#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ipd h GLN 190 N 0.00 0.00 -0.23 -1.58 1.08 -2.07 -3.28 115.11 109.03 3ipd h GLN 190 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3ipd h GLN 190 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3ipd h GLN 190 CO 0.00 0.34 0.00 0.00 -0.95 0.00 0.00 178.83 178.22 3ipd n ALA 191 N -2.35 2.49 0.67 3.87 0.00 -1.26 -3.54 120.51 120.38 3ipd n ALA 191 Ca -0.07 -0.65 0.07 0.00 0.00 0.00 0.00 53.44 52.80 3ipd n ALA 191 Cb 0.81 -1.03 -0.08 0.00 0.00 0.00 0.00 19.45 19.15 3ipd n ALA 191 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ipd n LEU 192 N 0.63 0.67 -0.26 0.00 4.77 -1.24 -3.76 117.00 117.82 3ipd n LEU 192 Ca 0.17 -0.49 0.11 0.00 -0.03 0.00 0.00 56.01 55.76 3ipd n LEU 192 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3ipd n LEU 192 CO 0.13 0.17 0.21 -0.24 -1.33 0.00 0.00 177.39 176.34 3ipd n SER 193 N -1.35 1.45 -0.05 -1.43 2.88 -1.23 -3.52 113.62 110.38 3ipd n SER 193 Ca 0.03 -1.18 0.02 0.00 -1.33 0.00 0.00 58.87 56.40 3ipd n SER 193 Cb 0.23 0.63 -0.16 0.00 -0.75 0.00 0.00 64.21 64.15 3ipd n SER 193 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 3ipd n GLU 194 N -0.73 0.67 0.17 -1.46 0.28 -1.24 -3.22 120.64 115.11 3ipd n GLU 194 Ca 0.07 -0.10 0.10 0.00 -0.16 0.00 0.00 57.16 57.07 3ipd n GLU 194 Cb 0.40 -1.53 0.09 0.00 1.43 0.00 0.00 31.44 31.83 3ipd n GLU 194 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 3ipd h ILE 195 N 0.00 0.11 0.00 3.84 2.04 -1.73 -2.22 117.51 119.55 3ipd h ILE 195 Ca -0.24 -1.17 -0.11 0.00 1.00 0.00 0.00 64.86 64.35 3ipd h ILE 195 Cb 1.54 1.89 -0.02 0.00 -0.74 0.00 0.00 36.82 39.49 3ipd h ILE 195 CO 0.01 0.06 -0.58 -0.08 0.00 0.00 0.00 178.15 177.56 3ipd h GLU 196 N 0.00 0.00 0.00 2.37 4.81 -1.69 -2.19 114.58 117.89 3ipd h GLU 196 Ca -0.01 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 3ipd h GLU 196 Cb 1.07 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 3ipd h GLU 196 CO 0.01 0.46 -1.90 2.41 -0.73 0.00 0.00 179.01 179.26 3ipd n THR 197 N -3.18 0.56 -0.01 0.32 -1.04 -1.20 -2.72 114.28 107.01 3ipd n THR 197 Ca 0.01 -0.62 -0.17 0.00 -2.04 0.00 0.00 64.05 61.24 3ipd n THR 197 Cb 0.74 -0.25 -0.13 0.00 -1.82 0.00 0.00 70.33 68.87 3ipd n THR 197 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 3ipd h ARG 198 N 0.00 0.20 -0.97 -2.82 3.08 -1.48 -3.16 114.38 109.23 3ipd h ARG 198 Ca -0.15 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 59.64 3ipd h ARG 198 Cb 1.37 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 31.47 3ipd h ARG 198 CO 0.01 1.05 0.64 1.25 -1.07 0.00 0.00 179.97 181.86 3ipd h HIS 199 N -0.52 1.22 -0.07 3.04 2.76 -1.59 -1.45 115.15 118.55 3ipd h HIS 199 Ca -0.06 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.16 3ipd h HIS 199 Cb 1.22 -0.41 -0.00 0.00 1.55 0.00 0.00 27.41 29.77 3ipd h HIS 199 CO 0.20 0.77 0.26 1.03 -1.30 0.00 0.00 177.93 178.89 3ipd h SER 200 N 1.32 0.00 0.00 3.26 0.87 -1.54 -2.31 113.55 115.16 3ipd h SER 200 Ca 0.36 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.90 3ipd h SER 200 Cb -0.15 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.81 3ipd h SER 200 CO -0.08 0.00 -1.32 -0.62 -0.53 0.00 0.00 176.83 174.29 3ipd n GLU 201 N -3.14 0.64 0.26 2.24 1.02 -0.97 -4.05 120.64 116.63 3ipd n GLU 201 Ca -0.01 -0.05 0.11 0.00 -0.02 0.00 0.00 57.16 57.19 3ipd n GLU 201 Cb 0.33 -1.16 0.69 