#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hd7 h GLN 190 N 0.00 0.08 0.00 -1.58 5.75 -2.06 -2.92 115.11 114.38 3hd7 h GLN 190 Ca 0.00 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.36 3hd7 h GLN 190 Cb 0.00 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.60 3hd7 h GLN 190 CO 0.00 1.04 -0.02 0.00 -2.65 0.00 0.00 178.83 177.20 3hd7 h ALA 191 N 0.05 1.94 -0.15 3.38 0.00 -2.06 -1.91 119.26 120.51 3hd7 h ALA 191 Ca -0.03 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 3hd7 h ALA 191 Cb 1.14 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.94 3hd7 h ALA 191 CO 0.04 0.03 -0.79 1.25 0.00 0.00 0.00 179.25 179.78 3hd7 h LEU 192 N 0.00 0.94 -1.60 0.00 6.46 -2.00 -2.65 115.31 116.47 3hd7 h LEU 192 Ca -0.00 -0.62 -0.04 0.00 -0.12 0.00 0.00 57.88 57.09 3hd7 h LEU 192 Cb 0.04 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 3hd7 h LEU 192 CO 0.00 1.42 -0.21 -1.28 -0.62 0.00 0.00 178.44 177.76 3hd7 h SER 193 N 0.54 0.00 0.62 1.25 0.87 -1.16 -0.94 113.55 114.73 3hd7 h SER 193 Ca -0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 3hd7 h SER 193 Cb 1.42 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.38 3hd7 h SER 193 CO 0.16 0.21 -0.63 -1.84 -0.53 0.00 0.00 176.83 174.20 3hd7 n GLU 194 N -3.80 0.15 -0.05 2.24 0.28 -0.93 -3.48 120.64 115.05 3hd7 n GLU 194 Ca -0.02 0.03 -0.21 0.00 -0.16 0.00 0.00 57.16 56.80 3hd7 n GLU 194 Cb 0.31 -1.58 -0.13 0.00 1.43 0.00 0.00 31.44 31.47 3hd7 n GLU 194 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 3hd7 h ILE 195 N 0.00 0.97 0.00 3.84 2.04 -1.01 -3.12 117.51 120.22 3hd7 h ILE 195 Ca 0.00 -2.28 0.00 0.00 1.00 0.00 0.00 64.86 63.58 3hd7 h ILE 195 Cb 0.62 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 3hd7 h ILE 195 CO 0.00 0.55 0.08 -0.08 0.00 0.00 0.00 178.15 178.71 3hd7 h GLU 196 N -0.61 0.00 0.20 2.37 4.81 -1.34 0.14 114.58 120.15 3hd7 h GLU 196 Ca -0.32 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.59 3hd7 h GLU 196 Cb 1.54 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.94 3hd7 h GLU 196 CO -0.06 0.00 -1.49 1.15 -0.73 0.00 0.00 179.01 177.88 3hd7 h THR 197 N 0.00 1.16 0.59 0.32 2.02 -1.66 -2.69 112.91 112.66 3hd7 h THR 197 Ca 0.00 -2.58 -0.03 0.00 0.77 0.00 0.00 66.41 64.57 3hd7 h THR 197 Cb 0.17 2.93 0.01 0.00 -1.74 0.00 0.00 68.15 69.52 3hd7 h THR 197 CO 0.00 0.80 -0.29 0.03 0.37 0.00 0.00 175.52 176.44 3hd7 h ARG 198 N 0.02 -0.77 -0.84 6.66 3.08 -1.16 -2.75 114.38 118.61 3hd7 h ARG 198 Ca -0.28 0.05 0.20 0.00 0.07 0.00 0.00 59.98 60.02 3hd7 h ARG 198 Cb 2.04 0.17 -0.12 0.00 0.08 0.00 0.00 29.97 32.14 3hd7 h ARG 198 CO 0.20 -0.46 0.32 1.25 -1.07 0.00 0.00 179.97 180.21 3hd7 h HIS 199 N -1.11 0.53 -0.67 3.04 2.76 -0.95 0.55 115.15 119.29 3hd7 h HIS 199 Ca -0.08 0.04 0.04 0.00 -2.20 0.00 0.00 60.37 58.17 3hd7 h HIS 199 Cb 0.66 -0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.47 3hd7 h HIS 199 CO 0.01 -0.05 0.41 1.03 -1.30 0.00 0.00 177.93 178.03 3hd7 h SER 200 N 0.37 0.65 0.64 3.26 0.87 -1.50 -2.77 113.55 115.07 3hd7 h SER 200 Ca 0.51 0.01 -0.27 0.00 -1.23 0.00 0.00 61.79 60.80 3hd7 h SER 200 Cb 0.92 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 3hd7 h SER 200 CO -0.52 0.45 -1.31 -0.33 -0.53 0.00 0.00 176.83 174.59 3hd7 h GLU 201 N 0.79 0.20 -0.15 2.24 5.08 -0.63 -2.93 114.58 119.18 3hd7 h GLU 201 Ca 0.28 -0.34 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 