n ILE 281 Ca -0.11 0.26 0.02 0.00 -1.77 0.00 0.00 62.75 61.16 1pkd n ILE 281 Cb 0.30 -1.22 0.33 0.00 -1.44 0.00 0.00 39.64 37.62 1pkd n ILE 281 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 1pkd n THR 282 N -1.29 2.52 -1.21 7.28 -2.24 -1.19 -4.91 114.28 113.24 1pkd n THR 282 Ca 0.01 -1.30 -0.07 0.00 -2.27 0.00 0.00 64.05 60.42 1pkd n THR 282 Cb 0.02 -0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 67.89 1pkd n THR 282 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1pkd n ASP 283 N 0.35 -5.46 -2.55 3.42 -0.08 -1.05 -1.79 116.55 109.39 1pkd n ASP 283 Ca 0.28 0.18 -0.20 0.00 -1.51 0.00 0.00 54.79 53.54 1pkd n ASP 283 Cb 1.16 -3.59 -0.00 0.00 2.34 0.00 0.00 41.12 41.02 1pkd n ASP 283 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1pkd n ASP 284 N -0.91 -5.65 -0.23 1.67 8.00 -1.25 -4.89 116.55 113.29 1pkd n ASP 284 Ca -0.07 -0.05 -0.00 0.00 0.71 0.00 0.00 54.79 55.37 1pkd n ASP 284 Cb 0.50 -4.68 0.21 0.00 -0.02 0.00 0.00 41.12 37.13 1pkd n ASP 284 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1pkd h THR 285 N -0.28 1.21 -3.00 -3.53 2.02 -1.67 -3.45 112.91 104.21 1pkd h THR 285 Ca -0.48 -0.44 -0.63 0.00 0.77 0.00 0.00 66.41 65.63 1pkd h THR 285 Cb 1.35 0.12 -0.16 0.00 -1.74 0.00 0.00 68.15 67.72 1pkd h THR 285 CO 0.55 0.22 -0.76 -0.31 0.37 0.00 0.00 175.52 175.59 1pkd s TYR 286 N -5.80 2.50 0.30 3.16 2.02 -1.26 -5.13 117.35 113.14 1pkd s TYR 286 Ca -0.11 -0.28 -0.10 0.00 -0.37 0.00 0.00 57.07 56.21 1pkd s TYR 286 Cb 0.17 -1.22 -0.07 0.00 -0.40 0.00 0.00 41.96 40.45 1pkd s TYR 286 CO 0.79 0.52 0.64 0.95 -1.57 0.00 0.00 175.55 176.88 1pkd s THR 287 N -1.75 4.87 0.36 -0.71 -4.23 -1.26 -4.97 115.64 107.95 1pkd s THR 287 Ca 0.24 0.51 0.17 0.00 -1.18 0.00 0.00 61.69 61.42 1pkd s THR 287 Cb -0.08 -3.67 0.36 0.00 1.34 0.00 0.00 72.50 70.45 1pkd s THR 287 CO 0.13 -0.25 1.68 0.50 -0.54 0.00 0.00 174.62 176.15 1pkd h LYS 288 N 2.01 0.33 -0.43 3.99 3.64 -1.97 -0.12 116.57 124.02 1pkd h LYS 288 Ca -0.47 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 58.79 1pkd h LYS 288 Cb 1.18 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1pkd h LYS 288 CO 0.67 0.22 -0.13 -0.22 -2.27 0.00 0.00 179.45 177.71 1pkd h LYS 289 N 0.34 0.78 -0.28 1.90 1.63 -1.99 -1.71 116.57 117.25 1pkd h LYS 289 Ca 0.71 -0.27 -0.02 0.00 -0.85 0.00 0.00 60.65 60.22 1pkd h LYS 289 Cb 1.70 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 33.26 1pkd h LYS 289 CO -0.51 0.88 0.11 1.96 -3.45 0.00 0.00 179.45 178.44 1pkd h GLN 290 N 0.70 0.42 -0.26 1.90 4.20 -1.41 -1.21 115.11 119.44 1pkd h GLN 290 Ca 0.11 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.78 1pkd h GLN 290 Cb 0.62 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 1pkd h GLN 290 CO 0.04 0.44 0.07 0.28 -0.67 0.00 0.00 178.83 179.00 1pkd h VAL 291 N 0.31 0.91 -0.67 -0.54 2.07 -1.18 -0.19 116.25 116.95 1pkd h VAL 291 Ca 0.09 -0.06 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 1pkd h VAL 291 Cb 0.18 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1pkd h VAL 291 CO -0.01 0.03 0.18 -0.07 0.02 0.00 0.00 177.57 177.73 1pkd h LEU 292 N 0.19 0.99 -0.74 2.57 4.07 -1.21 0.72 115.31 121.89 1pkd h LEU 292 Ca 0.12 -0.22 -0.11 0.00 0.08 0.00 0.00 57.88 57.75 1pkd h LEU 292 Cb 0.10 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.57 1pkd h LEU 292 CO -0.14 0.96 -0.22 0.03 -1.08 0.00 0.00 178.44 177.99 1pkd h ARG 293 N 0.98 0.72 -0.29 1.13 3.08 -0.96 -2.60 114.38 116.43 1pkd h ARG 293 Ca 0.21 -0.28 -0.14 0.00 0.07 0.00 0.00 59.98 59.84 1pkd h ARG 293 Cb 0.34 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1pkd h ARG 293 CO -0.00 0.88 -0.38 1.98 -1.07 0.00 0.00 179.97 181.37 1pkd h MET 294 N 0.63 0.68 -0.37 0.04 4.05 -0.60 -0.60 114.93 118.76 1pkd h MET 294 Ca 0.09 -0.35 0.08 0.00 -0.28 0.00 0.00 59.70 59.24 1pkd h MET 294 Cb 0.71 0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 31.43 1pkd h MET 294 CO 0.05 0.95 -0.20 1.49 0.23 0.00 0.00 176.91 179.44 1pkd h GLU 295 N 0.56 -0.14 -0.48 0.39 4.81 -0.72 0.04 114.58 119.06 1pkd h GLU 295 Ca 0.05 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1pkd h GLU 295 Cb 0.91 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 1pkd h GLU 295 CO 0.08 -0.09 0.22 1.25 -0.73 0.00 0.00 179.01 179.74 1pkd h HIS 296 N -0.14 0.70 -0.70 0.92 2.76 -1.07 -2.22 115.15 115.40 1pkd h HIS 296 Ca 0.18 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1pkd h HIS 296 Cb 0.43 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.14 1pkd h HIS 296 CO -0.43 0.57 0.39 1.25 -1.30 0.00 0.00 177.93 178.41 1pkd h LEU 297 N 0.63 0.87 -0.49 0.26 5.85 -0.80 -2.45 115.31 119.17 1pkd h LEU 297 Ca 0.16 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.82 1pkd h LEU 297 Cb 0.14 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1pkd h LEU 297 CO -0.02 0.70 0.29 0.58 -0.34 0.00 0.00 178.44 179.65 1pkd h VAL 298 N 0.96 1.05 -1.00 1.05 2.07 -0.77 -0.91 116.25 118.71 1pkd h VAL 298 Ca 0.25 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.62 1pkd h VAL 298 Cb 0.02 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.15 1pkd h VAL 298 CO -0.04 0.11 0.65 -0.07 0.02 0.00 0.00 177.57 178.23 1pkd h LEU 299 N 0.58 1.06 -0.36 2.57 3.38 -1.23 -0.94 115.31 120.37 1pkd h LEU 299 Ca 0.19 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.99 1pkd