#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdg s ALA -3 N 0.00 0.84 0.25 4.61 0.00 -1.26 -5.10 121.76 121.10 2kdg s ALA -3 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.97 2kdg s ALA -3 Cb 0.00 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 2kdg s ALA -3 CO 0.00 -2.95 0.26 0.00 0.00 0.00 0.00 175.76 173.07 2kdg s MET -2 N -4.73 1.46 -0.05 0.00 0.23 -1.26 -5.04 119.30 109.91 2kdg s MET -2 Ca 0.66 -1.66 -0.31 0.00 -1.03 0.00 0.00 55.69 53.35 2kdg s MET -2 Cb -0.21 0.34 0.12 0.00 -1.53 0.00 0.00 34.83 33.55 2kdg s MET -2 CO 0.60 -0.54 1.35 0.20 -2.03 0.00 0.00 175.02 174.60 2kdg s GLY -1 N -3.19 -0.34 0.76 3.16 0.00 -0.17 -4.98 107.32 102.57 2kdg s GLY -1 Ca 0.36 0.54 -0.11 0.00 0.00 0.00 0.00 44.72 45.51 2kdg s GLY -1 CO 0.16 2.47 1.09 2.56 0.00 0.00 0.00 173.10 179.38 2kdg s PRO 249 N -2.14 2.31 0.90 2.90 0.04 -1.26 -1.58 135.00 136.16 2kdg s PRO 249 Ca 0.21 1.19 -0.11 0.00 0.04 0.00 0.00 61.00 62.32 2kdg s PRO 249 Cb 0.04 -1.90 0.13 0.00 0.04 0.00 0.00 34.50 32.80 2kdg s PRO 249 CO -0.04 -1.61 1.09 -1.25 0.04 0.00 0.00 177.00 175.23 2kdg s PRO 250 N -4.84 1.26 0.06 0.56 0.04 -1.26 -4.04 135.00 126.78 2kdg s PRO 250 Ca 0.62 0.85 -0.05 0.00 0.04 0.00 0.00 61.00 62.46 2kdg s PRO 250 Cb -0.17 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 2kdg s PRO 250 CO 0.55 -2.25 0.08 0.50 0.04 0.00 0.00 177.00 175.92 2kdg s ARG 251 N -4.92 0.67 -1.41 4.56 3.52 -1.26 -4.60 118.95 115.51 2kdg s ARG 251 Ca 0.63 -0.97 -0.13 0.00 -0.13 0.00 0.00 55.73 55.14 2kdg s ARG 251 Cb -0.18 0.26 0.07 0.00 -1.56 0.00 0.00 34.95 33.54 2kdg s ARG 251 CO 0.57 -0.17 2.15 1.19 -0.81 0.00 0.00 175.30 178.23 2kdg n PHE 252 N 0.31 3.33 -1.75 5.12 3.01 -1.26 -4.29 117.46 121.94 2kdg n PHE 252 Ca -0.16 -2.92 -0.30 0.00 1.01 0.00 0.00 57.45 55.08 2kdg n PHE 252 Cb 0.60 -2.38 0.17 0.00 -0.01 0.00 0.00 39.48 37.87 2kdg n PHE 252 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2kdg s ILE 253 N 2.33 1.94 -0.32 4.37 -1.09 -1.26 -4.95 121.20 122.23 2kdg s ILE 253 Ca 0.45 0.00 -0.38 0.00 -2.23 0.00 0.00 60.65 58.49 2kdg s ILE 253 Cb 0.13 -2.89 -0.14 0.00 -1.58 0.00 0.00 42.46 37.97 2kdg s ILE 253 CO -0.06 0.00 1.96 1.67 -1.23 0.00 0.00 174.94 177.27 2kdg n GLN 254 N -3.82 1.07 -2.38 2.79 7.27 -1.26 -4.78 117.38 116.28 2kdg n GLN 254 Ca 0.12 0.36 -0.32 0.00 0.07 0.00 0.00 57.00 57.23 2kdg n GLN 254 Cb 0.60 -2.21 -0.03 0.00 2.41 0.00 0.00 30.24 31.01 2kdg n GLN 254 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2kdg s VAL 255 N 5.20 4.31 0.82 1.69 -7.23 -1.26 -1.75 120.40 122.18 2kdg s VAL 255 Ca 1.04 1.16 -0.12 0.00 -1.81 0.00 0.00 61.98 62.26 2kdg s VAL 255 Cb -1.01 -3.61 0.08 0.00 0.56 0.00 0.00 36.38 32.39 2kdg s VAL 255 CO 0.59 -0.58 1.12 -2.16 -0.31 0.00 0.00 175.10 173.76 2kdg s PRO 256 N -3.91 1.91 0.81 4.82 0.04 -1.24 -4.98 135.00 132.44 2kdg s PRO 256 Ca 0.61 0.45 -0.11 0.00 0.04 0.00 0.00 61.00 61.98 2kdg s PRO 256 Cb -0.12 -1.91 0.08 0.00 0.04 0.00 0.00 34.50 32.59 2kdg s PRO 256 CO 0.30 -1.70 1.10 -1.21 0.04 0.00 0.00 177.00 175.53 2kdg s GLU 257 N -5.27 1.97 0.93 4.56 2.02 -1.26 -4.88 118.70 116.77 2kdg s GLU 257 Ca 0.61 0.65 -0.11 0.00 0.02 0.00 0.00 54.97 56.15 2kdg s GLU 257 Cb -0.14 -1.90 0.15 0.00 0.10 0.00 0.00 34.13 32.34 2kdg s GLU 257 CO 0.53 -1.70 1.11 0.54 0.02 0.00 0.00 175.26 175.76 2kdg s