3hd7 h GLU 201 Cb 0.07 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3hd7 h GLU 201 CO -0.13 1.11 0.13 0.82 -1.00 0.00 0.00 179.01 179.93 3hd7 h ILE 202 N 0.05 0.77 0.16 3.13 2.04 0.08 0.58 117.51 124.33 3hd7 h ILE 202 Ca -0.15 0.00 -0.32 0.00 1.00 0.00 0.00 64.86 65.39 3hd7 h ILE 202 Cb 1.95 0.91 0.01 0.00 -0.74 0.00 0.00 36.82 38.95 3hd7 h ILE 202 CO 0.17 0.00 -1.53 0.40 0.00 0.00 0.00 178.15 177.19 3hd7 h ILE 203 N 0.00 1.18 -0.53 -0.67 2.04 -1.54 -2.66 117.51 115.33 3hd7 h ILE 203 Ca 0.07 -2.75 0.15 0.00 1.00 0.00 0.00 64.86 63.33 3hd7 h ILE 203 Cb 0.32 2.84 -0.02 0.00 -0.74 0.00 0.00 36.82 39.22 3hd7 h ILE 203 CO -0.00 0.84 0.39 0.11 0.00 0.00 0.00 178.15 179.49 3hd7 h LYS 204 N 0.09 0.00 -0.03 2.37 1.57 -0.99 0.35 116.57 119.94 3hd7 h LYS 204 Ca -0.25 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.47 3hd7 h LYS 204 Cb 2.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.37 3hd7 h LYS 204 CO 0.19 0.00 -0.19 1.25 -0.57 0.00 0.00 179.45 180.14 3hd7 h LEU 205 N 0.00 0.22 0.35 2.94 5.85 -0.92 -3.07 115.31 120.68 3hd7 h LEU 205 Ca 0.25 -0.68 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 3hd7 h LEU 205 Cb 1.03 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.99 3hd7 h LEU 205 CO -0.00 0.87 -0.21 -0.08 -0.34 0.00 0.00 178.44 178.67 3hd7 h GLU 206 N -0.42 -0.52 -0.19 1.25 4.81 -0.80 -0.72 114.58 117.98 3hd7 h GLU 206 Ca -0.02 0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.31 3hd7 h GLU 206 Cb 0.87 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 3hd7 h GLU 206 CO 0.04 -0.34 0.19 -0.91 -0.73 0.00 0.00 179.01 177.25 3hd7 h ASN 207 N -0.54 0.00 1.37 1.04 2.35 -1.13 0.32 115.58 118.99 3hd7 h ASN 207 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 3hd7 h ASN 207 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3hd7 h ASN 207 CO 0.04 0.00 -0.46 -1.28 -1.65 0.00 0.00 177.43 174.08 3hd7 h SER 208 N 0.00 0.00 0.20 5.81 0.87 -1.33 -3.18 113.55 115.92 3hd7 h SER 208 Ca 0.09 -0.04 -0.32 0.00 -1.23 0.00 0.00 61.79 60.29 3hd7 h SER 208 Cb 0.47 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.45 3hd7 h SER 208 CO -0.00 0.02 -1.53 0.40 -0.53 0.00 0.00 176.83 175.19 3hd7 h ILE 209 N 0.00 1.13 -0.79 2.23 2.04 0.11 -3.00 117.51 119.23 3hd7 h ILE 209 Ca 0.00 -2.57 0.09 0.00 1.00 0.00 0.00 64.86 63.38 3hd7 h ILE 209 Cb 0.91 2.90 -0.07 0.00 -0.74 0.00 0.00 36.82 39.83 3hd7 h ILE 209 CO 0.00 0.81 0.44 0.03 0.00 0.00 0.00 178.15 179.43 3hd7 h ARG 210 N 0.03 0.74 -0.84 2.37 3.08 -1.32 0.34 114.38 118.78 3hd7 h ARG 210 Ca -0.29 -0.04 0.10 0.00 0.07 0.00 0.00 59.98 59.81 3hd7 h ARG 210 Cb 2.05 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 31.86 3hd7 h ARG 210 CO 0.20 0.49 0.49 1.49 -1.07 0.00 0.00 179.97 181.56 3hd7 h GLU 211 N 0.76 0.79 0.00 0.04 4.81 -1.60 0.20 114.58 119.57 3hd7 h GLU 211 Ca 0.38 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.48 3hd7 h GLU 211 Cb 0.33 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 3hd7 h GLU 211 CO -0.24 0.52 -0.37 1.25 -0.73 0.00 0.00 179.01 179.45 3hd7 h LEU 212 N 0.81 0.00 -0.28 1.64 5.85 -0.97 -2.76 115.31 119.60 3hd7 h LEU 212 Ca 0.41 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.07 3hd7 h LEU 212 Cb 0.38 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 3hd7 h LEU 212 CO -0.25 0.37 -0.04 -0.74 -0.34 0.00 0.00 178.44 177.44 3hd7 h HIS 