0.00 -0.02 0.00 0.00 31.44 31.29 3ipd n GLU 201 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3ipd h ILE 202 N 0.00 0.73 0.00 -3.67 2.04 -0.70 0.19 117.51 116.10 3ipd h ILE 202 Ca -0.03 -0.46 -0.21 0.00 1.00 0.00 0.00 64.86 65.15 3ipd h ILE 202 Cb 0.47 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 3ipd h ILE 202 CO 0.00 0.11 -1.31 0.40 0.00 0.00 0.00 178.15 177.35 3ipd h ILE 203 N 0.00 0.94 0.00 -0.67 2.04 -1.74 -1.94 117.51 116.13 3ipd h ILE 203 Ca -0.00 -2.59 0.00 0.00 1.00 0.00 0.00 64.86 63.26 3ipd h ILE 203 Cb 0.27 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 3ipd h ILE 203 CO 0.02 0.53 0.00 0.11 0.00 0.00 0.00 178.15 178.81 3ipd h LYS 204 N 0.00 0.00 0.04 2.37 1.57 -1.31 0.37 116.57 119.61 3ipd h LYS 204 Ca -0.15 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.25 3ipd h LYS 204 Cb 1.76 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 34.02 3ipd h LYS 204 CO 0.08 0.00 -2.28 -0.11 -0.57 0.00 0.00 179.45 176.57 3ipd n LEU 205 N -2.56 2.45 -0.17 2.94 7.94 0.54 -3.75 117.00 124.39 3ipd n LEU 205 Ca 0.02 0.02 -0.09 0.00 -1.11 0.00 0.00 56.01 54.84 3ipd n LEU 205 Cb 0.27 -0.77 0.04 0.00 0.53 0.00 0.00 43.42 43.48 3ipd n LEU 205 CO 0.23 0.84 0.75 -0.08 -1.11 0.00 0.00 177.39 178.01 3ipd h GLU 206 N 0.02 0.98 0.00 1.96 4.81 -1.15 0.22 114.58 121.42 3ipd h GLU 206 Ca -0.51 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 58.34 3ipd h GLU 206 Cb 1.98 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 31.30 3ipd h GLU 206 CO -0.01 1.04 -0.05 -0.91 -0.73 0.00 0.00 179.01 178.35 3ipd h ASN 207 N 0.87 0.00 0.40 1.04 2.35 -1.13 -2.36 115.58 116.75 3ipd h ASN 207 Ca 0.13 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.57 3ipd h ASN 207 Cb 0.68 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 3ipd h ASN 207 CO 0.05 0.05 -1.67 -1.28 -1.65 0.00 0.00 177.43 172.92 3ipd h SER 208 N 0.00 0.28 -0.35 5.81 0.87 -1.52 -3.30 113.55 115.35 3ipd h SER 208 Ca -0.00 -0.48 -0.09 0.00 -1.23 0.00 0.00 61.79 59.99 3ipd h SER 208 Cb 0.62 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 3ipd h SER 208 CO 0.01 1.41 -0.11 0.40 -0.53 0.00 0.00 176.83 178.01 3ipd h ILE 209 N 0.05 1.26 -0.84 2.23 2.04 -0.42 -2.42 117.51 119.40 3ipd h ILE 209 Ca -0.29 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 3ipd h ILE 209 Cb 2.01 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 39.09 3ipd h ILE 209 CO 0.12 0.40 0.52 0.03 0.00 0.00 0.00 178.15 179.22 3ipd h ARG 210 N 0.71 1.13 -0.64 2.37 3.08 -1.57 0.56 114.38 120.02 3ipd h ARG 210 Ca 0.12 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 3ipd h ARG 210 Cb 0.59 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 3ipd h ARG 210 CO 0.04 0.78 0.27 1.49 -1.07 0.00 0.00 179.97 181.48 3ipd h GLU 211 N 1.15 0.92 0.00 0.04 4.81 -1.52 -0.34 114.58 119.64 3ipd h GLU 211 Ca 0.30 -0.14 -0.18 0.00 -0.13 0.00 0.00 59.36 59.21 3ipd h GLU 211 Cb -0.07 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 3ipd h GLU 211 CO -0.06 0.74 -0.86 1.25 -0.73 0.00 0.00 179.01 179.35 3ipd h LEU 212 N 0.91 0.00 0.05 1.64 5.85 -0.95 -2.41 115.31 120.41 3ipd h LEU 212 Ca 0.22 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.95 3ipd h LEU 212 Cb 0.15 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3ipd h LEU 212 CO -0.02 0.86 -0.10 -0.74 -0.34 0.00 0.00 178.44 178.10 3ipd h HIS 213 N 0.00 -0.26 -0.24 