ASN 258 N -3.86 2.94 0.14 -0.19 2.20 -1.26 -4.82 114.94 110.09 2kdg s ASN 258 Ca 0.61 1.92 0.03 0.00 -0.94 0.00 0.00 52.86 54.48 2kdg s ASN 258 Cb -0.15 -2.46 -0.04 0.00 -2.00 0.00 0.00 41.25 36.59 2kdg s ASN 258 CO 0.54 -3.04 -0.06 -0.04 -2.94 0.00 0.00 177.10 171.57 2kdg s MET 259 N -4.70 1.00 -0.35 3.55 -1.94 -0.75 -5.00 119.30 111.10 2kdg s MET 259 Ca 0.66 -1.44 0.00 0.00 -1.71 0.00 0.00 55.69 53.20 2kdg s MET 259 Cb -0.21 -0.36 0.14 0.00 2.01 0.00 0.00 34.83 36.40 2kdg s MET 259 CO 0.59 -0.02 0.21 -1.54 -0.01 0.00 0.00 175.02 174.24 2kdg s SER 260 N -3.13 2.93 -0.11 3.03 1.04 -1.26 -1.00 113.70 115.21 2kdg s SER 260 Ca 0.17 -2.16 -0.05 0.00 0.48 0.00 0.00 55.95 54.40 2kdg s SER 260 Cb 0.05 -0.37 -0.04 0.00 0.10 0.00 0.00 66.02 65.76 2kdg s SER 260 CO -0.00 -0.31 0.06 -0.63 0.98 0.00 0.00 173.24 173.34 2kdg s ILE 261 N 1.10 4.83 0.12 -1.02 -1.09 -0.79 -4.85 121.20 119.49 2kdg s ILE 261 Ca 0.18 -0.04 -0.31 0.00 -2.23 0.00 0.00 60.65 58.24 2kdg s ILE 261 Cb -0.23 -3.08 -0.08 0.00 -1.58 0.00 0.00 42.46 37.49 2kdg s ILE 261 CO 0.00 0.59 1.40 -0.62 -1.23 0.00 0.00 174.94 175.08 2kdg s ASP 262 N -0.72 6.81 0.02 3.58 2.15 -1.26 -0.74 116.67 126.52 2kdg s ASP 262 Ca 0.12 2.34 -0.35 0.00 0.43 0.00 0.00 52.55 55.09 2kdg s ASP 262 Cb -0.12 -2.59 -0.14 0.00 -0.30 0.00 0.00 42.92 39.78 2kdg s ASP 262 CO 0.03 -0.66 1.65 1.21 -0.17 0.00 0.00 175.17 177.23 2kdg n GLU 263 N 3.93 1.88 -0.01 4.34 2.13 -0.23 -2.35 120.64 130.34 2kdg n GLU 263 Ca 0.12 0.68 0.00 0.00 0.66 0.00 0.00 57.16 58.62 2kdg n GLU 263 Cb 0.42 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.69 2kdg n GLU 263 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2kdg n GLY 264 N 3.66 0.20 3.81 8.31 0.00 0.07 -4.78 105.19 116.47 2kdg n GLY 264 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2kdg n GLY 264 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kdg s ARG 265 N -0.95 2.87 0.28 1.61 0.52 -0.99 -4.60 118.95 117.70 2kdg s ARG 265 Ca 0.00 0.99 -0.29 0.00 -0.52 0.00 0.00 55.73 55.91 2kdg s ARG 265 Cb 0.00 -1.98 -0.09 0.00 0.52 0.00 0.00 34.95 33.40 2kdg s ARG 265 CO 0.00 -1.15 1.03 0.12 0.02 0.00 0.00 175.30 175.32 2kdg s PHE 266 N -3.00 3.69 0.29 -0.53 2.19 -1.21 -2.42 117.98 116.98 2kdg s PHE 266 Ca 0.59 1.77 -0.09 0.00 0.33 0.00 0.00 56.93 59.53 2kdg s PHE 266 Cb -0.14 -3.14 -0.00 0.00 -1.31 0.00 0.00 43.02 38.43 2kdg s PHE 266 CO 0.54 -0.16 0.47 0.00 1.83 0.00 0.00 175.22 177.91 2kdg s ARG 268 N -3.56 1.26 0.20 0.00 1.70 -1.26 -0.85 118.95 116.43 2kdg s ARG 268 Ca 0.26 -1.35 0.08 0.00 -0.47 0.00 0.00 55.73 54.25 2kdg s ARG 268 Cb -0.00 0.36 -0.05 0.00 -0.57 0.00 0.00 34.95 34.69 2kdg s ARG 268 CO 0.13 -0.46 -0.15 -1.64 -1.08 0.00 0.00 175.30 172.11 2kdg s MET 269 N -4.04 1.33 -0.32 3.89 -1.94 -0.03 -5.00 119.30 113.18 2kdg s MET 269 Ca 0.25 -1.58 -0.02 0.00 -1.71 0.00 0.00 55.69 52.63 2kdg s MET 269 Cb 0.04 -1.13 0.11 0.00 2.01 0.00 0.00 34.83 35.86 2kdg s MET 269 CO 0.06 0.19 0.15 -0.51 -0.01 0.00 0.00 175.02 174.90 2kdg s ASP 270 N -3.29 3.52 -0.32 3.03 1.11 -1.26 -3.00 116.67 116.46 2kdg s ASP 270 Ca 0.22 -1.68 -0.06 0.00 0.18 0.00 0.00 52.55 51.21 2kdg s ASP 270 Cb -0.01 -0.53 0.03 0.00 1.07 0.00 0.00 42.92 43.49 2kdg s ASP 270 CO 0.07 -0.39 0.08 -0.36 1.18 0.00 0.00 175.17 175.75 2kdg s PHE 271 N 1.62 3.22 0.52 4.23 0.40 -0.73 -3.65 