#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vnf s PRO 196 N 0.00 2.78 0.27 3.49 0.02 -1.26 -4.93 135.00 135.37 2vnf s PRO 196 Ca 0.00 1.80 0.09 0.00 0.02 0.00 0.00 61.00 62.91 2vnf s PRO 196 Cb 0.00 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 2vnf s PRO 196 CO 0.00 -1.35 0.04 0.95 -0.33 0.00 0.00 177.00 176.31 2vnf s THR 197 N -1.70 3.55 0.24 0.99 -4.23 -1.26 -4.23 115.64 108.99 2vnf s THR 197 Ca 0.77 -1.81 -0.04 0.00 -1.18 0.00 0.00 61.69 59.42 2vnf s THR 197 Cb -0.30 -2.95 -0.02 0.00 1.34 0.00 0.00 72.50 70.57 2vnf s THR 197 CO 0.36 -0.35 0.28 -0.31 -0.54 0.00 0.00 174.62 174.07 2vnf s TYR 198 N -2.31 0.93 0.09 3.99 1.51 -0.15 -4.91 117.35 116.52 2vnf s TYR 198 Ca 0.32 -1.18 0.00 0.00 -1.01 0.00 0.00 57.07 55.20 2vnf s TYR 198 Cb -0.06 -0.29 0.00 0.00 -0.11 0.00 0.00 41.96 41.50 2vnf s TYR 198 CO 0.21 -0.81 0.00 0.00 -1.11 0.00 0.00 175.55 173.84 2vnf h LEU 200 N -0.29 0.00 -0.40 0.00 3.38 -1.95 -3.07 115.31 112.98 2vnf h LEU 200 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2vnf h LEU 200 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2vnf h LEU 200 CO 0.01 0.01 -0.61 0.00 0.09 0.00 0.00 178.44 177.95 2vnf n HIS 202 N -0.89 -1.82 -4.12 0.00 8.25 -0.73 -5.01 115.22 110.90 2vnf n HIS 202 Ca 0.07 0.46 -0.23 0.00 -0.26 0.00 0.00 57.72 57.76 2vnf n HIS 202 Cb 0.38 -4.35 -0.06 0.00 1.12 0.00 0.00 29.99 27.07 2vnf n HIS 202 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2vnf s GLN 203 N -5.60 2.35 0.94 -0.41 -1.52 -1.04 -4.61 119.66 109.76 2vnf s GLN 203 Ca 0.27 -1.57 -0.11 0.00 -1.95 0.00 0.00 55.36 52.00 2vnf s GLN 203 Cb -0.12 -2.15 0.11 0.00 -0.22 0.00 0.00 33.01 30.63 2vnf s GLN 203 CO 0.33 0.11 0.85 1.33 -0.25 0.00 0.00 175.29 177.66 2vnf n VAL 204 N -1.13 0.00 -1.70 1.09 0.24 -1.26 -0.97 118.33 114.59 2vnf n VAL 204 Ca -0.03 -0.09 -0.43 0.00 -2.04 0.00 0.00 64.34 61.75 2vnf n VAL 204 Cb 0.61 -0.85 -0.01 0.00 -1.47 0.00 0.00 33.84 32.12 2vnf n VAL 204 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2vnf n SER 205 N -3.15 3.03 -3.49 -1.34 2.88 -1.26 -4.80 113.62 105.50 2vnf n SER 205 Ca 0.10 1.18 -0.14 0.00 -1.33 0.00 0.00 58.87 58.67 2vnf n SER 205 Cb 0.53 -1.49 -0.04 0.00 -0.75 0.00 0.00 64.21 62.45 2vnf n SER 205 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2vnf s TYR 206 N -0.54 -0.55 0.00 0.66 -0.85 -1.26 -5.14 117.35 109.67 2vnf s TYR 206 Ca 0.61 0.60 0.00 0.00 -0.52 0.00 0.00 57.07 57.76 2vnf s TYR 206 Cb -0.58 0.46 0.00 0.00 0.38 0.00 0.00 41.96 42.23 2vnf s TYR 206 CO 0.56 -0.73 0.00 0.41 -1.52 0.00 0.00 175.55 174.26 2vnf n GLY 207 N 0.19 0.99 3.78 5.49 0.00 -1.26 -4.55 105.19 109.82 2vnf n GLY 207 Ca -0.18 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.82 2vnf n GLY 207 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vnf s GLU 208 N 0.00 4.33 0.19 1.61 2.02 -1.26 -5.03 