213 N 0.00 0.58 -0.41 1.25 2.76 0.16 -2.71 115.15 116.78 3hd7 h HIS 213 Ca -0.00 -0.12 -0.13 0.00 -2.20 0.00 0.00 60.37 57.92 3hd7 h HIS 213 Cb 0.99 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.79 3hd7 h HIS 213 CO 0.00 0.70 -0.26 -0.44 -1.30 0.00 0.00 177.93 176.63 3hd7 h ASP 214 N 0.29 0.90 -0.75 3.26 3.32 -1.20 0.27 116.42 122.50 3hd7 h ASP 214 Ca 0.07 -0.35 0.15 0.00 0.02 0.00 0.00 57.03 56.93 3hd7 h ASP 214 Cb 0.50 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 3hd7 h ASP 214 CO 0.02 1.11 0.50 0.24 -1.72 0.00 0.00 179.24 179.39 3hd7 h MET 215 N 0.74 0.36 0.03 3.56 2.86 -1.43 0.58 114.93 121.64 3hd7 h MET 215 Ca 0.09 -0.02 -0.29 0.00 -2.06 0.00 0.00 59.70 57.42 3hd7 h MET 215 Cb 0.82 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.36 3hd7 h MET 215 CO 0.07 0.24 -1.62 0.74 1.06 0.00 0.00 176.91 177.40 3hd7 h PHE 216 N 0.38 0.13 0.02 -0.22 -1.00 -1.05 -3.06 116.94 112.13 3hd7 h PHE 216 Ca 0.37 -0.09 -0.00 0.00 2.81 0.00 0.00 57.97 61.05 3hd7 h PHE 216 Cb 0.89 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.45 3hd7 h PHE 216 CO -0.00 1.16 -0.01 0.52 -1.61 0.00 0.00 178.31 178.37 3hd7 h MET 217 N 0.02 -0.02 0.00 1.51 2.86 0.44 -2.89 114.93 116.84 3hd7 h MET 217 Ca -0.26 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 3hd7 h MET 217 Cb 1.98 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 33.65 3hd7 h MET 217 CO 0.10 0.55 -0.07 -0.44 1.06 0.00 0.00 176.91 178.11 3hd7 h ASP 218 N -0.62 0.00 0.43 1.22 3.32 -0.05 -2.36 116.42 118.35 3hd7 h ASP 218 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3hd7 h ASP 218 Cb 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 3hd7 h ASP 218 CO 0.00 0.07 -0.21 -0.03 -1.72 0.00 0.00 179.24 177.36 3hd7 h MET 219 N 0.00 -0.56 0.00 3.56 4.05 -1.49 -1.85 114.93 118.64 3hd7 h MET 219 Ca -0.00 0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.46 3hd7 h MET 219 Cb 0.26 0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 31.19 3hd7 h MET 219 CO 0.01 -0.26 -0.01 0.00 0.23 0.00 0.00 176.91 176.88 3hd7 h ALA 220 N -0.45 1.09 0.01 0.39 0.00 -1.28 -1.93 119.26 117.09 3hd7 h ALA 220 Ca -0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3hd7 h ALA 220 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3hd7 h ALA 220 CO 0.10 0.01 -0.19 1.98 0.00 0.00 0.00 179.25 181.15 3hd7 h MET 221 N 0.00 0.11 -0.45 0.00 -1.53 -1.25 -2.70 114.93 109.11 3hd7 h MET 221 Ca -0.00 -0.13 -0.10 0.00 -3.44 0.00 0.00 59.70 56.02 3hd7 h MET 221 Cb 0.09 0.04 -0.02 0.00 -0.55 0.00 0.00 31.60 31.16 3hd7 h MET 221 CO 0.00 0.92 -0.13 -0.07 0.14 0.00 0.00 176.91 177.77 3hd7 h LEU 222 N -0.63 0.84 -0.98 3.39 4.07 -0.98 -1.22 115.31 119.79 3hd7 h LEU 222 Ca -0.03 -0.27 -0.11 0.00 0.08 0.00 0.00 57.88 57.56 3hd7 h LEU 222 Cb 1.00 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.50 3hd7 h LEU 222 CO 0.04 0.98 -0.46 0.58 -1.08 0.00 0.00 178.44 178.50 3hd7 h VAL 223 N 0.75 1.33 0.02 1.22 2.07 -1.47 -0.63 116.25 119.55 3hd7 h VAL 223 Ca 0.12 -1.61 -0.21 0.00 0.82 0.00 0.00 66.70 65.81 3hd7 h VAL 223 Cb 0.64 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 3hd7 h VAL 223 CO 0.04 0.47 -0.94 -0.08 0.02 0.00 0.00 177.57 177.09 3hd7 h GLU 224 N 0.09 0.26 -0.33 1.57 4.81 -1.32 -2.60 114.58 117.07 3hd7 h GLU 224 Ca 0.00 -0.30 -0.12 0.00 -0.13 0.00 0.00 59.36 58.81 3hd7 h GLU 224 Cb 0.85 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3hd7 