117.98 123.59 2kdg s PHE 271 Ca 0.12 -1.38 -0.22 0.00 -0.60 0.00 0.00 56.93 54.86 2kdg s PHE 271 Cb -0.19 -2.24 -0.06 0.00 0.51 0.00 0.00 43.02 41.05 2kdg s PHE 271 CO -0.23 -0.70 1.22 0.15 0.70 0.00 0.00 175.22 176.37 2kdg s LYS 272 N 1.41 3.41 0.11 0.44 1.02 -0.72 -0.52 119.74 124.88 2kdg s LYS 272 Ca -0.01 1.90 -0.13 0.00 0.02 0.00 0.00 55.97 57.75 2kdg s LYS 272 Cb -0.19 -2.24 0.02 0.00 -0.52 0.00 0.00 37.83 34.90 2kdg s LYS 272 CO 0.02 -0.88 0.31 0.54 -0.92 0.00 0.00 175.35 174.42 2kdg s VAL 273 N -1.50 0.10 0.24 3.17 0.11 -0.41 -4.32 120.40 117.79 2kdg s VAL 273 Ca 0.69 -0.83 0.03 0.00 -2.93 0.00 0.00 61.98 58.94 2kdg s VAL 273 Cb -0.32 -1.24 -0.01 0.00 -1.53 0.00 0.00 36.38 33.29 2kdg s VAL 273 CO 0.37 -0.46 0.26 -0.24 -3.33 0.00 0.00 175.10 171.70 2kdg n SER 274 N -0.15 -0.70 0.00 3.54 2.88 -1.26 -4.50 113.62 113.43 2kdg n SER 274 Ca -0.16 -2.47 0.00 0.00 -1.33 0.00 0.00 58.87 54.91 2kdg n SER 274 Cb 0.63 1.45 0.00 0.00 -0.75 0.00 0.00 64.21 65.54 2kdg n SER 274 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kdg n GLY 275 N -0.43 2.38 3.20 0.46 0.00 -1.26 -4.01 105.19 105.53 2kdg n GLY 275 Ca 0.03 -1.94 -0.11 0.00 0.00 0.00 0.00 46.02 44.00 2kdg n GLY 275 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kdg s LEU 276 N 0.00 0.14 1.06 0.99 2.96 -0.61 -4.45 118.68 118.77 2kdg s LEU 276 Ca 0.00 0.75 -0.12 0.00 -0.22 0.00 0.00 54.13 54.54 2kdg s LEU 276 Cb 0.00 1.13 0.23 0.00 0.50 0.00 0.00 46.19 48.05 2kdg s LEU 276 CO 0.00 -0.18 1.07 -2.16 -1.32 0.00 0.00 176.35 173.76 2kdg s PRO 277 N 1.25 -0.10 -0.03 0.98 0.04 -1.26 -0.99 135.00 134.88 2kdg s PRO 277 Ca -0.09 0.69 -0.33 0.00 0.04 0.00 0.00 61.00 61.31 2kdg s PRO 277 Cb -0.09 -1.66 -0.12 0.00 0.04 0.00 0.00 34.50 32.68 2kdg s PRO 277 CO -0.10 -3.13 1.86 0.00 0.04 0.00 0.00 177.00 175.66 2kdg n ALA 278 N -4.48 1.08 -1.70 8.56 0.00 -1.26 -4.84 120.51 117.86 2kdg n ALA 278 Ca 0.04 0.30 -0.34 0.00 0.00 0.00 0.00 53.44 53.44 2kdg n ALA 278 Cb 0.56 -2.51 0.01 0.00 0.00 0.00 0.00 19.45 17.51 2kdg n ALA 278 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2kdg s PRO 279 N 3.68 3.24 0.38 0.00 0.04 -1.26 -4.92 135.00 136.15 2kdg s PRO 279 Ca 0.90 1.52 -0.26 0.00 0.04 0.00 0.00 61.00 63.21 2kdg s PRO 279 Cb -0.65 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 2kdg s PRO 279 CO 0.48 -0.93 1.15 0.34 0.04 0.00 0.00 177.00 178.08 2kdg s ASP 280 N -2.03 6.69 -0.48 6.66 2.15 -0.02 -4.79 116.67 124.84 2kdg s ASP 280 Ca 0.71 2.30 0.03 0.00 0.43 0.00 0.00 52.55 56.01 2kdg s ASP 280 Cb -0.22 -2.61 0.14 0.00 -0.30 0.00 0.00 42.92 39.93 2kdg s ASP 280 CO 0.31 -0.56 0.29 0.68 -0.17 0.00 0.00 175.17 175.71 2kdg s VAL 281 N -1.40 1.59 -0.35 1.11 -7.23 -1.26 -1.03 120.40 111.83 2kdg s VAL 281 Ca 0.55 -2.86 -0.29 0.00 -1.81 0.00 0.00 61.98 57.56 2kdg s VAL 281 Cb -0.30 -2.10 0.01 0.00 0.56 0.00 0.00 36.38 34.55 2kdg s VAL 281 CO 0.38 -0.94 1.25 -0.44 -0.31 0.00 0.00 175.10 175.04 2kdg s SER 282 N 0.02 6.66 0.28 4.85 0.01 -0.87 -4.87 113.70 119.78 2kdg s SER 282 Ca 0.20 1.00 -0.07 0.00 1.31 0.00 0.00 55.95 58.40 2kdg s SER 282 Cb -0.19 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.44 2kdg s SER 282 CO -0.04 -1.13 0.57 0.26 0.41 0.00 0.00 173.24 173.31 2kdg s TRP 283 N 4.43 3.46 0.07 2.43 0.52 -1.26 -1.00 118.94 127.59 2kdg s TRP 283 Ca 0.54 0.76 -0.06 