118.70 120.56 2vnf s GLU 208 Ca 0.00 0.83 0.11 0.00 0.02 0.00 0.00 54.97 55.93 2vnf s GLU 208 Cb 0.00 -3.29 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 2vnf s GLU 208 CO 0.00 0.49 -0.23 -1.64 0.02 0.00 0.00 175.26 173.90 2vnf s MET 209 N -0.65 1.50 0.00 1.61 -1.94 -1.26 -1.94 119.30 116.61 2vnf s MET 209 Ca 0.32 -1.52 0.06 0.00 -1.71 0.00 0.00 55.69 52.83 2vnf s MET 209 Cb -0.20 -1.78 -0.02 0.00 2.01 0.00 0.00 34.83 34.84 2vnf s MET 209 CO 0.20 0.38 -0.18 -1.50 -0.01 0.00 0.00 175.02 173.90 2vnf s ILE 210 N -1.75 1.46 -0.12 2.53 2.07 -0.13 -4.92 121.20 120.35 2vnf s ILE 210 Ca 0.21 -0.88 -0.07 0.00 -1.41 0.00 0.00 60.65 58.51 2vnf s ILE 210 Cb -0.08 -1.24 -0.04 0.00 0.13 0.00 0.00 42.46 41.24 2vnf s ILE 210 CO 0.10 0.34 0.12 -0.83 -1.91 0.00 0.00 174.94 172.76 2vnf s GLY 211 N -0.62 2.12 0.11 1.50 0.00 -1.26 -1.27 107.32 107.90 2vnf s GLY 211 Ca 0.07 -0.66 -0.29 0.00 0.00 0.00 0.00 44.72 43.83 2vnf s GLY 211 CO -0.00 -0.38 0.94 0.00 0.00 0.00 0.00 173.10 173.66 2vnf n ASP 213 N 2.75 0.97 -4.59 0.00 10.43 0.33 -4.70 116.55 121.74 2vnf n ASP 213 Ca 0.02 -1.73 -0.42 0.00 2.57 0.00 0.00 54.79 55.22 2vnf n ASP 213 Cb 0.49 -0.08 -0.04 0.00 1.84 0.00 0.00 41.12 43.32 2vnf n ASP 213 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 2vnf s ASN 214 N -1.36 6.59 0.39 -2.24 2.47 -1.26 -4.89 114.94 114.63 2vnf s ASN 214 Ca 0.24 0.41 0.27 0.00 0.42 0.00 0.00 52.86 54.20 2vnf s ASN 214 Cb 0.12 -2.43 1.38 0.00 -1.45 0.00 0.00 41.25 38.87 2vnf s ASN 214 CO 0.19 -0.82 1.82 -0.65 -3.72 0.00 0.00 177.10 173.92 2vnf h PRO 215 N 8.54 0.00 -0.70 0.43 0.11 -2.02 -0.36 132.00 138.01 2vnf h PRO 215 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2vnf h PRO 215 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2vnf h PRO 215 CO 0.95 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.49 2vnf n ASP 216 N -2.46 3.99 -4.77 -2.05 8.00 -1.26 -4.96 116.55 113.03 2vnf n ASP 216 Ca -0.01 -2.10 -0.40 0.00 0.71 0.00 0.00 54.79 52.99 2vnf n ASP 216 Cb 0.10 -0.50 -0.01 0.00 -0.02 0.00 0.00 41.12 40.69 2vnf n ASP 216 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vnf n SER 218 N 0.42 0.32 -0.04 0.00 3.41 -1.26 -4.25 113.62 112.22 2vnf n SER 218 Ca 0.02 0.16 -0.05 0.00 -0.26 0.00 0.00 58.87 58.73 2vnf n SER 218 Cb 0.41 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 2vnf n SER 218 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2vnf n ILE 219 N -1.60 0.41 0.00 -1.33 5.41 -1.26 -5.03 119.36 115.96 2vnf n ILE 219 Ca 0.06 -0.15 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2vnf n ILE 219 Cb 0.35 -0.90 0.00 0.00 -0.71 0.00 0.00 39.64 38.38 2vnf n ILE 219 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2vnf n GLU 220 N -2.82 0.00 -4.49 0.38 1.02 -1.26 -4.53 120.64 108.94 2vnf n GLU 220 Ca -0.13 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.81 