1.25 2.76 0.68 -2.58 115.15 116.76 3ipd h HIS 213 Ca -0.01 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 3ipd h HIS 213 Cb 1.67 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 30.72 3ipd h HIS 213 CO 0.00 -0.15 0.03 -0.44 -1.30 0.00 0.00 177.93 176.06 3ipd h ASP 214 N -0.20 0.32 0.27 3.26 5.19 -1.07 -1.55 116.42 122.64 3ipd h ASP 214 Ca 0.02 -0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.36 3ipd h ASP 214 Cb 0.22 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 39.64 3ipd h ASP 214 CO -0.07 0.36 -0.15 0.24 -3.12 0.00 0.00 179.24 176.50 3ipd h MET 215 N 0.34 0.00 0.00 3.56 2.86 -1.05 0.55 114.93 121.19 3ipd h MET 215 Ca 0.08 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.60 3ipd h MET 215 Cb 0.19 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 3ipd h MET 215 CO 0.00 0.15 -1.38 1.19 1.06 0.00 0.00 176.91 177.93 3ipd n PHE 216 N -3.94 0.88 0.05 -0.22 3.01 -0.64 -3.20 117.46 113.39 3ipd n PHE 216 Ca -0.02 0.28 -0.02 0.00 1.01 0.00 0.00 57.45 58.70 3ipd n PHE 216 Cb 0.24 -1.01 -0.07 0.00 -0.01 0.00 0.00 39.48 38.62 3ipd n PHE 216 CO 0.00 0.00 0.00 0.52 1.01 0.00 0.00 176.76 178.29 3ipd h MET 217 N 0.00 0.00 0.00 -1.08 2.86 -1.08 -2.42 114.93 113.21 3ipd h MET 217 Ca -0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3ipd h MET 217 Cb 1.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.07 3ipd h MET 217 CO 0.03 0.47 0.00 -0.25 1.06 0.00 0.00 176.91 178.22 3ipd n ASP 218 N -3.05 0.00 -0.08 1.22 9.92 0.19 -2.78 116.55 121.96 3ipd n ASP 218 Ca -0.07 -0.60 -0.15 0.00 -0.53 0.00 0.00 54.79 53.44 3ipd n ASP 218 Cb 0.86 -0.08 -0.07 0.00 -0.64 0.00 0.00 41.12 41.20 3ipd n ASP 218 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 3ipd n MET 219 N -1.08 0.39 0.00 -1.24 1.56 -1.18 -3.84 117.12 111.74 3ipd n MET 219 Ca 0.17 0.13 0.05 0.00 -0.27 0.00 0.00 57.70 57.77 3ipd n MET 219 Cb 0.12 -1.23 0.22 0.00 2.15 0.00 0.00 33.22 34.47 3ipd n MET 219 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3ipd n ALA 220 N -3.35 1.49 -0.03 -5.12 0.00 -0.92 -1.90 120.51 110.69 3ipd n ALA 220 Ca -0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.07 3ipd n ALA 220 Cb 0.78 -1.16 -0.01 0.00 0.00 0.00 0.00 19.45 19.06 3ipd n ALA 220 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 3ipd h MET 221 N 0.00 0.00 -0.08 0.00 -1.53 -1.72 -3.26 114.93 108.34 3ipd h MET 221 Ca 0.00 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.26 3ipd h MET 221 Cb 0.15 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.19 3ipd h MET 221 CO 0.00 0.00 0.04 -0.07 0.14 0.00 0.00 176.91 177.02 3ipd h LEU 222 N -0.52 0.09 0.10 3.39 4.07 -1.65 0.53 115.31 121.32 3ipd h LEU 222 Ca 0.00 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 3ipd h LEU 222 Cb 0.21 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.93 3ipd h LEU 222 CO 0.00 0.08 -0.05 0.58 -1.08 0.00 0.00 178.44 177.97 3ipd h VAL 223 N 0.11 1.01 -0.19 1.22 2.07 -1.60 -2.25 116.25 116.62 3ipd h VAL 223 Ca 0.03 -1.36 -0.07 0.00 0.82 0.00 0.00 66.70 66.12 3ipd h VAL 223 Cb 0.01 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3ipd h VAL 223 CO -0.00 0.28 -0.18 -0.08 0.02 0.00 0.00 177.57 177.61 3ipd h GLU 224 N -0.87 0.33 -0.65 1.57 4.81 -1.53 -0.11 114.58 118.13 3ipd h GLU 224 Ca -0.01 -0.10 -0.07 0.00 -0.13 0.00 0.00 59.36 59.05 3ipd h GLU 224 Cb 0.57 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 