0.00 0.02 0.00 0.00 56.10 57.36 2kdg s TRP 283 Cb -0.14 -2.19 -0.02 0.00 -1.15 0.00 0.00 33.47 29.97 2kdg s TRP 283 CO 0.25 0.18 0.10 0.71 0.02 0.00 0.00 176.95 178.20 2kdg s TYR 284 N -2.03 0.30 -0.13 -1.98 1.51 0.09 -1.07 117.35 114.05 2kdg s TYR 284 Ca 0.46 -0.78 -0.04 0.00 -1.01 0.00 0.00 57.07 55.70 2kdg s TYR 284 Cb -0.11 -0.19 0.06 0.00 -0.11 0.00 0.00 41.96 41.61 2kdg s TYR 284 CO 0.27 -0.47 0.24 -1.17 -1.11 0.00 0.00 175.55 173.31 2kdg s LEU 285 N -2.87 -0.24 -0.69 -1.29 2.96 0.02 -1.48 118.68 115.08 2kdg s LEU 285 Ca 0.06 0.48 0.00 0.00 -0.22 0.00 0.00 54.13 54.45 2kdg s LEU 285 Cb 0.06 0.59 0.00 0.00 0.50 0.00 0.00 46.19 47.34 2kdg s LEU 285 CO -0.11 -0.25 0.00 0.59 -1.32 0.00 0.00 176.35 175.27 2kdg n ASN 286 N 5.34 -4.32 0.00 3.68 3.02 -0.39 -1.42 115.26 121.16 2kdg n ASN 286 Ca -0.06 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2kdg n ASN 286 Cb 0.50 -3.16 0.00 0.00 -0.61 0.00 0.00 39.78 36.51 2kdg n ASN 286 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kdg n GLY 287 N 0.32 1.14 3.90 7.41 0.00 -1.26 -5.07 105.19 111.62 2kdg n GLY 287 Ca -0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 2kdg n GLY 287 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kdg s ARG 288 N -0.58 3.61 0.67 1.61 0.52 -0.51 -5.10 118.95 119.17 2kdg s ARG 288 Ca 0.00 0.22 -0.14 0.00 -0.52 0.00 0.00 55.73 55.29 2kdg s ARG 288 Cb 0.00 -2.42 0.01 0.00 0.52 0.00 0.00 34.95 33.05 2kdg s ARG 288 CO 0.00 -0.10 1.09 0.95 0.02 0.00 0.00 175.30 177.26 2kdg s THR 289 N -2.55 3.51 -0.24 0.02 -4.23 -1.26 -0.80 115.64 110.08 2kdg s THR 289 Ca 0.48 0.62 -0.02 0.00 -1.18 0.00 0.00 61.69 61.59 2kdg s THR 289 Cb -0.10 -3.17 0.08 0.00 1.34 0.00 0.00 72.50 70.64 2kdg s THR 289 CO 0.39 -0.51 0.06 -0.69 -0.54 0.00 0.00 174.62 173.33 2kdg s VAL 290 N -2.60 0.62 0.69 2.29 1.01 -0.24 -4.66 120.40 117.53 2kdg s VAL 290 Ca 0.64 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 2kdg s VAL 290 Cb -0.18 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 34.95 2kdg s VAL 290 CO 0.46 -0.40 1.06 -1.10 0.00 0.00 0.00 175.10 175.12 2kdg s GLN 291 N 1.78 2.91 0.69 2.72 -0.21 -1.26 -4.11 119.66 122.18 2kdg s GLN 291 Ca 0.03 1.01 -0.14 0.00 0.02 0.00 0.00 55.36 56.28 2kdg s GLN 291 Cb -0.17 -1.98 0.02 0.00 1.00 0.00 0.00 33.01 31.87 2kdg s GLN 291 CO -0.16 -1.13 1.11 -1.54 -2.12 0.00 0.00 175.29 171.46 2kdg s SER 292 N -3.63 4.89 0.23 5.90 1.04 -1.26 -4.98 113.70 115.90 2kdg s SER 292 Ca 0.59 2.00 -0.14 0.00 0.48 0.00 0.00 55.95 58.87 2kdg s SER 292 Cb -0.15 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.43 2kdg s SER 292 CO 0.53 -1.77 0.50 -0.62 0.98 0.00 0.00 173.24 172.85 2kdg s ASP 293 N -2.69 -0.13 0.37 7.02 2.15 -0.70 -4.96 116.67 117.73 2kdg s ASP 293 Ca 0.66 -0.80 0.07 0.00 0.43 0.00 0.00 52.55 52.91 2kdg s ASP 293 Cb -0.21 0.59 0.78 0.00 -0.30 0.00 0.00 42.92 43.79 2kdg s ASP 293 CO 0.45 -1.13 1.96 -0.78 -0.17 0.00 0.00 175.17 175.50 2kdg h ASP 294 N 2.24 0.62 1.76 -0.34 3.58 -2.01 -1.86 116.42 120.42 2kdg h ASP 294 Ca -0.26 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2kdg h ASP 294 Cb 1.25 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.17 2kdg h ASP 294 CO 0.35 0.40 -0.02 -0.07 -2.88 0.00 0.00 179.24 177.02 2kdg h LEU 295 N 0.71 0.00 -6.08 2.28 3.38 -1.96 -3.41 115.31 110.23 2kdg h LEU 295 Ca 0.31 -0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.71 2kdg h LEU 295 Cb 0.32 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.67 2kdg h LEU 295 CO -0.11 0.00 -0.96 1.41 0.09 0.00 0.00 178.44 178.87 2kdg n HIS 296 N -2.74 0.72 -2.43 1.13 8.25 -0.71 -1.23 115.22 118.22 2kdg n HIS 296 Ca 0.05 -3.72 -0.39 0.00 -0.26 0.00 0.00 57.72 53.40 2kdg n HIS 296 Cb 0.49 -0.39 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 2kdg n HIS 296 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2kdg s LYS 297 N -1.48 4.37 -0.31 -0.41 1.02 -1.13 -1.72 119.74 120.06 2kdg s LYS 297 Ca 0.36 1.77 -0.02 0.00 0.02 0.00 0.00 55.97 58.10 2kdg s LYS 297 Cb 0.16 -2.90 0.10 0.00 -0.52 0.00 0.00 37.83 34.67 2kdg s LYS 297 CO -0.09 -0.03 0.13 -1.64 -0.92 0.00 0.00 175.35 172.81 2kdg s MET 298 N -1.93 0.47 0.08 1.68 -1.94 -1.26 -2.02 119.30 114.39 2kdg s MET 298 Ca 0.51 -0.87 0.01 0.00 -1.71 0.00 0.00 55.69 53.63 2kdg s MET 298 Cb -0.30 -1.54 -0.04 0.00 2.01 0.00 0.00 34.83 34.96 2kdg s MET 298 CO 0.38 -1.03 -0.05 0.96 -0.01 0.00 0.00 175.02 175.26 2kdg s ILE 299 N 1.75 0.55 -0.05 2.53 -0.00 -1.15 -5.04 121.20 119.78 2kdg s ILE 299 Ca 0.10 -1.89 -0.02 0.00 -0.00 0.00 0.00 60.65 58.85 2kdg s ILE 299 Cb -0.17 -1.62 0.04 0.00 -0.00 0.00 0.00 42.46 40.70 2kdg s ILE 299 CO -0.28 -0.91 0.09 0.54 -0.00 0.00 0.00 174.94 174.39 2kdg s VAL 300 N -3.68 -0.14 0.51 8.37 0.11 -1.26 -0.69 120.40 123.62 2kdg s VAL 300 Ca 0.10 0.35 -0.21 0.00 -2.93 0.00 0.00 61.98 59.29 2kdg s VAL 300 Cb 0.06 -0.19 -0.06 0.00 -1.53 0.00 0.00 36.38 34.65 2kdg s VAL 300 CO -0.06 0.15 1.15 -0.44 -3.33 0.00 0.00 175.10 172.56 2kdg s SER 301 N 1.94 5.89 0.41 3.54 0.01 -0.36 -4.93 113.70 120.19 2kdg s SER 301 Ca 0.01 2.23 0.12 0.00 1.31 0.00 0.00 55.95 59.62 2kdg s SER 301 Cb -0.12 -2.59 0.95 0.00 0.21 0.00 0.00 66.02 64.47 2kdg s SER 301 CO -0.04 -1.11 1.95 -0.08 0.41 0.00 0.00 173.24 174.37 2kdg h GLU 302 N 1.52 0.50 0.00 12.44 4.57 -2.02 -1.51 114.58 130.09 2kdg h GLU 302 Ca -0.50 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 2kdg h GLU 302 Cb 1.26 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 2kdg h GLU 302 CO 0.58 0.33 0.00 1.63 -1.18 0.00 0.00 179.01 180.37 2kdg n LYS 303 N -4.49 0.92 -0.35 1.92 5.02 -1.26 -4.91 118.16 115.02 2kdg n LYS 303 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2kdg n LYS 303 Cb 0.39 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 2kdg n LYS 303 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kdg n GLY 304 N 0.82 0.50 2.74 0.72 0.00 -0.57 -4.97 105.19 104.43 2kdg n GLY 304 Ca 0.21 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2kdg n GLY 304 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kdg s LEU 305 N -0.35 1.55 -0.28 0.99 2.96 -1.23 -1.29 118.68 121.02 2kdg s LEU 305 Ca 0.00 -1.11 -0.23 0.00 -0.22 0.00 0.00 54.13 52.56 2kdg s LEU 305 Cb 0.00 -0.70 -0.00 0.00 0.50 0.00 0.00 46.19 45.99 2kdg s LEU 305 CO 0.00 -0.34 0.78 -2.28 -1.32 0.00 0.00 176.35 173.19 2kdg s HIS 306 N 1.77 3.24 0.12 5.38 5.65 0.32 -1.23 115.29 130.55 2kdg s HIS 306 Ca 0.02 0.91 -0.13 0.00 0.25 0.00 0.00 55.06 56.12 2kdg s HIS 306 Cb -0.17 -3.12 -0.06 0.00 -1.18 0.00 0.00 32.58 28.04 2kdg s HIS 306 CO -0.15 -0.49 0.49 -1.12 -0.65 0.00 0.00 174.74 172.83 2kdg s SER 307 N 1.52 6.76 -0.11 9.88 0.01 0.13 -1.77 113.70 130.12 