2vnf n GLU 220 Cb 0.63 -0.02 -0.15 0.00 -0.02 0.00 0.00 31.44 31.88 2vnf n GLU 220 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2vnf s TRP 221 N 0.00 1.02 0.01 -0.32 0.52 -1.26 -0.75 118.94 118.16 2vnf s TRP 221 Ca 0.00 -0.20 0.01 0.00 0.02 0.00 0.00 56.10 55.93 2vnf s TRP 221 Cb 0.00 -0.67 -0.01 0.00 -1.15 0.00 0.00 33.47 31.64 2vnf s TRP 221 CO 0.00 -0.03 -0.04 -0.06 0.02 0.00 0.00 176.95 176.83 2vnf s PHE 222 N -0.19 0.39 0.24 -1.98 0.40 -0.39 -1.52 117.98 114.93 2vnf s PHE 222 Ca 0.03 -0.22 -0.30 0.00 -0.60 0.00 0.00 56.93 55.84 2vnf s PHE 222 Cb -0.05 -0.24 -0.09 0.00 0.51 0.00 0.00 43.02 43.14 2vnf s PHE 222 CO -0.00 -0.05 1.25 -1.01 0.70 0.00 0.00 175.22 176.11 2vnf s HIS 223 N -0.55 3.29 0.21 0.36 3.76 -1.26 -0.95 115.29 120.14 2vnf s HIS 223 Ca -0.03 1.39 -0.12 0.00 -0.15 0.00 0.00 55.06 56.14 2vnf s HIS 223 Cb -0.04 -3.54 0.26 0.00 1.11 0.00 0.00 32.58 30.37 2vnf s HIS 223 CO -0.00 -1.52 1.65 0.74 -0.85 0.00 0.00 174.74 174.76 2vnf h PHE 224 N 4.57 -0.14 -0.15 1.40 0.05 -1.69 -0.78 116.94 120.21 2vnf h PHE 224 Ca -0.46 0.05 -0.10 0.00 3.82 0.00 0.00 57.97 61.28 2vnf h PHE 224 Cb 1.22 0.15 -0.01 0.00 2.00 0.00 0.00 35.95 39.31 2vnf h PHE 224 CO 0.60 -0.20 -0.36 0.00 -0.18 0.00 0.00 178.31 178.18 2vnf h ALA 225 N 1.56 1.13 0.00 2.45 0.00 -1.87 -0.72 119.26 121.81 2vnf h ALA 225 Ca 0.30 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2vnf h ALA 225 Cb 0.48 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2vnf h ALA 225 CO -0.55 0.57 -0.04 0.00 0.00 0.00 0.00 179.25 179.22 2vnf n VAL 227 N -3.89 2.38 -1.46 0.00 0.24 -0.75 -4.98 118.33 109.87 2vnf n VAL 227 Ca -0.03 -2.27 -0.07 0.00 -2.04 0.00 0.00 64.34 59.93 2vnf n VAL 227 Cb 0.13 -0.28 -0.02 0.00 -1.47 0.00 0.00 33.84 32.19 2vnf n VAL 227 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2vnf n GLY 228 N -0.85 0.70 3.66 7.63 0.00 -0.72 -5.03 105.19 110.57 2vnf n GLY 228 Ca 0.26 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 2vnf n GLY 228 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vnf s LEU 229 N -1.74 3.43 -0.10 0.99 1.43 -0.35 -4.98 118.68 117.36 2vnf s LEU 229 Ca 0.00 -0.00 0.06 0.00 -1.03 0.00 0.00 54.13 53.15 2vnf s LEU 229 Cb 0.00 -1.91 -0.10 0.00 0.03 0.00 0.00 46.19 44.21 2vnf s LEU 229 CO 0.00 0.31 -0.01 0.41 0.23 0.00 0.00 176.35 177.29 2vnf n THR 230 N 1.66 0.62 -4.25 5.49 -1.04 -1.26 -3.85 114.28 111.65 2vnf n THR 230 Ca -0.16 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.05 61.37 2vnf n THR 230 Cb 0.53 -0.81 -0.10 0.00 -1.82 0.00 0.00 70.33 68.13 2vnf n THR 230 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2vnf s THR 231 N -2.22 1.14 0.15 12.58 -4.23 -1.26 -5.10 115.64 116.70 2vnf s THR 231 Ca -0.08 -2.05 -0.31 0.00 -1.18 0.00 0.00 61.69 58.06 2vnf s THR 231 Cb 0.03 -1.87 -0.11 0.00 1.34 0.00 0.00 