h GLU 224 CO 0.06 1.03 -0.29 1.03 -0.73 0.00 0.00 179.01 180.11 3hd7 h SER 225 N 0.14 0.70 1.59 1.04 0.87 -0.87 -2.67 113.55 114.34 3hd7 h SER 225 Ca -0.06 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 3hd7 h SER 225 Cb 1.59 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 3hd7 h SER 225 CO 0.15 0.95 0.00 1.56 -0.53 0.00 0.00 176.83 178.96 3hd7 h GLN 226 N 0.59 0.00 -0.16 2.24 4.20 -1.16 -3.33 115.11 117.49 3hd7 h GLN 226 Ca 0.07 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 3hd7 h GLN 226 Cb 0.79 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 3hd7 h GLN 226 CO 0.06 0.00 -0.10 0.78 -0.67 0.00 0.00 178.83 178.91 3hd7 h GLY 227 N 4.12 0.26 1.42 3.46 0.00 -1.09 -2.42 103.07 108.83 3hd7 h GLY 227 Ca 0.00 -0.15 -0.28 0.00 0.00 0.00 0.00 47.33 46.89 3hd7 h GLY 227 CO 0.00 0.14 -1.40 0.83 0.00 0.00 0.00 176.54 176.11 3hd7 h GLU 228 N 0.24 0.21 0.00 4.80 5.08 -1.68 -3.09 114.58 120.14 3hd7 h GLU 228 Ca 0.05 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 3hd7 h GLU 228 Cb 0.32 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 3hd7 h GLU 228 CO 0.02 1.08 -0.02 1.98 -1.00 0.00 0.00 179.01 181.07 3hd7 h MET 229 N 0.06 0.00 0.00 2.33 4.05 -1.64 -1.07 114.93 118.65 3hd7 h MET 229 Ca -0.19 0.00 -0.24 0.00 -0.28 0.00 0.00 59.70 58.99 3hd7 h MET 229 Cb 1.97 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 32.74 3hd7 h MET 229 CO 0.16 0.02 -1.24 0.82 0.23 0.00 0.00 176.91 176.90 3hd7 h ILE 230 N 0.00 1.42 -0.30 1.77 2.04 -1.40 -3.12 117.51 117.92 3hd7 h ILE 230 Ca -0.00 -3.17 -0.08 0.00 1.00 0.00 0.00 64.86 62.60 3hd7 h ILE 230 Cb 0.09 2.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.85 3hd7 h ILE 230 CO 0.00 0.81 -0.16 0.44 0.00 0.00 0.00 178.15 179.23 3hd7 h ASP 231 N 0.00 0.53 -0.15 1.72 3.32 -1.12 0.05 116.42 120.77 3hd7 h ASP 231 Ca -0.10 -0.15 -0.22 0.00 0.02 0.00 0.00 57.03 56.57 3hd7 h ASP 231 Cb 1.85 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 41.27 3hd7 h ASP 231 CO 0.11 0.71 -0.76 0.03 -1.72 0.00 0.00 179.24 177.62 3hd7 h ARG 232 N 0.49 0.77 -0.01 3.56 3.08 -1.59 0.19 114.38 120.87 3hd7 h ARG 232 Ca 0.08 -0.63 0.01 0.00 0.07 0.00 0.00 59.98 59.51 3hd7 h ARG 232 Cb 0.57 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 3hd7 h ARG 232 CO 0.04 1.24 -0.06 0.82 -1.07 0.00 0.00 179.97 180.94 3hd7 h ILE 233 N 0.50 0.85 -0.29 2.04 2.04 -1.45 0.26 117.51 121.46 3hd7 h ILE 233 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3hd7 h ILE 233 Cb 1.39 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3hd7 h ILE 233 CO 0.16 0.00 0.19 -0.08 0.00 0.00 0.00 178.15 178.42 3hd7 h GLU 234 N -0.10 0.38 0.28 2.37 4.81 -0.96 -1.23 114.58 120.13 3hd7 h GLU 234 Ca 0.03 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3hd7 h GLU 234 Cb 0.13 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3hd7 h GLU 234 CO -0.07 0.25 -0.35 -0.92 -0.73 0.00 0.00 179.01 177.19 3hd7 h TYR 235 N 0.39 -0.98 -0.35 0.92 3.20 -0.34 0.10 116.97 119.91 3hd7 h TYR 235 Ca 0.10 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.09 3hd7 h TYR 235 Cb -0.04 0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3hd7 h TYR 235 CO -0.06 -0.45 0.26 -0.91 -1.64 0.00 0.00 178.16 175.37 3hd7 h ASN 236 N -0.65 0.00 0.12 -2.11 2.35 -0.42 -1.05 115.58 113.83 3hd7 h ASN 236 Ca -0.03 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.54 