h LEU 299 Cb 0.02 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1pkd h LEU 299 CO -0.09 0.71 -0.47 0.11 0.09 0.00 0.00 178.44 178.80 1pkd h LYS 300 N 1.22 0.90 -0.52 1.13 1.57 -1.04 0.19 116.57 120.03 1pkd h LYS 300 Ca 0.41 -0.52 -0.08 0.00 -1.87 0.00 0.00 60.65 58.59 1pkd h LYS 300 Cb 0.06 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1pkd h LYS 300 CO -0.14 1.17 -0.01 0.28 -0.57 0.00 0.00 179.45 180.18 1pkd h VAL 301 N 0.71 1.25 -0.12 0.50 2.07 -0.95 -2.57 116.25 117.15 1pkd h VAL 301 Ca 0.04 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1pkd h VAL 301 Cb 1.07 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1pkd h VAL 301 CO 0.11 0.38 0.00 0.18 0.02 0.00 0.00 177.57 178.26 1pkd n LEU 302 N -4.20 1.35 -4.43 2.57 4.77 -0.38 -4.92 117.00 111.77 1pkd n LEU 302 Ca 0.03 -0.55 -0.39 0.00 -0.03 0.00 0.00 56.01 55.07 1pkd n LEU 302 Cb 0.32 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.27 1pkd n LEU 302 CO 0.42 0.27 -0.19 0.35 -1.33 0.00 0.00 177.39 176.92 1pkd n THR 303 N 0.10 -0.48 -1.27 -5.08 -2.24 -0.51 -0.78 114.28 104.03 1pkd n THR 303 Ca 0.16 -0.10 -0.09 0.00 -2.27 0.00 0.00 64.05 61.75 1pkd n THR 303 Cb 0.29 -0.90 -0.04 0.00 -2.10 0.00 0.00 70.33 67.58 1pkd n THR 303 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1pkd n PHE 304 N -4.22 0.00 -2.76 4.78 3.72 0.55 -4.93 117.46 114.60 1pkd n PHE 304 Ca 0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.00 1pkd n PHE 304 Cb 0.51 -2.34 -0.03 0.00 -0.94 0.00 0.00 39.48 36.68 1pkd n PHE 304 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1pkd s ASP 305 N -2.44 6.57 -0.02 4.37 1.01 0.04 -4.75 116.67 121.45 1pkd s ASP 305 Ca 0.00 -1.77 0.13 0.00 0.71 0.00 0.00 52.55 51.63 1pkd s ASP 305 Cb 0.00 -2.48 -0.20 0.00 1.01 0.00 0.00 42.92 41.25 1pkd s ASP 305 CO 0.00 -1.27 0.32 0.18 0.21 0.00 0.00 175.17 174.61 1pkd n LEU 306 N 7.61 0.07 -2.26 1.23 4.77 -1.26 -4.68 117.00 122.47 1pkd n LEU 306 Ca 0.28 -0.06 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 1pkd n LEU 306 Cb 0.50 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.46 1pkd n LEU 306 CO 0.57 0.02 1.73 0.00 -1.33 0.00 0.00 177.39 178.38 1pkd n ALA 307 N -1.89 5.81 -2.16 -1.18 0.00 -1.26 -4.92 120.51 114.90 1pkd n ALA 307 Ca -0.02 -1.82 -0.41 0.00 0.00 0.00 0.00 53.44 51.19 1pkd n ALA 307 Cb 0.33 -2.46 -0.04 0.00 0.00 0.00 0.00 19.45 17.28 1pkd n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pkd s ALA 308 N 1.48 3.37 0.38 0.00 0.00 -1.26 -5.01 121.76 120.72 1pkd s ALA 308 Ca 0.58 0.83 -0.26 0.00 0.00 0.00 0.00 51.96 53.11 1pkd s ALA 308 Cb 0.26 -3.38 -0.09 0.00 0.00 0.00 0.00 23.12 19.91 1pkd s ALA 308 CO -0.01 -0.28 1.20 -2.14 0.00 0.00 0.00 175.76 174.53 1pkd s PRO 309 N 0.00 4.14 0.22 0.00 0.02 -1.26 -4.94 135.00 133.17 1pkd s PRO 309 Ca 0.52 1.93 0.07 0.00 0.02 0.00 0.00 61.00 63.54 1pkd s PRO 309 Cb -0.29 -2.79 -0.05 0.00 0.02 0.00 0.00 34.50 31.39 1pkd s PRO 309 CO 0.34 -0.28 -0.12 0.95 -0.33 0.00 0.00 177.00 177.56 1pkd s THR 310 N -1.33 1.68 0.28 0.99 -4.23 -1.26 -4.93 115.64 106.84 1pkd s THR 310 Ca 0.55 -2.19 0.02 0.00 -1.18 0.00 0.00 61.69 58.89 1pkd s THR 310 Cb -0.33 -2.12 0.30 0.00 1.34 0.00 0.00 72.50 71.69 1pkd s THR 310 CO 0.42 -0.54 1.66 0.58 -0.54 0.00 0.00 174.62 176.20 1pkd h VAL 311 N 2.51 0.37 -0.87 2.29 2.07 -1.96 -1.29 116.25 119.38 1pkd h VAL 311 Ca -0.38 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 1pkd h VAL 311 Cb 1.22 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1pkd h VAL 311 CO 0.63 0.05 0.46 -1.13 0.02 0.00 0.00 177.57 177.60 1pkd h ASN 312 N 0.26 1.10 0.03 0.57 -1.24 -1.95 0.15 115.58 114.50 1pkd h ASN 312 Ca 0.54 -0.10 -0.10 0.00 0.71 0.00 0.00 56.30 57.35 1pkd h ASN 312 Cb 1.05 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.81 1pkd h ASN 312 CO -0.61 0.89 -0.30 1.56 -1.29 0.00 0.00 177.43 177.69 1pkd h GLN 313 N 1.22 0.40 -0.01 6.67 4.20 -1.65 -1.91 115.11 124.03 1pkd h GLN 313 Ca 0.30 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 1pkd h GLN 313 Cb 0.05 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1pkd h GLN 313 CO -0.05 0.66 -0.26 0.74 -0.67 0.00 0.00 178.83 179.25 1pkd h PHE 314 N 0.35 0.28 -0.68 2.96 0.04 -0.95 -3.20 116.94 115.73 1pkd h PHE 314 Ca 0.05 -0.14 0.11 0.00 2.80 0.00 0.00 57.97 60.78 1pkd h PHE 314 Cb 0.70 -0.03 -0.08 0.00 2.20 0.00 0.00 35.95 38.74 1pkd h PHE 314 CO 0.02 0.93 0.28 -0.07 -0.60 0.00 0.00 178.31 178.87 1pkd h LEU 315 N -0.45 0.30 -1.37 1.54 3.38 -0.62 -0.94 115.31 117.15 1pkd h LEU 315 Ca -0.03 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1pkd h LEU 315 Cb 0.99 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1pkd h LEU 315 CO 0.05 0.16 0.43 0.74 0.09 0.00 0.00 178.44 179.91 1pkd h THR 316 N 0.47 1.15 0.00 0.22 2.02 -1.45 0.42 112.91 115.75 1pkd h THR 316 Ca 0.35 -0.29 -0.10 0.00 0.77 0.00 0.00 66.41 67.14 1pkd h THR 316 Cb 0.46 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1pkd h THR 316 CO -0.33 0.16 -0.49 1.56 0.37 0.00 0.00 175.52 176.78 1pkd h GLN 317 N 0.86 0.00 0.16 6.66 4.20 -1.20 -3.27 115.11 122.52 1pkd h GLN 317 Ca 0.24 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.65 1pkd h GLN 317 Cb -0.07 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.74 1pkd h GLN 317 CO -0.06 0.49 -1.28 1.88 -0.67 0.00 0.00 178.83 179.20 1pkd h TYR 318 N 