2kdg s SER 307 Ca 0.32 0.97 -0.03 0.00 1.31 0.00 0.00 55.95 58.53 2kdg s SER 307 Cb -0.15 -2.25 0.04 0.00 0.21 0.00 0.00 66.02 63.88 2kdg s SER 307 CO 0.10 0.13 0.05 -0.22 0.41 0.00 0.00 173.24 173.72 2kdg s LEU 308 N -1.93 0.45 0.15 2.44 1.98 -1.16 -2.96 118.68 117.65 2kdg s LEU 308 Ca 0.36 -0.28 0.04 0.00 -2.89 0.00 0.00 54.13 51.35 2kdg s LEU 308 Cb -0.15 -0.30 -0.04 0.00 0.66 0.00 0.00 46.19 46.37 2kdg s LEU 308 CO 0.19 -0.27 0.18 -0.63 -1.89 0.00 0.00 176.35 173.92 2kdg s ILE 309 N 2.07 4.78 -0.22 6.68 1.09 -0.85 -0.85 121.20 133.89 2kdg s ILE 309 Ca 0.03 -0.90 -0.02 0.00 -1.10 0.00 0.00 60.65 58.67 2kdg s ILE 309 Cb -0.14 -3.43 0.07 0.00 -1.06 0.00 0.00 42.46 37.90 2kdg s ILE 309 CO -0.06 -0.07 0.02 -0.36 -0.10 0.00 0.00 174.94 174.38 2kdg s PHE 310 N -1.70 1.51 0.11 3.97 0.40 -0.03 -3.86 117.98 118.37 2kdg s PHE 310 Ca 0.32 -1.25 -0.17 0.00 -0.60 0.00 0.00 56.93 55.23 2kdg s PHE 310 Cb -0.11 -1.29 -0.05 0.00 0.51 0.00 0.00 43.02 42.09 2kdg s PHE 310 CO 0.25 -0.70 1.59 0.93 0.70 0.00 0.00 175.22 177.99 2kdg h GLU 311 N 8.14 0.53 -0.95 0.44 4.39 -1.42 -1.28 114.58 124.43 2kdg h GLU 311 Ca -0.16 -0.14 -0.38 0.00 0.34 0.00 0.00 59.36 59.02 2kdg h GLU 311 Cb 1.09 -0.06 -0.26 0.00 -0.10 0.00 0.00 28.75 29.42 2kdg h GLU 311 CO 0.38 0.61 -0.78 1.55 -1.16 0.00 0.00 179.01 179.61 2kdg n VAL 312 N -4.62 -0.33 -1.75 3.13 3.14 -1.25 -3.36 118.33 113.30 2kdg n VAL 312 Ca -0.02 -2.67 -0.40 0.00 -2.96 0.00 0.00 64.34 58.29 2kdg n VAL 312 Cb 0.21 -0.13 0.01 0.00 -1.06 0.00 0.00 33.84 32.88 2kdg n VAL 312 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 2kdg n VAL 313 N 1.56 2.61 -4.49 1.55 3.14 -1.01 -4.66 118.33 117.03 2kdg n VAL 313 Ca 0.15 -0.50 -0.24 0.00 -2.96 0.00 0.00 64.34 60.78 2kdg n VAL 313 Cb 0.58 -1.79 -0.10 0.00 -1.06 0.00 0.00 33.84 31.47 2kdg n VAL 313 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 2kdg s ARG 314 N -2.33 1.71 0.50 1.45 1.81 -1.26 -0.75 118.95 120.07 2kdg s ARG 314 Ca 0.60 -1.82 0.21 0.00 -1.72 0.00 0.00 55.73 53.00 2kdg s ARG 314 Cb -0.47 -1.68 1.27 0.00 -0.45 0.00 0.00 34.95 33.62 2kdg s ARG 314 CO 0.59 0.24 1.99 0.00 -0.68 0.00 0.00 175.30 177.43 2kdg h ALA 315 N 2.19 2.34 0.00 2.13 0.00 -1.94 -0.63 119.26 123.35 2kdg h ALA 315 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2kdg h ALA 315 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2kdg h ALA 315 CO 0.64 -0.49 0.00 0.66 0.00 0.00 0.00 179.25 180.07 2kdg h SER 316 N 0.14 0.00 0.62 0.00 4.64 -1.96 -2.92 113.55 114.06 2kdg h SER 316 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2kdg h SER 316 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2kdg h SER 316 CO -0.04 0.00 -0.12 0.47 -0.87 0.00 0.00 176.83 176.27 2kdg n ASP 317 N -2.63 0.25 -4.76 4.97 8.00 -0.24 -4.93 116.55 117.21 2kdg n ASP 317 Ca 0.01 -0.12 -0.36 0.00 0.71 0.00 0.00 54.79 55.03 2kdg n ASP 317 Cb 0.22 -0.19 0.03 0.00 -0.02 0.00 0.00 41.12 41.16 2kdg n ASP 317 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kdg s ALA 318 N -2.74 2.59 0.00 2.24 0.00 -1.10 -4.95 121.76 117.80 2kdg s ALA 318 Ca 0.21 1.00 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2kdg s ALA 318 Cb 0.19 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2kdg s ALA 318 CO 0.53 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.59 2kdg n GLY 319 N 0.48 0.85 