72.50 71.89 2vnf s THR 231 CO 0.33 -0.72 1.80 -0.75 -0.54 0.00 0.00 174.62 174.73 2vnf s LYS 232 N -3.76 4.13 0.57 3.99 2.20 -1.26 -4.99 119.74 120.62 2vnf s LYS 232 Ca 0.17 2.60 -0.17 0.00 -0.36 0.00 0.00 55.97 58.21 2vnf s LYS 232 Cb 0.03 -3.43 -0.05 0.00 -1.51 0.00 0.00 37.83 32.87 2vnf s LYS 232 CO 0.01 -0.81 1.07 -2.14 -0.36 0.00 0.00 175.35 173.11 2vnf s PRO 233 N 2.24 3.37 0.17 4.03 0.02 -1.26 -5.05 135.00 138.52 2vnf s PRO 233 Ca 0.79 1.32 -0.10 0.00 0.02 0.00 0.00 61.00 63.03 2vnf s PRO 233 Cb -0.47 -2.03 -0.07 0.00 0.02 0.00 0.00 34.50 31.95 2vnf s PRO 233 CO 0.35 -0.78 0.50 -0.98 -0.33 0.00 0.00 177.00 175.76 2vnf s ARG 234 N -3.78 3.80 0.92 5.54 3.03 -1.26 -4.98 118.95 122.23 2vnf s ARG 234 Ca 0.66 0.24 0.00 0.00 2.03 0.00 0.00 55.73 58.66 2vnf s ARG 234 Cb -0.18 -2.79 0.00 0.00 -1.03 0.00 0.00 34.95 30.95 2vnf s ARG 234 CO 0.32 0.41 0.00 0.41 -1.13 0.00 0.00 175.30 175.31 2vnf n GLY 235 N 0.25 -1.84 3.75 3.88 0.00 -1.26 -4.88 105.19 105.09 2vnf n GLY 235 Ca -0.02 -1.32 -0.38 0.00 0.00 0.00 0.00 46.02 44.30 2vnf n GLY 235 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vnf s LYS 236 N -0.50 3.17 -0.02 1.61 1.02 -1.26 -5.03 119.74 118.73 2vnf s LYS 236 Ca 0.00 2.14 0.01 0.00 0.02 0.00 0.00 55.97 58.14 2vnf s LYS 236 Cb 0.00 -2.23 0.01 0.00 -0.52 0.00 0.00 37.83 35.09 2vnf s LYS 236 CO 0.00 -1.14 -0.04 -0.46 -0.92 0.00 0.00 175.35 172.79 2vnf s TRP 237 N -1.36 0.52 0.04 3.18 -0.00 -1.26 -5.06 118.94 115.01 2vnf s TRP 237 Ca 0.72 -0.10 0.09 0.00 -0.00 0.00 0.00 56.10 56.80 2vnf s TRP 237 Cb -0.38 -0.41 -0.03 0.00 -0.00 0.00 0.00 33.47 32.65 2vnf s TRP 237 CO 0.45 -0.07 -0.24 -0.06 -0.00 0.00 0.00 176.95 177.02 2vnf s PHE 238 N 0.30 2.38 1.10 5.86 0.40 -1.26 -0.52 117.98 126.24 2vnf s PHE 238 Ca -0.03 -0.37 -0.16 0.00 -0.60 0.00 0.00 56.93 55.76 2vnf s PHE 238 Cb -0.07 -1.41 0.24 0.00 0.51 0.00 0.00 43.02 42.29 2vnf s PHE 238 CO -0.00 0.15 1.13 0.00 0.70 0.00 0.00 175.22 177.20 2vnf h PRO 240 N -2.22 0.48 -0.07 0.00 0.13 -1.97 0.45 132.00 128.80 2vnf h PRO 240 Ca -0.48 -0.23 -0.10 0.00 -0.87 0.00 0.00 66.00 64.32 2vnf h PRO 240 Cb 1.30 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 2vnf h PRO 240 CO 0.44 0.78 -0.44 -0.09 -0.23 0.00 0.00 178.00 178.46 2vnf h ARG 241 N 0.40 0.15 0.00 0.86 2.43 -1.93 -2.91 114.38 113.39 2vnf h ARG 241 Ca 0.04 -0.07 -0.25 0.00 -0.81 0.00 0.00 59.98 58.89 2vnf h ARG 241 Cb 0.83 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.34 2vnf h ARG 241 CO 0.07 0.56 -1.34 0.00 -1.51 0.00 0.00 179.97 177.75 2vnf h SER 243 N 0.00 0.00 0.00 0.00 0.02 -0.09 -3.47 113.55 110.01 2vnf h SER 243 Ca -0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2vnf h SER 243 Cb 1.88 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.42 2vnf h SER 243 CO 0.10 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.79