0.00 0.97 -0.79 2.96 0.05 -0.05 -3.28 116.97 116.84 1pkd h TYR 318 Ca -0.00 -0.64 0.23 0.00 0.05 0.00 0.00 58.73 58.36 1pkd h TYR 318 Cb 0.93 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 38.57 1pkd h TYR 318 CO 0.00 1.49 0.57 0.74 -1.05 0.00 0.00 178.16 179.91 1pkd h PHE 319 N 0.18 0.01 0.00 4.88 0.04 -1.17 0.37 116.94 121.24 1pkd h PHE 319 Ca -0.21 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.56 1pkd h PHE 319 Cb 1.96 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.11 1pkd h PHE 319 CO 0.13 0.00 0.00 1.28 -0.60 0.00 0.00 178.31 179.12 1pkd n LEU 320 N -4.30 0.57 -1.18 1.54 4.77 -1.23 -1.83 117.00 115.33 1pkd n LEU 320 Ca 0.16 0.69 0.09 0.00 -0.03 0.00 0.00 56.01 56.93 1pkd n LEU 320 Cb 0.86 -0.67 0.28 0.00 -2.33 0.00 0.00 43.42 41.55 1pkd n LEU 320 CO 0.38 -0.70 0.73 1.41 -1.33 0.00 0.00 177.39 177.88 1pkd n HIS 321 N -2.18 0.91 -2.68 -1.77 8.25 0.13 -4.87 115.22 113.00 1pkd n HIS 321 Ca 0.01 -0.43 -0.41 0.00 -0.26 0.00 0.00 57.72 56.63 1pkd n HIS 321 Cb 0.14 -0.04 -0.04 0.00 1.12 0.00 0.00 29.99 31.17 1pkd n HIS 321 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1pkd s GLN 322 N -1.30 4.67 -0.04 -0.41 -0.21 -0.76 -4.98 119.66 116.64 1pkd s GLN 322 Ca 0.42 1.51 -0.04 0.00 0.02 0.00 0.00 55.36 57.26 1pkd s GLN 322 Cb 0.23 -3.36 -0.02 0.00 1.00 0.00 0.00 33.01 30.85 1pkd s GLN 322 CO 0.27 0.17 0.26 1.96 -2.12 0.00 0.00 175.29 175.83 1pkd h GLN 323 N 5.53 -0.15 -5.67 2.91 1.08 -1.89 -3.40 115.11 113.52 1pkd h GLN 323 Ca -0.43 0.01 -0.59 0.00 -1.45 0.00 0.00 58.65 56.19 1pkd h GLN 323 Cb 1.21 0.04 -0.09 0.00 -0.05 0.00 0.00 27.48 28.58 1pkd h GLN 323 CO 0.72 -0.10 0.13 -1.25 -0.95 0.00 0.00 178.83 177.38 1pkd s PRO 324 N -2.01 4.21 -0.58 1.46 0.04 -1.26 -5.03 135.00 131.84 1pkd s PRO 324 Ca -0.02 0.63 -0.27 0.00 0.04 0.00 0.00 61.00 61.37 1pkd s PRO 324 Cb 0.00 -3.58 -0.01 0.00 0.04 0.00 0.00 34.50 30.96 1pkd s PRO 324 CO 0.07 -0.24 1.67 0.00 0.04 0.00 0.00 177.00 178.53 1pkd s ALA 325 N 1.93 2.49 -0.25 8.56 0.00 -1.26 -4.97 121.76 128.26 1pkd s ALA 325 Ca 0.29 -0.63 -0.17 0.00 0.00 0.00 0.00 51.96 51.46 1pkd s ALA 325 Cb -0.16 -4.21 -0.03 0.00 0.00 0.00 0.00 23.12 18.72 1pkd s ALA 325 CO 0.10 -3.41 0.45 1.21 0.00 0.00 0.00 175.76 174.11 1pkd s ASN 326 N 6.36 6.39 0.39 0.00 3.84 -1.26 -4.97 114.94 125.69 1pkd s ASN 326 Ca 0.61 0.46 0.21 0.00 0.21 0.00 0.00 52.86 54.35 1pkd s ASN 326 Cb -0.13 -2.25 0.61 0.00 -0.55 0.00 0.00 41.25 38.93 1pkd s ASN 326 CO 0.23 -0.20 1.69 0.00 -2.79 0.00 0.00 177.10 176.03 1pkd h LYS 328 N 0.00 0.20 0.16 0.00 3.64 -1.95 -2.43 116.57 116.19 1pkd h LYS 328 Ca -0.00 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 59.05 1pkd h LYS 328 Cb 0.96 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1pkd h LYS 328 CO 0.04 1.13 -0.08 0.28 -2.27 0.00 0.00 179.45 178.55 1pkd h VAL 329 N 0.07 0.94 -0.32 2.00 2.07 -1.83 -2.16 116.25 117.02 1pkd h VAL 329 Ca -0.09 -0.44 0.07 0.00 0.82 0.00 0.00 66.70 67.06 1pkd h VAL 329 Cb 1.84 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 32.76 1pkd h VAL 329 CO 0.17 0.10 -0.15 -0.33 0.02 0.00 0.00 177.57 177.39 1pkd h GLU 330 N -0.42 -0.09 -0.27 1.57 5.08 -1.56 -0.38 114.58 118.50 1pkd h GLU 330 Ca -0.02 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1pkd h GLU 330 Cb 0.33 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1pkd h GLU 330 CO 0.04 -0.06 0.09 0.77 -1.00 0.00 0.00 179.01 178.84 1pkd h SER 331 N -0.10 0.10 -0.44 1.42 0.02 -1.45 -1.41 113.55 111.69 1pkd h SER 331 Ca 0.16 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1pkd h SER 331 Cb 0.34 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 1pkd h SER 331 CO -0.38 0.09 0.14 0.25 -1.14 0.00 0.00 176.83 175.79 1pkd h LEU 332 N 0.21 0.64 -0.63 5.07 5.85 -0.92 0.01 115.31 125.55 1pkd h LEU 332 Ca 0.12 -0.20 0.10 0.00 0.84 0.00 0.00 57.88 58.74 1pkd h LEU 332 Cb 0.09 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 40.87 1pkd h LEU 332 CO -0.12 0.68 0.22 0.00 -0.34 0.00 0.00 178.44 178.87 1pkd h ALA 333 N 0.99 0.81 -0.35 1.25 0.00 -0.91 0.14 119.26 121.18 1pkd h ALA 333 Ca 0.14 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1pkd h ALA 333 Cb 0.26 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1pkd h ALA 333 CO -0.00 -0.22 0.15 0.52 0.00 0.00 0.00 179.25 179.70 1pkd h MET 334 N 0.38 0.30 -0.92 0.00 2.86 -0.56 -1.10 114.93 115.89 1pkd h MET 334 Ca 0.32 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.98 1pkd h MET 334 Cb 0.43 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 1pkd h MET 334 CO -0.34 0.20 0.60 0.35 1.06 0.00 0.00 176.91 178.78 1pkd h PHE 335 N 0.31 1.11 -0.01 -0.22 3.57 -0.03 -0.90 116.94 120.77 1pkd h PHE 335 Ca 0.15 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1pkd h PHE 335 Cb 0.10 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.47 1pkd h PHE 335 CO -0.12 0.65 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.49 1pkd h LEU 336 N 1.16 0.07 -0.96 0.59 3.38 -0.70 -0.99 115.31 117.86 1pkd h LEU 336 Ca 0.36 -0.63 0.08 0.00 0.09 0.00 0.00 57.88 57.79 1pkd h LEU 336 Cb 0.01 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 1pkd h LEU 336 CO -0.11 0.68 0.60 1.23 0.09 0.00 0.00 178.44 180.94 1pkd h GLY 337 N -0.54 1.48 2.00 0.83 0.00 -1.16 -0.45 103.07 105.22 1pkd h GLY 337 Ca -0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1pkd