3.56 0.00 0.00 -0.21 -5.00 105.19 104.87 2kdg n GLY 319 Ca 0.13 -1.89 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 2kdg n GLY 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kdg s ALA 320 N -1.02 3.09 0.36 4.61 0.00 -1.26 -1.19 121.76 126.35 2kdg s ALA 320 Ca 0.00 -0.97 -0.16 0.00 0.00 0.00 0.00 51.96 50.83 2kdg s ALA 320 Cb 0.00 -3.88 -0.09 0.00 0.00 0.00 0.00 23.12 19.15 2kdg s ALA 320 CO 0.00 -2.48 0.81 0.71 0.00 0.00 0.00 175.76 174.79 2kdg s TYR 321 N 4.44 3.36 0.11 0.00 1.51 -0.30 -1.26 117.35 125.21 2kdg s TYR 321 Ca 0.38 1.32 -0.06 0.00 -1.01 0.00 0.00 57.07 57.70 2kdg s TYR 321 Cb -0.10 -2.63 -0.02 0.00 -0.11 0.00 0.00 41.96 39.11 2kdg s TYR 321 CO 0.23 0.01 0.15 0.00 -1.11 0.00 0.00 175.55 174.83 2kdg s ALA 322 N -2.08 0.16 0.00 3.71 0.00 -0.55 -1.40 121.76 121.60 2kdg s ALA 322 Ca 0.56 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2kdg s ALA 322 Cb -0.10 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.62 2kdg s ALA 322 CO 0.17 -0.51 -0.01 0.00 0.00 0.00 0.00 175.76 175.41 2kdg s VAL 324 N -0.09 2.07 -0.21 0.00 1.01 -0.17 -0.86 120.40 122.16 2kdg s VAL 324 Ca -0.00 -1.93 -0.23 0.00 0.00 0.00 0.00 61.98 59.81 2kdg s VAL 324 Cb -0.01 -2.39 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 2kdg s VAL 324 CO -0.00 -0.36 0.76 0.00 0.00 0.00 0.00 175.10 175.50 2kdg s ALA 325 N 1.07 3.58 -0.04 5.51 0.00 -0.09 -2.05 121.76 129.74 2kdg s ALA 325 Ca 0.03 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 51.86 2kdg s ALA 325 Cb -0.19 -3.16 0.01 0.00 0.00 0.00 0.00 23.12 19.78 2kdg s ALA 325 CO -0.08 -0.74 -0.08 0.15 0.00 0.00 0.00 175.76 175.02 2kdg s LYS 326 N 2.36 1.06 0.34 0.00 1.02 -0.20 -1.02 119.74 123.29 2kdg s LYS 326 Ca 0.33 -0.25 0.03 0.00 0.02 0.00 0.00 55.97 56.11 2kdg s LYS 326 Cb -0.16 -0.97 -0.01 0.00 -0.52 0.00 0.00 37.83 36.17 2kdg s LYS 326 CO 0.10 0.03 0.13 0.27 -0.92 0.00 0.00 175.35 174.95 2kdg n ASN 327 N 3.65 1.11 0.09 2.83 0.23 -0.63 -0.84 115.26 121.71 2kdg n ASN 327 Ca -0.22 -2.81 0.06 0.00 -0.53 0.00 0.00 54.58 51.08 2kdg n ASN 327 Cb 0.53 0.88 0.33 0.00 -2.08 0.00 0.00 39.78 39.43 2kdg n ASN 327 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 2kdg n ARG 328 N -0.76 0.08 -0.00 -3.83 1.85 -1.26 -2.82 116.66 109.92 2kdg n ARG 328 Ca -0.04 0.57 0.03 0.00 -1.00 0.00 0.00 57.85 57.41 2kdg n ARG 328 Cb 0.51 -1.77 -0.05 0.00 -1.05 0.00 0.00 32.46 30.10 2kdg n ARG 328 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2kdg n ALA 329 N -1.64 2.46 0.00 2.89 0.00 -1.26 -5.09 120.51 117.87 2kdg n ALA 329 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2kdg n ALA 329 Cb 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.24 2kdg n ALA 329 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kdg n GLY 330 N 1.80 -1.25 3.00 0.00 0.00 -1.13 -4.54 105.19 103.07 2kdg n GLY 330 Ca -0.00 -0.98 -0.15 0.00 0.00 0.00 0.00 46.02 44.89 2kdg n GLY 330 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kdg s GLU 331 N -0.88 0.47 0.08 1.61 2.12 -1.26 -1.60 118.70 119.23 2kdg s GLU 331 Ca 0.00 -0.42 -0.01 0.00 0.36 0.00 0.00 54.97 54.90 2kdg s GLU 331 Cb 0.00 -0.36 -0.04 0.00 0.26 0.00 0.00 34.13 33.98 2kdg s GLU 331 CO 0.00 0.09 -0.00 0.00 -0.54 0.00 0.00 175.26 174.81 2kdg s ALA 332 N -0.63 0.66 0.01 6.30 0.00 -0.19 -4.81 121.76 123.10 2kdg s ALA 332 Ca -0.03 -1.31 0.01 0.00 0.00 0.00 0.00 51.96 50.63 2kdg s ALA 332 Cb -0.05 0.48 -0.01 0.00 0.00 0.00 0.00 23.12 23.54 2kdg s ALA 332 CO 0.00 -0.41 -0.04 0.99 0.00 0.00 0.00 175.76 176.30 2kdg s THR 333 N -3.95 0.29 0.07 0.00 2.01 -1.26 -0.91 115.64 111.89 2kdg s THR 333 Ca 0.13 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.67 2kdg s THR 333 Cb 0.08 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 2kdg s THR 333 CO -0.05 -0.14 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.28 2kdg s PHE 334 N -0.63 0.87 -0.05 4.92 0.08 -0.04 -4.92 117.98 118.21 2kdg s PHE 334 Ca -0.05 -0.58 -0.11 0.00 0.12 0.00 0.00 56.93 56.31 2kdg s PHE 334 Cb -0.05 -0.50 0.02 0.00 -0.57 0.00 0.00 43.02 41.92 2kdg s PHE 334 CO -0.00 -0.05 0.26 0.99 -0.10 0.00 0.00 175.22 176.32 2kdg s THR 335 N -1.87 0.04 0.31 0.64 2.01 -1.26 -1.16 115.64 114.35 2kdg s THR 335 Ca -0.03 -0.34 -0.12 0.00 0.31 0.00 0.00 61.69 61.52 2kdg s THR 335 Cb -0.07 -0.49 0.01 0.00 0.01 0.00 0.00 72.50 71.97 2kdg s THR 335 CO -0.00 -0.19 0.57 0.54 -0.69 0.00 0.00 174.62 174.85 2kdg s VAL 336 N -0.78 0.00 0.03 3.82 0.11 -0.49 -4.82 120.40 118.27 2kdg s VAL 336 Ca -0.09 -1.33 0.05 0.00 -2.93 0.00 0.00 61.98 57.68 2kdg s VAL 336 Cb -0.05 -2.45 -0.02 0.00 -1.53 0.00 0.00 36.38 32.34 2kdg s VAL 336 CO 0.02 0.00 -0.14 -1.58 -3.33 0.00 0.00 175.10 170.07 2kdg s GLN 337 N -3.37 1.00 -0.23 1.54 0.74 -1.26 -1.15 119.66 116.93 2kdg s GLN 337 Ca 0.22 -0.70 -0.00 0.00 0.05 0.00 0.00 55.36 54.92 2kdg s GLN 337 Cb -0.02 -1.00 0.06 0.00 1.10 0.00 0.00 33.01 33.15 2kdg s GLN 337 CO 0.12 0.26 -0.01 -1.17 -0.55 0.00 0.00 175.29 173.94 2kdg s LEU 338 N -0.94 2.16 0.38 3.68 2.96 -0.33 -1.82 118.68 124.77 2kdg s LEU 338 Ca 0.03 -1.12 -0.24 0.00 -0.22 0.00 0.00 54.13 52.58 2kdg s LEU 338 Cb -0.07 -0.98 -0.10 0.00 0.50 0.00 0.00 46.19 45.53 2kdg s LEU 338 CO 0.01 -0.27 0.96 -1.81 -1.32 0.00 0.00 176.35 173.91 2kdg s ASP 339 N 1.54 7.09 -0.25 3.68 1.01 -0.17 -1.05 116.67 128.53 2kdg s ASP 339 Ca -0.03 1.80 -0.00 0.00 0.71 0.00 0.00 52.55 55.03 2kdg s ASP 339 Cb -0.18 -2.56 0.07 0.00 1.01 0.00 0.00 42.92 41.26 2kdg s ASP 339 CO -0.08 -0.25 0.01 -0.69 0.21 0.00 0.00 175.17 174.37 2kdg s VAL 340 N -1.86 1.24 -0.57 -1.27 1.01 -1.26 -1.89 120.40 115.79 2kdg s VAL 340 Ca 0.56 -1.23 -0.27 0.00 0.00 0.00 0.00 61.98 61.05 2kdg s VAL 340 Cb -0.15 -1.69 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 2kdg s VAL 340 CO 0.20 -0.30 1.77 -0.76 0.00 0.00 0.00 175.10 176.01 2kdg s LEU 341 N 1.50 3.33 0.70 3.92 1.43 0.09 -4.73 118.68 124.91 2kdg s LEU 341 Ca 0.00 0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 53.37 2kdg s LEU 341 Cb -0.18 -2.73 0.02 0.00 0.03 0.00 0.00 46.19 43.33 2kdg s LEU 341 CO -0.11 -2.18 1.27 0.00 0.23 0.00 0.00 176.35 175.56 2kdg n ALA 342 N 11.88 0.77 -0.19 4.21 0.00 -1.26 -1.06 120.51 134.85 2kdg n ALA 342 Ca 0.19 -0.11 -0.10 0.00 0.00 0.00 0.00 53.44 53.42 2kdg n ALA 342 Cb 0.51 -2.30 0.01 0.00 0.00 0.00 0.00 19.45 17.67 2kdg n ALA 342 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2kdg h LYS 343 N 0.04 0.98 0.00 0.00 1.63 -1.94 -3.45 116.57 113.83 2kdg h LYS 343 Ca -0.49 -0.33 0.00 0.00 -0.85 0.00 0.00 60.65 58.98 2kdg h LYS 343 Cb 1.33 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 2kdg h LYS 343 CO 0.51 1.00 0.00 0.39 -3.45 0.00 0.00 179.45 177.90