3ipd h GLU 224 CO 0.02 0.51 0.12 1.03 -0.73 0.00 0.00 179.01 179.97 3ipd h SER 225 N 0.31 1.02 0.65 1.04 0.87 -0.03 -0.43 113.55 116.98 3ipd h SER 225 Ca 0.06 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 3ipd h SER 225 Cb 0.50 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 3ipd h SER 225 CO 0.03 1.01 0.00 0.00 -0.53 0.00 0.00 176.83 177.35 3ipd n GLN 226 N -4.26 0.10 0.16 2.24 6.02 -0.76 -2.82 117.38 118.06 3ipd n GLN 226 Ca 0.04 0.11 0.01 0.00 -0.01 0.00 0.00 57.00 57.15 3ipd n GLN 226 Cb 0.28 -1.50 0.32 0.00 1.02 0.00 0.00 30.24 30.36 3ipd n GLN 226 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 3ipd h GLY 227 N 3.76 0.09 2.00 1.08 0.00 0.72 -1.58 103.07 109.14 3ipd h GLY 227 Ca 0.00 -0.07 -0.11 0.00 0.00 0.00 0.00 47.33 47.15 3ipd h GLY 227 CO 0.00 0.07 -0.50 0.83 0.00 0.00 0.00 176.54 176.94 3ipd h GLU 228 N 0.07 0.00 0.00 4.80 5.08 -1.52 -3.19 114.58 119.82 3ipd h GLU 228 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3ipd h GLU 228 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3ipd h GLU 228 CO 0.05 0.50 -0.17 -0.12 -1.00 0.00 0.00 179.01 178.28 3ipd n MET 229 N -3.45 0.25 -0.02 2.33 1.56 -0.66 -3.60 117.12 113.53 3ipd n MET 229 Ca 0.00 0.17 -0.22 0.00 -0.27 0.00 0.00 57.70 57.38 3ipd n MET 229 Cb 0.63 -1.75 -0.13 0.00 2.15 0.00 0.00 33.22 34.11 3ipd n MET 229 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 3ipd h ILE 230 N 0.00 0.72 -0.34 1.12 2.04 -1.39 -3.29 117.51 116.37 3ipd h ILE 230 Ca 0.00 -2.31 0.08 0.00 1.00 0.00 0.00 64.86 63.63 3ipd h ILE 230 Cb 0.72 2.45 -0.02 0.00 -0.74 0.00 0.00 36.82 39.24 3ipd h ILE 230 CO 0.00 0.75 0.24 0.44 0.00 0.00 0.00 178.15 179.58 3ipd h ASP 231 N -0.21 0.08 1.05 1.72 3.32 -1.64 0.39 116.42 121.13 3ipd h ASP 231 Ca -0.40 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.55 3ipd h ASP 231 Cb 1.85 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 41.37 3ipd h ASP 231 CO 0.02 0.05 -0.51 0.03 -1.72 0.00 0.00 179.24 177.11 3ipd h ARG 232 N 0.09 0.00 0.00 3.56 3.08 -1.71 0.28 114.38 119.69 3ipd h ARG 232 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3ipd h ARG 232 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3ipd h ARG 232 CO -0.01 0.51 -0.34 0.82 -1.07 0.00 0.00 179.97 179.87 3ipd h ILE 233 N 0.00 0.00 0.00 2.04 2.04 -0.46 -1.92 117.51 119.21 3ipd h ILE 233 Ca -0.01 -0.54 -0.13 0.00 1.00 0.00 0.00 64.86 65.18 3ipd h ILE 233 Cb 1.17 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 3ipd h ILE 233 CO 0.07 0.00 -0.81 -0.08 0.00 0.00 0.00 178.15 177.32 3ipd h GLU 234 N 0.00 0.00 -0.47 2.37 4.81 -0.45 -3.10 114.58 117.74 3ipd h GLU 234 Ca 0.00 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 3ipd h GLU 234 Cb 0.77 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.05 3ipd h GLU 234 CO 0.00 0.70 -0.26 -0.92 -0.73 0.00 0.00 179.01 177.80 3ipd h TYR 235 N -1.00 -0.69 -0.16 0.92 3.20 -0.55 0.47 116.97 119.15 3ipd h TYR 235 Ca -0.19 0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.71 3ipd h TYR 235 Cb 0.99 0.38 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 3ipd h TYR 235 CO 0.05 -0.34 0.00 -0.91 -1.64 0.00 0.00 178.16 175.32 3ipd h ASN 236 N -0.16 0.20 0.12 -2.11 2.35 -1.52 -2.23 115.58 112.23 3ipd h ASN 236 Ca 0.21 -0.02 -0.17 0.00 -0.55 0.00 0.00 56.30 55.77 3ipd h ASN 236 Cb 0.50 -0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.83 3ipd h ASN 236 CO -0.56 0.24 -0.78 0.58 -1.65 0.00 0.00 177.43 175.26 3ipd h VAL 237 N 0.22 1.49 0.00 2.81 2.07 -1.09 -1.06 116.25 120.69 3ipd h VAL 237 Ca 0.05 -2.49 -0.01 0.00 0.82 0.00 0.00 66.70 65.07 3ipd h VAL 237 Cb 0.15 3.16 -0.00 0.00 -1.52 0.00 0.00 31.29 33.08 3ipd h VAL 237 CO 0.00 0.69 -0.07 -0.33 0.02 0.00 0.00 177.57 177.88 3ipd h GLU 238 N -0.47 0.00 0.12 1.57 5.08 -0.00 1.48 114.58 122.35 3ipd h GLU 238 Ca -0.14 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.00 3ipd h GLU 238 Cb 1.56 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.82 3ipd h GLU 238 CO 0.11 0.07 -1.03 0.45 -1.00 0.00 0.00 179.01 177.61 3ipd h HIS 239 N 0.00 0.45 0.00 4.33 3.86 -1.49 -2.85 115.15 119.46 3ipd h HIS 239 Ca -0.00 -0.33 -0.03 0.00 -1.16 0.00 0.00 60.37 58.85 3ipd h HIS 239 Cb 0.19 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 28.64 3ipd h HIS 239 CO 0.00 1.40 -0.15 0.00 0.86 0.00 0.00 177.93 180.04 3ipd h ALA 240 N 0.00 1.41 -0.12 2.45 0.00 -0.08 0.41 119.26 123.33 3ipd h ALA 240 Ca -0.21 -0.14 -0.23 0.00 0.00 0.00 0.00 54.91 54.33 3ipd h ALA 240 Cb 1.64 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.42 3ipd h ALA 240 CO 0.09 0.19 -0.84 0.28 0.00 0.00 0.00 179.25 178.97 3ipd h VAL 241 N 0.00 1.28 -0.07 0.00 2.07 0.19 -3.12 116.25 116.60 3ipd h VAL 241 Ca -0.00 -2.03 -0.21 0.00 0.82 0.00 0.00 66.70 65.28 3ipd h VAL 241 Cb 0.34 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 3ipd h VAL 241 CO 0.02 0.64 -0.81 -0.78 0.02 0.00 0.00 177.57 176.66 3ipd h ASP 242 N 0.51 0.64 -0.84 0.57 3.58 -1.03 -2.01 116.42 117.84 3ipd h ASP 242 Ca -0.07 -0.45 0.03 0.00 0.42 0.00 0.00 57.03 56.96 3ipd h ASP 242 Cb 1.47 -0.19 -0.05 0.00 1.72 0.00 0.00 39.33 42.28 3ipd h ASP 242 CO 0.17 1.22 0.55 1.88 -2.88 0.00 0.00 179.24 180.19 3ipd h TYR 243 N 0.34 1.02 -0.00 0.28 0.05 -0.30 -0.80 116.97 117.56 3ipd h TYR 243 Ca -0.05 0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.60 3ipd h TYR 243 Cb 1.42 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 3ipd h TYR 243 CO 0.06 0.60 -0.72 0.28 -1.05 0.00 0.00 178.16 177.33 3ipd h VAL 244 N 1.06 1.50 -0.55 -2.88 2.07 -1.47 0.78 116.25 116.78 3ipd h VAL 244 Ca 0.33 -2.43 -0.05 0.00 0.82 0.00 0.00 66.70 65.37 3ipd h VAL 244 Cb 0.00 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 3ipd h VAL 244 CO -0.09 0.70 0.15 -0.08 0.02 0.00 0.00 177.57 178.26 3ipd h GLU 245 N 0.02 0.86 0.04 1.57 4.81 -0.41 -2.28 114.58 119.20 3ipd h GLU 245 Ca -0.01 -0.20 -0.10 0.00 -0.13 0.00 0.00 59.36 58.92 3ipd h GLU 245 Cb 1.27 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.54 3ipd h GLU 245 CO 0.10 0.80 -0.41 0.00 -0.73 0.00 0.00 179.01 178.77 3ipd h ARG 246 N 0.77 0.20 0.00 1.92 3.08 -1.33 -3.22 114.38 115.80 3ipd h ARG 246 Ca 0.17 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.95 3ipd h ARG 246 Cb 0.32 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3ipd h ARG 246 CO -0.00 1.06 0.21 0.00 -1.07 0.00 0.00 179.97 180.17 3ipd h ALA 247 N 0.16 1.18 0.01 0.04 0.00 -0.74 0.15 119.26 120.05 3ipd h ALA 247 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.48 3ipd h ALA 247 Cb 1.24 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 3ipd h ALA 247 CO 0.08 -0.18 -2.28 1.55 0.00 0.00 0.00 179.25 178.42 3ipd n VAL 248 N -2.57 1.47 0.14 0.00 3.14 -0.87 -3.90 118.33 115.75 3ipd n VAL 