h GLY 337 CO 0.01 0.27 -0.34 -2.09 0.00 0.00 0.00 176.54 174.39 1pkd h GLU 338 N 1.06 0.00 0.00 4.80 4.81 -1.17 -2.73 114.58 121.36 1pkd h GLU 338 Ca 0.43 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.53 1pkd h GLU 338 Cb 0.25 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1pkd h GLU 338 CO -0.20 0.34 -0.61 -0.07 -0.73 0.00 0.00 179.01 177.74 1pkd h LEU 339 N 0.00 0.00 -1.35 1.64 3.38 0.31 -3.07 115.31 116.22 1pkd h LEU 339 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pkd h LEU 339 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1pkd h LEU 339 CO 0.04 0.61 0.00 0.77 0.09 0.00 0.00 178.44 179.95 1pkd h SER 340 N 0.00 0.00 0.44 -0.43 4.64 -1.01 -3.05 113.55 114.14 1pkd h SER 340 Ca -0.01 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 1pkd h SER 340 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1pkd h SER 340 CO 0.08 0.00 -0.51 -0.07 -0.87 0.00 0.00 176.83 175.46 1pkd h LEU 341 N 0.00 0.09 -0.53 5.97 3.38 -1.60 -3.28 115.31 119.35 1pkd h LEU 341 Ca 0.00 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1pkd h LEU 341 Cb 0.38 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1pkd h LEU 341 CO 0.00 0.59 -0.27 0.40 0.09 0.00 0.00 178.44 179.25 1pkd h ILE 342 N 0.07 1.27 -3.46 1.22 1.08 -1.71 -3.42 117.51 112.56 1pkd h ILE 342 Ca -0.00 -1.43 -0.71 0.00 -0.39 0.00 0.00 64.86 62.34 1pkd h ILE 342 Cb 0.93 1.23 -0.31 0.00 -3.07 0.00 0.00 36.82 35.59 1pkd h ILE 342 CO 0.07 0.48 -0.51 -1.81 -0.69 0.00 0.00 178.15 175.70 1pkd s ASP 343 N -6.77 5.43 0.48 1.72 1.01 -1.24 -4.03 116.67 113.27 1pkd s ASP 343 Ca -0.10 -1.77 0.15 0.00 0.71 0.00 0.00 52.55 51.53 1pkd s ASP 343 Cb 0.12 -1.90 1.11 0.00 1.01 0.00 0.00 42.92 43.26 1pkd s ASP 343 CO 0.86 -0.55 2.06 0.00 0.21 0.00 0.00 175.17 177.76 1pkd h ALA 344 N 8.24 1.83 -1.32 5.23 0.00 -1.83 -3.18 119.26 128.22 1pkd h ALA 344 Ca -0.18 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1pkd h ALA 344 Cb 1.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1pkd h ALA 344 CO 0.73 0.13 0.00 -3.47 0.00 0.00 0.00 179.25 176.64 1pkd n ASP 345 N -4.42 0.00 -0.04 0.00 -0.08 -1.26 -1.73 116.55 109.02 1pkd n ASP 345 Ca -0.03 0.78 -0.15 0.00 -1.51 0.00 0.00 54.79 53.88 1pkd n ASP 345 Cb 0.17 -0.28 -0.08 0.00 2.34 0.00 0.00 41.12 43.27 1pkd n ASP 345 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1pkd h PRO 346 N 0.00 0.52 0.00 -0.67 0.11 -1.98 -3.40 132.00 126.58 1pkd h PRO 346 Ca 0.00 -0.38 -0.07 0.00 0.11 0.00 0.00 66.00 65.66 1pkd h PRO 346 Cb 0.00 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 1pkd h PRO 346 CO 0.00 1.01 -0.34 1.88 -0.21 0.00 0.00 178.00 180.34 1pkd h TYR 347 N 0.13 0.00 -0.09 0.65 0.05 -1.49 -2.52 116.97 113.70 1pkd h TYR 347 Ca -0.02 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.79 1pkd h TYR 347 Cb 1.05 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.79 1pkd h TYR 347 CO 0.11 0.34 0.09 1.25 -1.05 0.00 0.00 178.16 178.89 1pkd h LEU 348 N 0.00 0.00 -1.11 3.88 5.85 -1.55 -2.17 115.31 120.20 1pkd h LEU 348 Ca -0.00 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1pkd h LEU 348 Cb 1.25 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 1pkd h LEU 348 CO 0.04 0.00 -0.31 0.50 -0.34 0.00 0.00 178.44 178.34 1pkd h LYS 349 N 0.00 0.00 -5.71 1.25 3.64 -1.68 -3.44 116.57 110.63 1pkd h LYS 349 Ca 0.04 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 58.75 1pkd h LYS 349 Cb 0.21 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.95 1pkd h LYS 349 CO -0.00 0.31 -0.51 0.71 -2.27 0.00 0.00 179.45 177.69 1pkd s TYR 350 N -3.72 3.51 0.37 1.91 2.02 -0.82 -5.08 117.35 115.54 1pkd s TYR 350 Ca -0.00 0.46 -0.27 0.00 -0.37 0.00 0.00 57.07 56.89 1pkd s TYR 350 Cb 0.11 -1.91 -0.09 0.00 -0.40 0.00 0.00 41.96 39.68 1pkd s TYR 350 CO 0.66 0.68 1.25 -0.51 -1.57 0.00 0.00 175.55 176.06 1pkd s LEU 351 N -1.04 4.30 0.33 -1.29 1.43 -1.26 -4.88 118.68 116.27 1pkd s LEU 351 Ca 0.15 2.54 0.10 0.00 -1.03 0.00 0.00 54.13 55.89 1pkd s LEU 351 Cb -0.12 -3.84 0.99 0.00 0.03 0.00 0.00 46.19 43.25 1pkd s LEU 351 CO 0.04 -0.65 1.61 -0.65 0.23 0.00 0.00 176.35 176.94 1pkd h PRO 352 N 2.97 0.13 -0.01 1.29 0.11 -1.92 -0.97 132.00 133.59 1pkd h PRO 352 Ca -0.49 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1pkd h PRO 352 Cb 1.23 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1pkd h PRO 352 CO 0.64 0.08 -0.44 0.66 -0.21 0.00 0.00 178.00 178.74 1pkd h SER 353 N 0.13 0.02 0.09 -2.05 4.64 -1.91 -0.02 113.55 114.44 1pkd h SER 353 Ca 0.69 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 62.00 1pkd h SER 353 Cb 1.59 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 1pkd h SER 353 CO -0.74 0.45 -0.04 0.58 -0.87 0.00 0.00 176.83 176.21 1pkd h VAL 354 N 0.01 1.15 -0.96 0.95 2.07 -1.58 -2.05 116.25 115.85 1pkd h VAL 354 Ca -0.00 -1.13 0.03 0.00 0.82 0.00 0.00 66.70 66.42 1pkd h VAL 354 Cb 0.78 1.85 -0.05 0.00 -1.52 0.00 0.00 31.29 32.34 1pkd h VAL 354 CO 0.06 0.27 0.63 0.40 0.02 0.00 0.00 177.57 178.95 1pkd h ILE 355 N -0.66 1.17 -0.87 4.57 2.04 -1.23 0.17 117.51 122.70 1pkd h ILE 355 Ca -0.01 -0.42 0.03 0.00 1.00 0.00 0.00 64.86 65.46 1pkd h ILE 355 Cb 0.53 -0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.40 1pkd h ILE 355 CO 0.02 0.22 0.57 0.00 0.00 0.00 0.00 178.15 178.96 1pkd h ALA 356 N 1.43 1.14 