3hd7 h ASN 236 Cb 0.58 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.97 3hd7 h ASN 236 CO -0.08 0.00 -0.77 0.58 -1.65 0.00 0.00 177.43 175.51 3hd7 h VAL 237 N 0.00 1.51 0.00 2.81 2.07 -0.93 -0.22 116.25 121.49 3hd7 h VAL 237 Ca 0.17 -2.47 -0.00 0.00 0.82 0.00 0.00 66.70 65.21 3hd7 h VAL 237 Cb 0.69 3.13 -0.00 0.00 -1.52 0.00 0.00 31.29 33.58 3hd7 h VAL 237 CO -0.00 0.70 -0.01 1.05 0.02 0.00 0.00 177.57 179.33 3hd7 h GLU 238 N -0.35 0.00 0.00 1.57 4.11 -0.08 0.26 114.58 120.10 3hd7 h GLU 238 Ca -0.13 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.26 3hd7 h GLU 238 Cb 1.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.83 3hd7 h GLU 238 CO 0.15 0.01 -0.19 0.45 0.07 0.00 0.00 179.01 179.49 3hd7 h HIS 239 N 0.00 0.00 -0.94 2.06 3.86 -1.23 -2.98 115.15 115.92 3hd7 h HIS 239 Ca -0.00 0.00 0.20 0.00 -1.16 0.00 0.00 60.37 59.41 3hd7 h HIS 239 Cb 0.19 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.58 3hd7 h HIS 239 CO 0.00 1.01 0.61 0.00 0.86 0.00 0.00 177.93 180.40 3hd7 h ALA 240 N -0.14 2.04 -0.21 2.45 0.00 -0.08 0.18 119.26 123.49 3hd7 h ALA 240 Ca -0.05 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3hd7 h ALA 240 Cb 0.98 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3hd7 h ALA 240 CO -0.03 -0.35 -0.34 0.28 0.00 0.00 0.00 179.25 178.81 3hd7 h VAL 241 N 0.53 1.32 0.12 0.00 2.07 -0.65 -2.30 116.25 117.35 3hd7 h VAL 241 Ca 0.50 -1.55 0.02 0.00 0.82 0.00 0.00 66.70 66.49 3hd7 h VAL 241 Cb 1.07 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.62 3hd7 h VAL 241 CO -0.24 0.48 -0.23 -0.78 0.02 0.00 0.00 177.57 176.82 3hd7 h ASP 242 N 0.29 -0.66 0.08 0.57 3.58 -0.82 -0.58 116.42 118.89 3hd7 h ASP 242 Ca 0.02 0.08 0.02 0.00 0.42 0.00 0.00 57.03 57.57 3hd7 h ASP 242 Cb 0.92 0.25 -0.04 0.00 1.72 0.00 0.00 39.33 42.18 3hd7 h ASP 242 CO 0.08 -0.32 -0.30 1.88 -2.88 0.00 0.00 179.24 177.69 3hd7 h TYR 243 N -0.44 -0.83 -0.94 0.28 0.05 -0.76 -1.45 116.97 112.89 3hd7 h TYR 243 Ca 0.03 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.89 3hd7 h TYR 243 Cb 0.46 0.36 -0.06 0.00 1.01 0.00 0.00 36.73 38.49 3hd7 h TYR 243 CO -0.21 -0.41 0.60 0.28 -1.05 0.00 0.00 178.16 177.37 3hd7 h VAL 244 N -0.50 1.08 -0.69 -2.88 2.07 -1.32 0.93 116.25 114.94 3hd7 h VAL 244 Ca 0.04 -0.38 0.01 0.00 0.82 0.00 0.00 66.70 67.19 3hd7 h VAL 244 Cb 0.55 -0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 3hd7 h VAL 244 CO -0.21 0.20 0.45 -0.08 0.02 0.00 0.00 177.57 177.95 3hd7 h GLU 245 N 1.10 0.91 0.38 1.57 4.81 -0.51 0.62 114.58 123.44 3hd7 h GLU 245 Ca 0.40 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 3hd7 h GLU 245 Cb 0.15 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.33 3hd7 h GLU 245 CO -0.17 0.61 -0.18 0.00 -0.73 0.00 0.00 179.01 178.54 3hd7 h ARG 246 N 0.93 -0.49 -0.86 1.92 3.08 -0.68 -3.12 114.38 115.15 3hd7 h ARG 246 Ca 0.25 0.03 0.21 0.00 0.07 0.00 0.00 59.98 60.55 3hd7 h ARG 246 Cb -0.10 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.01 3hd7 h ARG 246 CO -0.05 -0.19 0.59 0.00 -1.07 0.00 0.00 179.97 179.25 3hd7 h ALA 247 N -0.29 2.43 -0.07 0.04 0.00 -0.55 -1.27 119.26 119.55 3hd7 h ALA 247 Ca -0.05 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 3hd7 h ALA 247 Cb 0.52 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3hd7 h ALA 247 CO 0.08 -0.69 -0.75 -0.24 0.00 0.00 0.00 179.25 177.65 3hd7 h VAL 248 