248 Ca -0.02 -0.77 0.03 0.00 -2.96 0.00 0.00 64.34 60.62 3ipd n VAL 248 Cb 0.25 -0.85 0.42 0.00 -1.06 0.00 0.00 33.84 32.60 3ipd n VAL 248 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 3ipd h SER 249 N 0.00 0.18 0.64 6.55 4.64 -0.75 -1.85 113.55 122.96 3ipd h SER 249 Ca -0.51 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 60.62 3ipd h SER 249 Cb 2.12 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 64.15 3ipd h SER 249 CO 0.01 0.32 -0.72 0.44 -0.87 0.00 0.00 176.83 176.02 3ipd h ASP 250 N 0.18 0.08 0.55 4.97 5.19 -1.48 -2.70 116.42 123.21 3ipd h ASP 250 Ca 0.04 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 3ipd h ASP 250 Cb 0.33 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.82 3ipd h ASP 250 CO 0.02 0.77 0.00 0.71 -3.12 0.00 0.00 179.24 177.62 3ipd h THR 251 N 0.04 0.00 0.00 0.35 1.35 -1.45 0.12 112.91 113.31 3ipd h THR 251 Ca -0.01 -0.20 -0.06 0.00 -0.55 0.00 0.00 66.41 65.59 3ipd h THR 251 Cb 1.27 0.92 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 3ipd h THR 251 CO 0.10 0.00 -0.49 0.50 -0.25 0.00 0.00 175.52 175.38 3ipd h LYS 252 N 0.00 0.00 -0.48 4.72 3.64 -1.30 -3.27 116.57 119.87 3ipd h LYS 252 Ca 0.00 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.52 3ipd h LYS 252 Cb 0.28 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 3ipd h LYS 252 CO 0.00 0.45 0.41 0.87 -2.27 0.00 0.00 179.45 178.91 3ipd h LYS 253 N -1.00 0.00 -1.53 1.90 1.57 -1.46 -0.95 116.57 115.10 3ipd h LYS 253 Ca -0.09 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.38 3ipd h LYS 253 Cb 0.69 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.87 3ipd h LYS 253 CO -0.06 0.00 0.40 0.00 -0.57 0.00 0.00 179.45 179.22 3ipd n ALA 254 N -2.50 5.03 -1.17 3.86 0.00 0.39 -2.80 120.51 123.32 3ipd n ALA 254 Ca 0.09 -1.57 0.00 0.00 0.00 0.00 0.00 53.44 51.96 3ipd n ALA 254 Cb 0.61 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3ipd n ALA 254 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3ipd n VAL 255 N 0.39 0.00 0.08 0.00 0.24 -0.38 -4.89 118.33 113.78 3ipd n VAL 255 Ca 0.28 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.50 3ipd n VAL 255 Cb 0.58 0.44 -0.06 0.00 -1.47 0.00 0.00 33.84 33.34 3ipd n VAL 255 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3ipd h LYS 256 N 0.00 -0.29 0.00 7.34 3.64 -1.35 -3.32 116.57 122.59 3ipd h LYS 256 Ca 0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3ipd h LYS 256 Cb 0.23 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3ipd h LYS 256 CO 0.00 0.02 0.00 0.66 -2.27 0.00 0.00 179.45 177.86 3ipd n TYR 257 N -4.97 0.00 -0.07 1.91 0.53 -1.25 -2.64 117.16 110.67 3ipd n TYR 257 Ca -0.07 0.00 -0.09 0.00 -1.02 0.00 0.00 57.90 56.72 3ipd n TYR 257 Cb 0.22 -0.06 -0.07 0.00 -1.03 0.00 0.00 39.34 38.41 3ipd n TYR 257 CO 0.00 0.00 0.00 0.37 -1.02 0.00 0.00 176.86 176.21 3ipd h GLN 258 N 0.00 0.00 -0.15 -0.72 4.15 -1.91 0.78 115.11 117.26 3ipd h GLN 258 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 3ipd h GLN 258 Cb 0.02 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 3ipd h GLN 258 CO 0.00 0.57 0.09 0.66 -1.93 0.00 0.00 178.83 178.22 3ipd h SER 259 N -1.00 0.18 0.91 -0.69 4.64 -1.70 1.26 113.55 117.16 3ipd h SER 259 Ca -0.04 -0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.12 3ipd h SER 259 Cb 0.65 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 3ipd h SER 259 