0.04 1.87 0.00 -1.05 0.23 119.26 122.93 1pkd h ALA 356 Ca 0.38 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1pkd h ALA 356 Cb -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1pkd h ALA 356 CO -0.11 0.43 -0.02 0.78 0.00 0.00 0.00 179.25 180.33 1pkd h GLY 357 N 1.11 -0.05 1.02 0.00 0.00 -0.37 -0.86 103.07 103.93 1pkd h GLY 357 Ca 0.34 0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.66 1pkd h GLY 357 CO -0.11 -0.02 0.34 0.00 0.00 0.00 0.00 176.54 176.75 1pkd h ALA 358 N 0.77 0.95 0.00 3.60 0.00 -0.35 -1.21 119.26 123.02 1pkd h ALA 358 Ca -0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1pkd h ALA 358 Cb 0.17 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1pkd h ALA 358 CO 0.01 0.52 -0.24 0.00 0.00 0.00 0.00 179.25 179.54 1pkd h ALA 359 N 1.17 0.94 0.10 0.00 0.00 -0.55 -0.98 119.26 119.94 1pkd h ALA 359 Ca 0.25 -0.22 -0.27 0.00 0.00 0.00 0.00 54.91 54.67 1pkd h ALA 359 Cb 0.14 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1pkd h ALA 359 CO -0.03 0.30 -1.18 0.35 0.00 0.00 0.00 179.25 178.70 1pkd h PHE 360 N 0.00 0.58 -0.14 0.00 3.57 -0.81 -2.82 116.94 117.33 1pkd h PHE 360 Ca -0.00 -0.39 -0.04 0.00 3.53 0.00 0.00 57.97 61.07 1pkd h PHE 360 Cb 0.90 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.60 1pkd h PHE 360 CO 0.00 1.27 -0.06 1.25 -2.23 0.00 0.00 178.31 178.55 1pkd h HIS 361 N 0.13 0.32 0.00 0.41 2.76 -1.14 -2.41 115.15 115.23 1pkd h HIS 361 Ca -0.13 -0.08 -0.03 0.00 -2.20 0.00 0.00 60.37 57.93 1pkd h HIS 361 Cb 1.87 -0.08 -0.00 0.00 1.55 0.00 0.00 27.41 30.75 1pkd h HIS 361 CO 0.07 0.60 -0.16 1.25 -1.30 0.00 0.00 177.93 178.39 1pkd h LEU 362 N -0.05 0.00 0.00 0.26 5.85 -1.26 -0.35 115.31 119.76 1pkd h LEU 362 Ca 0.03 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.60 1pkd h LEU 362 Cb 0.51 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1pkd h LEU 362 CO 0.02 0.16 -1.44 0.00 -0.34 0.00 0.00 178.44 176.84 1pkd n ALA 363 N -2.30 1.99 0.09 1.25 0.00 -1.06 -2.29 120.51 118.19 1pkd n ALA 363 Ca -0.02 -0.54 -0.13 0.00 0.00 0.00 0.00 53.44 52.75 1pkd n ALA 363 Cb 0.28 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 18.71 1pkd n ALA 363 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1pkd h LEU 364 N 0.00 -0.21 -0.38 0.00 5.85 -0.89 -3.16 115.31 116.51 1pkd h LEU 364 Ca -0.16 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 1pkd h LEU 364 Cb 1.54 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.61 1pkd h LEU 364 CO 0.04 0.17 0.12 0.22 -0.34 0.00 0.00 178.44 178.65 1pkd h TYR 365 N -0.64 0.62 0.14 1.25 3.20 -0.53 0.52 116.97 121.52 1pkd h TYR 365 Ca -0.03 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.80 1pkd h TYR 365 Cb 0.46 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 1pkd h TYR 365 CO 0.04 0.58 -0.35 1.15 -1.64 0.00 0.00 178.16 177.95 1pkd h THR 366 N 0.47 0.27 0.10 1.81 2.02 -1.57 -0.99 112.91 115.02 1pkd h THR 366 Ca 0.12 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 67.09 1pkd h THR 366 Cb 0.26 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1pkd h THR 366 CO -0.00 0.00 -1.04 0.58 0.37 0.00 0.00 175.52 175.43 1pkd h VAL 367 N -0.59 1.27 -0.01 3.16 2.07 -1.56 -3.40 116.25 117.19 1pkd h VAL 367 Ca 0.02 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.12 1pkd h VAL 367 Cb 0.61 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.30 1pkd h VAL 367 CO -0.19 0.67 -0.04 0.35 0.02 0.00 0.00 177.57 178.37 1pkd n THR 368 N -4.11 0.00 -1.92 2.57 -2.24 0.15 -4.98 114.28 103.75 1pkd n THR 368 Ca -0.20 -0.48 -0.15 0.00 -2.27 0.00 0.00 64.05 60.95 1pkd n THR 368 Cb 0.81 1.24 -0.03 0.00 -2.10 0.00 0.00 70.33 70.25 1pkd n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pkd n GLY 369 N 0.75 0.52 3.82 3.38 0.00 -0.38 -4.94 105.19 108.34 1pkd n GLY 369 Ca 0.07 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 1pkd n GLY 369 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pkd s GLN 370 N -4.12 2.49 0.07 1.61 -0.21 -1.17 -4.86 119.66 113.46 1pkd s GLN 370 Ca 0.00 -1.54 0.06 0.00 0.02 0.00 0.00 55.36 53.90 1pkd s GLN 370 Cb 0.00 -2.29 -0.03 0.00 1.00 0.00 0.00 33.01 31.69 1pkd s GLN 370 CO 0.00 -0.05 -0.17 0.45 -2.12 0.00 0.00 175.29 173.41 1pkd s SER 371 N -4.00 1.98 -0.20 5.90 0.15 -1.26 -2.12 113.70 114.15 1pkd s SER 371 Ca 0.43 -0.58 -0.05 0.00 0.70 0.00 0.00 55.95 56.45 1pkd s SER 371 Cb -0.02 -0.10 -0.05 0.00 -1.71 0.00 0.00 66.02 64.13 1pkd s SER 371 CO 0.26 0.01 0.50 1.87 1.20 0.00 0.00 173.24 177.08 1pkd n TRP 372 N 1.44 0.08 -1.26 3.44 -0.00 -1.26 -4.81 117.44 115.07 1pkd n TRP 372 Ca -0.20 0.05 -0.35 0.00 -0.00 0.00 0.00 57.50 57.01 1pkd n TRP 372 Cb 0.54 -0.37 0.11 0.00 -0.00 0.00 0.00 31.31 31.59 1pkd n TRP 372 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1pkd n PRO 373 N 1.50 0.39 -0.30 5.87 -0.02 -1.26 -4.86 135.00 136.33 1pkd n PRO 373 Ca 0.13 0.20 -0.05 0.00 -2.02 0.00 0.00 63.50 61.76 1pkd n PRO 373 Cb 0.01 -2.35 0.07 0.00 -0.02 0.00 0.00 33.50 31.21 1pkd n PRO 373 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1pkd h GLU 374 N -0.53 1.15 -0.95 -0.52 4.57 -1.98 -2.63 114.58 113.69 1pkd h GLU 374 Ca -0.47 -0.14 0.14 0.00 -1.18 0.00 0.00 59.36 57.71 1pkd h GLU 374 Cb 1.32 -0.22 -0.09 0.00 -0.16 0.00 0.00 28.75 29.59 1pkd h GLU 374 CO 0.47 0.85 0.56 0.66 -1.18 0.00 0.00 179.01 180.37 1pkd h SER 375 N 