N 0.24 1.38 -0.21 0.00 3.04 -0.85 -2.98 116.25 116.88 3hd7 h VAL 248 Ca 0.43 -2.18 -0.11 0.00 -1.01 0.00 0.00 66.70 63.83 3hd7 h VAL 248 Cb 1.32 2.15 -0.00 0.00 -2.01 0.00 0.00 31.29 32.74 3hd7 h VAL 248 CO -0.11 0.65 -0.30 0.77 -1.01 0.00 0.00 177.57 177.58 3hd7 h SER 249 N 0.27 0.62 -0.24 3.17 4.64 -1.18 -2.73 113.55 118.09 3hd7 h SER 249 Ca -0.03 -0.52 0.05 0.00 -0.47 0.00 0.00 61.79 60.82 3hd7 h SER 249 Cb 1.33 -0.18 -0.08 0.00 -0.31 0.00 0.00 62.40 63.17 3hd7 h SER 249 CO 0.13 1.02 -0.42 0.44 -0.87 0.00 0.00 176.83 177.13 3hd7 h ASP 250 N 0.25 -1.35 -0.83 4.97 3.32 -1.51 0.32 116.42 121.59 3hd7 h ASP 250 Ca 0.02 0.19 0.19 0.00 0.02 0.00 0.00 57.03 57.45 3hd7 h ASP 250 Cb 0.88 0.57 -0.11 0.00 0.22 0.00 0.00 39.33 40.88 3hd7 h ASP 250 CO 0.07 -0.40 0.31 0.71 -1.72 0.00 0.00 179.24 178.21 3hd7 h THR 251 N -0.42 0.53 -0.68 0.35 1.35 -1.51 0.56 112.91 113.09 3hd7 h THR 251 Ca 0.10 -0.13 0.03 0.00 -0.55 0.00 0.00 66.41 65.86 3hd7 h THR 251 Cb 0.61 0.11 -0.04 0.00 -1.73 0.00 0.00 68.15 67.10 3hd7 h THR 251 CO -0.47 0.07 0.45 0.50 -0.25 0.00 0.00 175.52 175.82 3hd7 h LYS 252 N 0.38 0.81 -0.02 4.72 3.64 -0.69 -1.20 116.57 124.22 3hd7 h LYS 252 Ca 0.49 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.80 3hd7 h LYS 252 Cb 0.86 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 3hd7 h LYS 252 CO -0.50 0.53 -0.08 0.87 -2.27 0.00 0.00 179.45 178.00 3hd7 h LYS 253 N 0.83 0.08 -0.94 1.90 1.57 0.11 -2.96 116.57 117.16 3hd7 h LYS 253 Ca 0.27 -0.07 0.24 0.00 -1.87 0.00 0.00 60.65 59.22 3hd7 h LYS 253 Cb 0.04 0.01 -0.13 0.00 0.08 0.00 0.00 32.23 32.24 3hd7 h LYS 253 CO -0.07 0.73 0.47 0.00 -0.57 0.00 0.00 179.45 180.02 3hd7 h ALA 254 N 0.35 1.61 -0.02 3.86 0.00 0.59 0.37 119.26 126.01 3hd7 h ALA 254 Ca -0.01 0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 3hd7 h ALA 254 Cb 0.75 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 3hd7 h ALA 254 CO 0.02 -0.35 -0.60 -0.39 0.00 0.00 0.00 179.25 177.93 3hd7 h VAL 255 N 0.44 1.42 0.08 0.00 -1.51 -1.29 -1.77 116.25 113.63 3hd7 h VAL 255 Ca 0.61 -2.03 -0.00 0.00 -1.23 0.00 0.00 66.70 64.04 3hd7 h VAL 255 Cb 1.19 2.07 0.00 0.00 -2.13 0.00 0.00 31.29 32.42 3hd7 h VAL 255 CO -0.53 0.59 -0.04 0.50 -1.23 0.00 0.00 177.57 176.86 3hd7 h LYS 256 N 0.06 -0.10 -0.39 5.19 3.64 -0.20 -1.64 116.57 123.13 3hd7 h LYS 256 Ca -0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hd7 h LYS 256 Cb 1.08 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 3hd7 h LYS 256 CO 0.08 0.29 0.25 1.88 -2.27 0.00 0.00 179.45 179.68 3hd7 h TYR 257 N -0.53 0.50 -0.61 1.91 0.05 -0.97 -0.71 116.97 116.61 3hd7 h TYR 257 Ca -0.01 0.01 0.12 0.00 0.05 0.00 0.00 58.73 58.89 3hd7 h TYR 257 Cb 0.45 -0.17 -0.09 0.00 1.01 0.00 0.00 36.73 37.93 3hd7 h TYR 257 CO 0.06 0.34 0.09 0.37 -1.05 0.00 0.00 178.16 177.97 3hd7 h GLN 258 N 0.52 0.21 0.00 4.88 4.15 -1.33 0.29 115.11 123.82 3hd7 h GLN 258 Ca 0.14 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 3hd7 h GLN 258 Cb -0.03 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 27.61 3hd7 h GLN 258 CO -0.03 0.14 -0.12 0.66 -1.93 0.00 0.00 178.83 177.55 3hd7 h SER 259 N 0.22 0.00 0.31 -0.69 4.64 -0.63 0.13 113.55 117.52 3hd7 h SER 259 Ca 0.32 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.63 3hd7 h SER 259 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3hd7 h SER 259 CO -0.44 0.12 -0.15 0.11 -0.87 0.00 0.00 176.83 175.60 3hd7 h LYS 260 N 0.00 -0.40 -0.62 4.77 1.57 0.42 -3.07 116.57 119.24 3hd7 h LYS 260 Ca -0.00 0.03 0.18 0.00 -1.87 0.00 0.00 60.65 58.98 3hd7 h LYS 260 Cb 0.56 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.94 3hd7 h LYS 260 CO 0.02 -0.23 0.45 0.00 -0.57 0.00 0.00 179.45 179.11 3hd7 h ALA 261 N -1.04 2.58 -0.46 3.86 0.00 -0.32 -0.00 119.26 123.88 3hd7 h ALA 261 Ca -0.04 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 3hd7 h ALA 261 Cb 0.36 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3hd7 h ALA 261 CO 0.07 -0.76 -0.17 -0.09 0.00 0.00 0.00 179.25 178.31 3hd7 h ARG 262 N 0.01 0.92 -0.62 0.00 2.43 -0.83 -1.72 114.38 114.56 3hd7 h ARG 262 Ca 0.29 -0.38 -0.06 0.00 -0.81 0.00 0.00 59.98 59.03 3hd7 h ARG 262 Cb 1.17 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.66 3hd7 h ARG 262 CO -0.01 1.03 0.16 0.00 -1.51 0.00 0.00 179.97 179.65 3hd7 h ARG 263 N 0.75 0.99 -0.34 0.20 3.08 -0.91 -3.03 114.38 115.12 3hd7 h ARG 263 Ca 0.11 -0.23 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 3hd7 h ARG 263 Cb 0.73 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 3hd7 h ARG 263 CO 0.06 0.89 -0.03 0.87 -1.07 0.00 0.00 179.97 180.69 3hd7 h LYS 264 N 0.91 0.62 -0.73 0.04 1.57 -1.32 -1.83 116.57 115.82 3hd7 h LYS 264 Ca 0.20 -0.21 0.21 0.00 -1.87 0.00 0.00 60.65 58.98 3hd7 h LYS 264 Cb 0.34 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 3hd7 h LYS 264 CO -0.00 0.76 0.55 -0.22 -0.57 0.00 0.00 179.45 179.96 3hd7 h LYS 265 N 0.42 0.00 0.03 3.15 3.64 -1.24 0.16 116.57 122.72 3hd7 h LYS 265 Ca 0.09 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 3hd7 h LYS 265 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 3hd7 h LYS 265 CO 0.02 0.00 -0.15 0.82 -2.27 0.00 0.00 179.45 177.87 3hd7 h ILE 266 N 0.00 1.75 -0.41 2.00 2.04 -1.31 -2.87 117.51 118.71 3hd7 h ILE 266 Ca 0.35 -2.38 0.08 0.00 1.00 0.00 0.00 64.86 63.91 3hd7 h ILE 266 Cb 1.44 3.36 -0.08 0.00 -0.74 0.00 0.00 36.82 40.80 3hd7 h ILE 266 CO -0.00 0.63 -0.16 0.24 0.00 0.00 0.00 178.15 178.86 3hd7 h MET 267 N -0.88 -0.07 0.12 2.37 2.86 -0.47 -0.55 114.93 118.31 3hd7 h MET 267 Ca -0.03 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3hd7 h MET 267 Cb 1.12 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.75 3hd7 h MET 267 CO 0.03 -0.05 -0.48 0.82 1.06 0.00 0.00 176.91 178.29 3hd7 h ILE 268 N -0.07 0.00 -0.73 -1.22 2.04 -0.82 -0.67 117.51 116.04 3hd7 h ILE 268 Ca 0.20 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.22 3hd7 h ILE 268 Cb 0.38 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.35 3hd7 h ILE 268 CO -0.46 0.00 0.12 0.40 0.00 0.00 0.00 178.15 178.21 3hd7 h ILE 269 N -0.69 0.47 -0.85 -0.67 2.04 -1.25 0.19 117.51 116.75 3hd7 h ILE 269 Ca -0.01 -0.07 0.14 0.00 1.00 0.00 0.00 64.86 65.92 3hd7 h ILE 269 Cb 0.69 0.24 -0.09 0.00 -0.74 0.00 0.00 36.82 36.92 3hd7 h ILE 269 CO -0.26 0.04 0.45 0.40 0.00 0.00 0.00 178.15 178.78 3hd7 h ILE 270 N 0.21 0.75 -0.53 -0.67 2.04 -0.39 0.26 117.51 119.18 3hd7 h ILE 270 Ca 0.41 -0.22 -0.11 0.00 1.00 0.00 0.00 64.86 65.93 3hd7 h ILE 270 Cb 0.70 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3hd7 h ILE 270 CO -0.55 0.12 -0.11 0.00 0.00 0.00 0.00 178.15 177.61 3hd7 h VAL 273 N 0.50 1.06 -0.37 0.00 2.07 -0.44 0.23 116.25 119.30 3hd7 h VAL 273 Ca 0.02 -0.31 -0.13 0.00 0.82 0.00 0.00 66.70 67.11 3hd7 