CO -0.02 0.14 -0.75 0.11 -0.87 0.00 0.00 176.83 175.44 3ipd h LYS 260 N 0.21 0.00 0.00 4.77 1.57 -1.45 -1.38 116.57 120.29 3ipd h LYS 260 Ca 0.06 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3ipd h LYS 260 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 3ipd h LYS 260 CO -0.01 0.75 -0.11 0.00 -0.57 0.00 0.00 179.45 179.51 3ipd h ALA 261 N 1.25 0.02 -0.93 3.86 0.00 0.12 -2.85 119.26 120.73 3ipd h ALA 261 Ca -0.01 -0.34 0.24 0.00 0.00 0.00 0.00 54.91 54.81 3ipd h ALA 261 Cb 1.41 0.08 -0.17 0.00 0.00 0.00 0.00 17.79 19.11 3ipd h ALA 261 CO 0.10 0.08 0.04 -0.09 0.00 0.00 0.00 179.25 179.38 3ipd h ARG 262 N -1.00 0.05 0.39 0.00 2.43 0.15 1.06 114.38 117.47 3ipd h ARG 262 Ca -0.02 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 3ipd h ARG 262 Cb 0.57 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 3ipd h ARG 262 CO -0.01 0.03 -0.20 0.00 -1.51 0.00 0.00 179.97 178.28 3ipd h ARG 263 N 0.05 -0.52 0.00 0.20 3.08 -1.38 -1.42 114.38 114.39 3ipd h ARG 263 Ca 0.55 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.64 3ipd h ARG 263 Cb 1.10 0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3ipd h ARG 263 CO -0.84 -0.35 0.14 1.63 -1.07 0.00 0.00 179.97 179.48 3ipd n LYS 264 N -3.51 0.07 -0.04 0.04 5.02 -0.02 -0.13 118.16 119.59 3ipd n LYS 264 Ca -0.07 0.51 -0.20 0.00 -2.02 0.00 0.00 58.31 56.54 3ipd n LYS 264 Cb 0.22 -1.85 -0.13 0.00 -0.02 0.00 0.00 35.03 33.24 3ipd n LYS 264 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3ipd n LYS 265 N -1.83 0.72 0.14 1.97 4.81 0.35 -3.65 118.16 120.67 3ipd n LYS 265 Ca -0.01 0.22 0.12 0.00 -0.87 0.00 0.00 58.31 57.77 3ipd n LYS 265 Cb 0.15 -1.64 0.14 0.00 0.02 0.00 0.00 35.03 33.70 3ipd n LYS 265 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 3ipd h ILE 266 N 0.05 0.00 -0.03 3.15 2.04 -0.12 -0.69 117.51 121.91 3ipd h ILE 266 Ca -0.48 -0.87 -0.10 0.00 1.00 0.00 0.00 64.86 64.41 3ipd h ILE 266 Cb 1.99 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 39.68 3ipd h ILE 266 CO 0.03 0.00 -0.44 0.24 0.00 0.00 0.00 178.15 177.97 3ipd h MET 267 N 0.00 0.07 0.18 2.37 2.86 -0.71 0.48 114.93 120.18 3ipd h MET 267 Ca 0.00 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3ipd h MET 267 Cb 0.93 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.59 3ipd h MET 267 CO 0.00 0.50 -0.08 0.82 1.06 0.00 0.00 176.91 179.21 3ipd h ILE 268 N 0.06 0.89 -0.02 -1.22 2.04 -1.57 -2.56 117.51 115.14 3ipd h ILE 268 Ca 0.00 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.87 3ipd h ILE 268 Cb 0.81 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 38.32 3ipd h ILE 268 CO 0.06 0.21 0.12 0.40 0.00 0.00 0.00 178.15 178.93 3ipd h ILE 269 N -0.78 0.07 0.35 -0.67 2.04 -0.82 0.31 117.51 118.00 3ipd h ILE 269 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 3ipd h ILE 269 Cb 0.52 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3ipd h ILE 269 CO 0.04 0.00 -0.17 0.40 0.00 0.00 0.00 178.15 178.42 3ipd h ILE 270 N 0.00 0.40 0.00 -0.67 2.04 -0.04 -3.15 117.51 116.09 3ipd h ILE 270 Ca 0.01 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.14 3ipd h ILE 270 Cb 0.24 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 3ipd h ILE 270 CO -0.00 0.09 0.00 0.00 0.00 0.00 0.00 178.15 178.24 3ipd h VAL 273 N -0.71 0.52 -0.68 0.00 2.07 -1.52 0.35 116.25 116.28 3ipd h VAL 273 Ca 0.00 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 