1.14 0.77 -0.24 1.04 4.64 -1.95 -2.02 113.55 116.93 1pkd h SER 375 Ca 0.29 0.07 -0.17 0.00 -0.47 0.00 0.00 61.79 61.51 1pkd h SER 375 Cb 0.04 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1pkd h SER 375 CO -0.05 0.36 -0.47 -0.07 -0.87 0.00 0.00 176.83 175.73 1pkd h LEU 376 N 0.83 0.89 -1.23 5.97 3.38 -1.84 -2.49 115.31 120.82 1pkd h LEU 376 Ca 0.50 -0.44 0.05 0.00 0.09 0.00 0.00 57.88 58.08 1pkd h LEU 376 Cb 0.62 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 1pkd h LEU 376 CO -0.32 1.21 0.54 0.40 0.09 0.00 0.00 178.44 180.37 1pkd h ILE 377 N 0.64 1.09 -0.19 1.22 2.04 -1.16 0.17 117.51 121.33 1pkd h ILE 377 Ca 0.03 -0.33 -0.16 0.00 1.00 0.00 0.00 64.86 65.41 1pkd h ILE 377 Cb 1.05 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1pkd h ILE 377 CO 0.10 0.18 -0.53 0.03 0.00 0.00 0.00 178.15 177.93 1pkd h ARG 378 N 0.97 0.56 0.14 2.37 3.08 -1.26 0.32 114.38 120.57 1pkd h ARG 378 Ca 0.34 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1pkd h ARG 378 Cb 0.13 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1pkd h ARG 378 CO -0.11 0.95 -0.07 -0.22 -1.07 0.00 0.00 179.97 179.45 1pkd h LYS 379 N 0.44 -0.19 0.00 0.04 3.11 -0.90 -3.38 116.57 115.69 1pkd h LYS 379 Ca 0.01 0.01 -0.26 0.00 -2.81 0.00 0.00 60.65 57.61 1pkd h LYS 379 Cb 1.07 0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 32.30 1pkd h LYS 379 CO 0.10 0.25 -1.40 1.79 -2.81 0.00 0.00 179.45 177.38 1pkd h THR 380 N -0.89 1.22 0.00 1.00 1.35 -0.79 -3.48 112.91 111.33 1pkd h THR 380 Ca -0.02 -3.01 0.00 0.00 -0.55 0.00 0.00 66.41 62.83 1pkd h THR 380 Cb 0.52 2.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.55 1pkd h THR 380 CO 0.03 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.61 1pkd n GLY 381 N 1.47 0.64 3.63 5.82 0.00 0.10 -5.01 105.19 111.84 1pkd n GLY 381 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1pkd n GLY 381 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pkd s TYR 382 N -2.62 3.29 0.60 1.61 2.02 -1.25 -5.03 117.35 115.96 1pkd s TYR 382 Ca 0.00 0.77 0.02 0.00 -0.37 0.00 0.00 57.07 57.49 1pkd s TYR 382 Cb 0.00 -2.79 0.07 0.00 -0.40 0.00 0.00 41.96 38.84 1pkd s TYR 382 CO 0.00 -0.29 0.83 0.95 -1.57 0.00 0.00 175.55 175.47 1pkd s THR 383 N 2.35 2.46 0.22 -0.71 -4.23 -1.26 -4.35 115.64 110.13 1pkd s THR 383 Ca 0.25 -0.72 0.25 0.00 -1.18 0.00 0.00 61.69 60.29 1pkd s THR 383 Cb -0.16 -2.75 0.25 0.00 1.34 0.00 0.00 72.50 71.18 1pkd s THR 383 CO 0.09 0.00 1.90 0.25 -0.54 0.00 0.00 174.62 176.31 1pkd h LEU 384 N -0.05 0.00 -0.11 4.79 5.85 -1.98 -1.93 115.31 121.88 1pkd h LEU 384 Ca -0.38 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 1pkd h LEU 384 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 1pkd h LEU 384 CO 0.46 0.20 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.63 1pkd h GLU 385 N 0.00 0.24 0.00 1.25 4.57 -2.00 -2.60 114.58 116.04 1pkd h GLU 385 Ca -0.00 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 1pkd h GLU 385 Cb 0.63 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1pkd h GLU 385 CO 0.03 0.59 -0.11 0.66 -1.18 0.00 0.00 179.01 178.99 1pkd h SER 386 N -0.11 0.00 0.99 1.04 4.64 -1.84 -1.85 113.55 116.41 1pkd h SER 386 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1pkd h SER 386 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1pkd h SER 386 CO 0.02 0.11 -0.45 0.18 -0.87 0.00 0.00 176.83 175.82 1pkd n LEU 387 N -3.94 0.69 -0.08 5.97 4.77 -0.76 -4.50 117.00 119.15 1pkd n LEU 387 Ca -0.02 0.31 -0.07 0.00 -0.03 0.00 0.00 56.01 56.20 1pkd n LEU 387 Cb 0.20 -0.23 -0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1pkd n LEU 387 CO 0.32 -0.07 0.87 0.50 -1.33 0.00 0.00 177.39 177.67 1pkd h LYS 388 N 0.00 0.10 -0.66 3.23 3.64 -0.92 0.08 116.57 122.03 1pkd h LYS 388 Ca 0.00 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.45 1pkd h LYS 388 Cb 0.72 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.45 1pkd h LYS 388 CO 0.00 0.07 0.33 -1.35 -2.27 0.00 0.00 179.45 176.22 1pkd h PRO 389 N 0.10 0.56 -0.11 1.90 0.11 -1.79 0.80 132.00 133.57 1pkd h PRO 389 Ca 0.14 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 66.07 1pkd h PRO 389 Cb 0.18 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1pkd h PRO 389 CO -0.22 0.37 -0.57 0.00 -0.21 0.00 0.00 178.00 177.37 1pkd h LEU 391 N 0.27 0.88 -0.02 0.00 7.12 0.70 0.99 115.31 125.26 1pkd h LEU 391 Ca -0.00 -0.28 0.03 0.00 0.13 0.00 0.00 57.88 57.76 1pkd h LEU 391 Cb 1.08 -0.24 -0.04 0.00 -0.53 0.00 0.00 40.66 40.94 1pkd h LEU 391 CO 0.10 0.94 -0.23 -0.03 -0.13 0.00 0.00 178.44 179.08 1pkd h MET 392 N 0.79 -0.35 -0.14 1.25 4.05 0.54 -0.19 114.93 120.88 1pkd h MET 392 Ca 0.16 0.02 0.02 0.00 -0.28 0.00 0.00 59.70 59.62 1pkd h MET 392 Cb 0.45 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.31 1pkd h MET 392 CO 0.02 -0.23 0.03 -0.44 0.23 0.00 0.00 176.91 176.52 1pkd h ASP 393 N -0.36 0.02 -0.20 1.39 3.32 -1.33 -2.77 116.42 116.49 1pkd h ASP 393 Ca 0.07 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.06 1pkd h ASP 393 Cb 0.45 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 1pkd h ASP 393 CO -0.22 0.03 -0.12 0.25 -1.72 0.00 0.00 179.24 177.46 1pkd h LEU 394 N 0.09 0.56 -0.08 1.55 5.85 -0.63 -1.99 115.31 120.66 1pkd h LEU 394 Ca 0.06 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1pkd h LEU 394 Cb 0.05 