h VAL 273 Cb 1.04 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3hd7 h VAL 273 CO 0.10 0.16 -0.28 0.40 0.02 0.00 0.00 177.57 177.98 3hd7 h ILE 274 N 0.90 1.28 -0.13 4.57 2.04 -0.51 -1.69 117.51 123.97 3hd7 h ILE 274 Ca 0.34 -1.41 -0.12 0.00 1.00 0.00 0.00 64.86 64.67 3hd7 h ILE 274 Cb 0.19 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 3hd7 h ILE 274 CO -0.12 0.47 -0.37 -0.07 0.00 0.00 0.00 178.15 178.06 3hd7 h LEU 275 N 0.67 0.55 -0.98 1.44 3.38 -0.25 -0.49 115.31 119.62 3hd7 h LEU 275 Ca 0.08 -0.59 0.11 0.00 0.09 0.00 0.00 57.88 57.57 3hd7 h LEU 275 Cb 0.81 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.31 3hd7 h LEU 275 CO 0.07 1.05 0.62 1.23 0.09 0.00 0.00 178.44 181.49 3hd7 h GLY 276 N 0.09 1.59 1.06 0.83 0.00 -0.58 0.57 103.07 106.62 3hd7 h GLY 276 Ca -0.01 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 3hd7 h GLY 276 CO 0.08 0.19 0.14 -2.22 0.00 0.00 0.00 176.54 174.73 3hd7 h ILE 277 N 1.00 1.26 0.38 2.60 2.04 -1.16 0.14 117.51 123.77 3hd7 h ILE 277 Ca 0.48 -0.99 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 3hd7 h ILE 277 Cb 0.42 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 3hd7 h ILE 277 CO -0.25 0.38 -0.18 0.40 0.00 0.00 0.00 178.15 178.49 3hd7 h ILE 278 N 1.03 0.59 -0.80 -0.67 2.04 0.39 -0.32 117.51 119.78 3hd7 h ILE 278 Ca 0.21 -0.44 0.13 0.00 1.00 0.00 0.00 64.86 65.76 3hd7 h ILE 278 Cb 0.40 0.80 -0.09 0.00 -0.74 0.00 0.00 36.82 37.19 3hd7 h ILE 278 CO 0.01 0.08 0.39 0.40 0.00 0.00 0.00 178.15 179.03 3hd7 h ILE 279 N -0.78 0.74 0.00 -0.67 2.04 0.11 0.13 117.51 119.09 3hd7 h ILE 279 Ca -0.05 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3hd7 h ILE 279 Cb 0.52 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3hd7 h ILE 279 CO 0.09 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.34 3hd7 h ALA 280 N 1.53 1.00 0.00 1.87 0.00 -0.69 -1.79 119.26 121.17 3hd7 h ALA 280 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3hd7 h ALA 280 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3hd7 h ALA 280 CO -0.35 0.00 -0.41 0.45 0.00 0.00 0.00 179.25 178.94 3hd7 n SER 281 N -2.61 0.57 -0.10 0.00 2.88 0.40 -1.41 113.62 113.35 3hd7 n SER 281 Ca 0.03 0.16 -0.17 0.00 -1.33 0.00 0.00 58.87 57.55 3hd7 n SER 281 Cb 0.34 -0.06 -0.07 0.00 -0.75 0.00 0.00 64.21 63.68 3hd7 n SER 281 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3hd7 n THR 282 N -1.90 1.50 0.18 2.46 -2.24 -0.75 -3.83 114.28 109.70 3hd7 n THR 282 Ca 0.05 -0.04 0.18 0.00 -2.27 0.00 0.00 64.05 61.96 3hd7 n THR 282 Cb 0.40 -2.15 0.80 0.00 -2.10 0.00 0.00 70.33 67.28 3hd7 n THR 282 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3hd7 h ILE 283 N -1.00 0.49 -0.01 2.28 2.04 -1.47 0.92 117.51 120.75 3hd7 h ILE 283 Ca -0.29 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3hd7 h ILE 283 Cb 1.15 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 3hd7 h ILE 283 CO -0.17 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.59 3hd7 n GLY 284 N -1.43 -0.76 2.59 5.37 0.00 -0.50 -3.57 105.19 106.89 3hd7 n GLY 284 Ca 0.03 -0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 3hd7 n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hd7 n GLY 285 N 1.01 5.91 3.74 -0.02 0.00 0.32 -5.00 105.19 111.15 3hd7 n GLY 285 Ca 0.21 -2.75 0.00 0.00 0.00 0.00 0.00 46.02 43.49 3hd7 n GLY 285 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71