3ipd h VAL 273 Cb 0.70 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3ipd h VAL 273 CO 0.00 0.01 0.26 0.40 0.02 0.00 0.00 177.57 178.26 3ipd h ILE 274 N 0.07 1.24 0.00 4.57 2.04 -1.56 -2.63 117.51 121.24 3ipd h ILE 274 Ca 0.48 -0.78 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 3ipd h ILE 274 Cb 1.78 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 3ipd h ILE 274 CO -0.05 0.31 -0.41 -0.07 0.00 0.00 0.00 178.15 177.93 3ipd h LEU 275 N 0.96 0.00 -0.25 1.44 3.38 -0.43 -2.58 115.31 117.83 3ipd h LEU 275 Ca 0.22 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 3ipd h LEU 275 Cb 0.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3ipd h LEU 275 CO -0.02 0.41 -0.59 1.23 0.09 0.00 0.00 178.44 179.56 3ipd h GLY 276 N 2.59 0.00 -0.28 0.83 0.00 -0.95 -2.39 103.07 102.87 3ipd h GLY 276 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ipd h GLY 276 CO 0.05 0.00 -0.66 1.39 0.00 0.00 0.00 176.54 177.32 3ipd n ILE 277 N -3.35 0.00 0.48 2.60 5.41 -1.01 -1.54 119.36 121.95 3ipd n ILE 277 Ca 0.01 -0.12 0.12 0.00 1.00 0.00 0.00 62.75 63.76 3ipd n ILE 277 Cb 0.73 0.96 0.15 0.00 -0.71 0.00 0.00 39.64 40.77 3ipd n ILE 277 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3ipd h ILE 278 N 1.11 0.00 0.00 1.39 2.04 -1.35 -3.31 117.51 117.39 3ipd h ILE 278 Ca 0.00 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3ipd h ILE 278 Cb 0.60 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3ipd h ILE 278 CO 0.00 0.00 -0.61 -0.38 0.00 0.00 0.00 178.15 177.16 3ipd n ILE 279 N -2.25 0.00 0.95 -0.67 5.41 -0.91 -4.29 119.36 117.61 3ipd n ILE 279 Ca 0.03 -0.28 0.05 0.00 1.00 0.00 0.00 62.75 63.55 3ipd n ILE 279 Cb 0.46 0.83 0.14 0.00 -0.71 0.00 0.00 39.64 40.37 3ipd n ILE 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ipd n ALA 280 N -1.33 2.46 0.30 -1.39 0.00 -0.59 -3.46 120.51 116.50 3ipd n ALA 280 Ca 0.01 -0.57 0.03 0.00 0.00 0.00 0.00 53.44 52.90 3ipd n ALA 280 Cb 0.14 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 3ipd n ALA 280 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3ipd n SER 281 N 0.45 0.55 -1.26 0.00 3.41 -1.25 -3.36 113.62 112.15 3ipd n SER 281 Ca 0.11 -0.77 0.09 0.00 -0.26 0.00 0.00 58.87 58.03 3ipd n SER 281 Cb 0.28 0.81 0.29 0.00 -0.26 0.00 0.00 64.21 65.32 3ipd n SER 281 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3ipd n THR 282 N -0.85 1.19 0.00 6.66 -2.24 -1.22 -2.97 114.28 114.85 3ipd n THR 282 Ca 0.02 -0.90 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 3ipd n THR 282 Cb 0.11 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 3ipd n THR 282 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3ipd n ILE 283 N 1.09 0.00 0.62 2.28 5.41 -1.25 -4.26 119.36 123.24 3ipd n ILE 283 Ca 0.21 -0.04 0.12 0.00 1.00 0.00 0.00 62.75 64.04 3ipd n ILE 283 Cb 0.65 0.46 0.19 0.00 -0.71 0.00 0.00 39.64 40.22 3ipd n ILE 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ipd n GLY 284 N 1.84 1.38 2.19 7.39 0.00 -1.21 -4.12 105.19 112.66 3ipd n GLY 284 Ca 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 46.02 45.33 3ipd n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ipd n GLY 285 N 1.44 1.41 3.48 -0.02 0.00 -1.16 -5.02 105.19 105.31 3ipd n GLY 285 Ca 0.17 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3ipd n GLY 285 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71