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1pkd h LEU 394 CO -0.08 0.71 -0.12 -0.74 -0.34 0.00 0.00 178.44 177.88 1pkd h HIS 395 N 0.53 -0.30 -0.75 1.25 2.76 -0.88 -0.93 115.15 116.84 1pkd h HIS 395 Ca 0.10 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.30 1pkd h HIS 395 Cb 0.52 0.14 -0.04 0.00 1.55 0.00 0.00 27.41 29.58 1pkd h HIS 395 CO 0.02 -0.18 0.48 1.96 -1.30 0.00 0.00 177.93 178.92 1pkd h GLN 396 N -0.16 0.94 -0.66 5.26 1.08 -1.15 -1.00 115.11 119.42 1pkd h GLN 396 Ca 0.07 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.18 1pkd h GLN 396 Cb 0.26 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 1pkd h GLN 396 CO -0.18 0.62 0.28 1.15 -0.95 0.00 0.00 178.83 179.75 1pkd h THR 397 N 0.97 1.24 -0.02 -0.54 2.02 -1.16 -0.74 112.91 114.66 1pkd h THR 397 Ca 0.29 -0.72 0.02 0.00 0.77 0.00 0.00 66.41 66.77 1pkd h THR 397 Cb -0.05 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 66.81 1pkd h THR 397 CO -0.08 0.29 -0.12 0.22 0.37 0.00 0.00 175.52 176.20 1pkd h TYR 398 N 0.93 -0.30 -0.36 3.16 3.20 -0.74 0.37 116.97 123.23 1pkd h TYR 398 Ca 0.22 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.17 1pkd h TYR 398 Cb 0.19 0.14 -0.06 0.00 1.54 0.00 0.00 36.73 38.53 1pkd h TYR 398 CO 0.01 -0.18 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.25 1pkd h LEU 399 N -0.19 -0.22 -0.29 2.82 3.38 -0.82 -2.93 115.31 117.06 1pkd h LEU 399 Ca 0.05 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1pkd h LEU 399 Cb 0.26 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1pkd h LEU 399 CO -0.14 -0.07 -0.26 0.29 0.09 0.00 0.00 178.44 178.35 1pkd n LYS 400 N -5.22 0.56 -0.31 1.13 5.02 -0.32 -4.44 118.16 114.58 1pkd n LYS 400 Ca 0.02 -0.29 0.15 0.00 -2.02 0.00 0.00 58.31 56.17 1pkd n LYS 400 Cb 0.19 -1.49 0.32 0.00 -0.02 0.00 0.00 35.03 34.03 1pkd n LYS 400 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pkd h ALA 401 N 3.47 1.36 0.00 7.82 0.00 -0.73 0.16 119.26 131.34 1pkd h ALA 401 Ca 0.00 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1pkd h ALA 401 Cb 0.47 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1pkd h ALA 401 CO 0.00 -0.54 -0.02 -1.35 0.00 0.00 0.00 179.25 177.34 1pkd h PRO 402 N 0.15 0.00 -0.00 0.00 0.11 -1.81 -3.04 132.00 127.41 1pkd h PRO 402 Ca 0.59 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.70 1pkd h PRO 402 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1pkd h PRO 402 CO -0.72 0.02 -0.83 1.04 -0.21 0.00 0.00 178.00 177.30 1pkd n GLN 403 N -3.78 0.88 -1.69 1.05 3.00 0.51 -4.99 117.38 112.36 1pkd n GLN 403 Ca -0.03 -0.10 -0.41 0.00 -0.01 0.00 0.00 57.00 56.45 1pkd n GLN 403 Cb 0.11 -1.39 0.01 0.00 0.00 0.00 0.00 30.24 28.97 1pkd n GLN 403 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 1pkd n HIS 404 N -1.29 2.07 0.26 1.08 -0.00 -0.92 -4.88 115.22 111.53 1pkd n HIS 404 Ca 0.04 0.52 0.18 0.00 0.46 0.00 0.00 57.72 58.92 1pkd n HIS 404 Cb 0.31 -2.37 0.90 0.00 -0.12 0.00 0.00 29.99 28.70 1pkd n HIS 404 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1pkd h ALA 405 N 2.12 1.56 -2.94 1.57 0.00 -1.94 -3.40 119.26 116.24 1pkd h ALA 405 Ca -0.47 -0.00 -0.65 0.00 0.00 0.00 0.00 54.91 53.78 1pkd h ALA 405 Cb 1.30 0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.88 1pkd h ALA 405 CO 0.60 -0.27 -0.60 -0.65 0.00 0.00 0.00 179.25 178.33 1pkd s GLN 406 N -4.41 3.64 -0.01 0.00 1.11 -1.26 -4.98 119.66 113.75 1pkd s GLN 406 Ca -0.04 -0.49 0.10 0.00 0.01 0.00 0.00 55.36 54.93 1pkd s GLN 406 Cb 0.13 -3.40 -0.15 0.00 -1.01 0.00 0.00 33.01 28.59 1pkd s GLN 406 CO 0.45 -0.22 0.22 1.04 0.01 0.00 0.00 175.29 176.80 1pkd n GLN 407 N 4.95 0.52 -0.30 2.91 3.00 -1.26 -4.75 117.38 122.45 1pkd n GLN 407 Ca -0.16 -0.08 0.17 0.00 -0.01 0.00 0.00 57.00 56.92 1pkd n GLN 407 Cb 0.51 -1.21 0.43 0.00 0.00 0.00 0.00 30.24 29.97 1pkd n GLN 407 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.06 177.83 1pkd h SER 408 N 0.00 0.58 -0.44 1.08 0.02 -1.93 0.15 113.55 113.01 1pkd h SER 408 Ca 0.00 0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 60.93 1pkd h SER 408 Cb 0.43 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1pkd h SER 408 CO 0.00 0.21 -0.07 0.40 -1.14 0.00 0.00 176.83 176.23 1pkd h ILE 409 N 0.57 1.27 -0.17 3.27 2.04 -1.90 0.75 117.51 123.33 1pkd h ILE 409 Ca 0.53 -1.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 1pkd h ILE 409 Cb 1.09 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1pkd h ILE 409 CO -0.28 0.40 0.11 0.03 0.00 0.00 0.00 178.15 178.40 1pkd h ARG 410 N 0.65 0.23 -0.58 2.37 3.08 -1.12 -2.16 114.38 116.86 1pkd h ARG 410 Ca 0.11 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.16 1pkd h ARG 410 Cb 0.60 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1pkd h ARG 410 CO 0.04 0.19 0.38 0.93 -1.07 0.00 0.00 179.97 180.44 1pkd h GLU 411 N 0.21 0.74 -0.32 0.04 4.39 -0.94 -2.99 114.58 115.70 1pkd h GLU 411 Ca 0.06 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 1pkd h GLU 411 Cb 0.02 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 1pkd h GLU 411 CO -0.01 0.49 0.06 -0.22 -1.16 0.00 0.00 179.01 178.16 1pkd h LYS 412 N 0.76 0.53 -0.77 2.33 3.64 -0.50 -3.15 116.57 119.41 1pkd h LYS 412 Ca 0.22 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1pkd h LYS 412 Cb -0.06 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1pkd h LYS 412 CO -0.05 0.62 0.00 0.66 -2.27 0.00 0.00 179.45 178.41 1pkd n TYR 413 N -4.61 1.10 0.06 1.91 4.02 -0.84 -3.58 117.16 115.22 1pkd n TYR 413 Ca -0.02 -0.38 -0.18 0.00 -0.01 0.00 0.00 57.90 57.31 1pkd n TYR 413 Cb 0.21 -0.32 -0.14 0.00 -0.02 0.00 0.00 39.34 39.08 1pkd n TYR 413 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1pkd h LYS 414 N 2.11 0.28 -7.11 -0.72 1.57 -1.49 -2.97 116.57 108.24 1pkd h LYS 414 Ca 0.00 -0.48 -0.49 0.00 -1.87 0.00 0.00 60.65 57.80 1pkd h LYS 414 Cb 1.28 0.18 0.21 0.00 0.08 0.00 0.00 32.23 33.97 1pkd h LYS 414 CO 0.26 1.15 -0.06 -1.71 -0.57 0.00 0.00 179.45 178.52 1pkd n ASN 415 N -3.48 -0.81 -0.17 0.86 2.85 -1.23 -3.82 115.26 109.46 1pkd n ASN 415 Ca -0.19 0.20 0.02 0.00 -0.11 0.00 0.00 54.58 54.51 1pkd n ASN 415 Cb 1.05 -1.34 0.30 0.00 1.24 0.00 0.00 39.78 41.03 1pkd n ASN 415 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1pkd h SER 416 N -2.10 0.75 -0.89 1.20 4.64 -1.93 -2.24 113.55 112.99 1pkd h SER 416 Ca -0.49 -0.02 0.24 0.00 -0.47 0.00 0.00 61.79 61.05 1pkd h SER 416 Cb 1.30 -0.18 -0.15 0.00 -0.31 0.00 0.00 62.40 63.05 1pkd h SER 416 CO 0.42 0.54 0.16 0.50 -0.87 0.00 0.00 176.83 177.58 1pkd h LYS 417 N 0.89 0.13 -0.59 4.77 3.64 -1.94 0.71 116.57 124.17 1pkd h LYS 417 Ca 0.26 -0.01 -0.31 0.00 -1.27 0.00 0.00 60.65 59.32 1pkd h LYS 417 Cb -0.05 -0.03 -0.18 0.00 -0.41 0.00 0.00 32.23 31.56 1pkd h LYS 417 CO -0.06 0.09 0.19 0.66 -2.27 0.00 0.00 179.45 178.06 1pkd n TYR 418 N -5.31 1.83 -2.55 1.91 4.01 -1.05 -4.96 117.16 111.04 1pkd n TYR 418 Ca 0.21 -1.70 -0.11 0.00 -0.16 0.00 0.00 57.90 56.14 1pkd n TYR 418 Cb 0.68 -0.66 -0.00 0.00 -0.31 0.00 0.00 39.34 39.05 1pkd n TYR 418 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1pkd n HIS 419 N -1.12 -1.57 -4.11 -0.72 8.25 0.24 -2.46 115.22 113.73 1pkd n HIS 419 Ca 0.43 0.05 -0.33 0.00 -0.26 0.00 0.00 57.72 57.61 1pkd n HIS 419 Cb 1.28 -2.42 -0.01 0.00 1.12 0.00 0.00 29.99 29.95 1pkd n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pkd n GLY 420 N -0.78 -0.42 0.26 -1.41 0.00 -0.87 -4.88 105.19 97.09 1pkd n GLY 420 Ca -0.10 0.15 0.16 0.00 0.00 0.00 0.00 46.02 46.23 1pkd n GLY 420 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1pkd h VAL 421 N -1.70 0.00 0.00 1.61 -1.51 -1.33 -3.02 116.25 110.30 1pkd h VAL 421 Ca -0.59 -0.62 0.00 0.00 -1.23 0.00 0.00 66.70 64.26 1pkd h VAL 421 Cb 1.38 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.16 1pkd h VAL 421 CO 0.73 0.00 -0.18 -1.54 -1.23 0.00 0.00 177.57 175.35 1pkd n SER 422 N -3.08 0.43 0.00 4.19 3.41 -1.16 -2.93 113.62 114.48 1pkd n SER 422 Ca 0.01 0.34 0.13 0.00 -0.26 0.00 0.00 58.87 59.09 1pkd n SER 422 Cb 0.36 -0.37 0.34 0.00 -0.26 0.00 0.00 64.21 64.28 1pkd n SER 422 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1pkd n LEU 423 N -1.82 0.38 -4.69 1.04 4.77 -1.14 -4.91 117.00 110.62 1pkd n LEU 423 Ca 0.06 0.13 -0.29 0.00 -0.03 0.00 0.00 56.01 55.88 1pkd n LEU 423 Cb 0.38 -0.31 0.16 0.00 -2.33 0.00 0.00 43.42 41.32 1pkd n LEU 423 CO 0.31 0.09 0.65 -0.76 -1.33 0.00 0.00 177.39 176.35 1pkd s LEU 424 N -3.04 2.00 -0.17 2.23 1.43 -1.15 -5.04 118.68 114.94 1pkd s LEU 424 Ca 0.12 1.41 -0.06 0.00 -1.03 0.00 0.00 54.13 54.57 1pkd s LEU 424 Cb 0.18 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.63 1pkd s LEU 424 CO 0.66 -2.88 0.04 0.20 0.23 0.00 0.00 176.35 174.60 1pkd s ASN 425 N -3.37 5.48 0.54 2.29 0.02 -1.26 -5.10 114.94 113.54 1pkd s ASN 425 Ca 0.64 0.06 -0.19 0.00 -1.02 0.00 0.00 52.86 52.35 1pkd s ASN 425 Cb -0.19 -1.90 -0.06 0.00 0.02 0.00 0.00 41.25 39.13 1pkd s ASN 425 CO 0.58 0.20 1.10 -2.16 0.02 0.00 0.00 177.10 176.84 1pkd s PRO 426 N 0.22 3.41 0.75 -0.60 0.04 -1.26 -4.97 135.00 132.58 1pkd s PRO 426 Ca 0.03 1.52 -0.15 0.00 0.04 0.00 0.00 61.00 62.44 1pkd s PRO 426 Cb -0.13 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.44 1pkd s PRO 426 CO 0.01 -0.79 1.24 -2.14 0.04 0.00 0.00 177.00 175.36 1pkd s PRO 427 N -3.37 1.97 0.04 0.56 0.02 -1.26 -4.96 135.00 128.00 1pkd s PRO 427 Ca 0.71 1.89 -0.20 0.00 0.02 0.00 0.00 61.00 63.41 1pkd s PRO 427 Cb -0.22 -1.80 -0.14 0.00 0.02 0.00 0.00 34.50 32.37 1pkd s PRO 427 CO 0.27 -1.99 1.37 1.05 -0.33 0.00 0.00 177.00 177.36 1pkd h GLU 428 N -0.35 0.35 -4.64 5.54 4.11 -2.03 -3.46 114.58 114.10 1pkd h GLU 428 Ca -0.48 -0.17 -0.25 0.00 0.07 0.00 0.00 59.36 58.53 1pkd h GLU 428 Cb 1.31 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.42 1pkd h GLU 428 CO 0.49 0.71 -0.65 0.95 0.07 0.00 0.00 179.01 180.58 1pkd s THR 429 N -4.40 0.39 -0.88 -1.06 -4.23 -1.26 -5.07 115.64 99.13 1pkd s THR 429 Ca -0.14 -1.95 0.22 0.00 -1.18 0.00 0.00 61.69 58.63 1pkd s THR 429 Cb 0.05 -2.17 -0.20 0.00 1.34 0.00 0.00 72.50 71.53 1pkd s THR 429 CO 0.75 -0.39 0.94 0.18 -0.54 0.00 0.00 174.62 175.55 1pkd n LEU 430 N -0.21 0.81 -3.42 4.79 4.77 -1.26 -4.98 117.00 117.50 1pkd n LEU 430 Ca -0.05 -0.35 -0.20 0.00 -0.03 0.00 0.00 56.01 55.38 1pkd n LEU 430 Cb 0.64 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.77 1pkd n LEU 430 CO 0.33 0.19 0.18 0.59 -1.33 0.00 0.00 177.39 177.35 1pkd n ASN 431 N -1.61 -4.30 0.00 -1.43 5.03 -1.26 -5.18 115.26 106.51 1pkd n ASN 431 Ca 0.03 -0.56 0.00 0.00 0.87 0.00 0.00 54.58 54.93 1pkd n ASN 431 Cb 0.36 -4.92 0.00 0.00 -1.02 0.00 0.00 39.78 34.20 1pkd n ASN 431 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32