#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 2.00 0.33 4.61 0.00 -1.26 -5.08 121.76 122.36 2kdg s ALA -3 Ca 0.00 0.62 -0.07 0.00 0.00 0.00 0.00 51.96 52.51 2kdg s ALA -3 Cb 0.00 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.73 2kdg s ALA -3 CO 0.00 -2.04 0.53 0.00 0.00 0.00 0.00 175.76 174.24 2kdg s MET -2 N -4.37 1.90 -0.05 0.00 0.23 -1.26 -5.06 119.30 110.69 2kdg s MET -2 Ca 0.68 -1.61 -0.31 0.00 -1.03 0.00 0.00 55.69 53.42 2kdg s MET -2 Cb -0.23 0.48 0.13 0.00 -1.53 0.00 0.00 34.83 33.67 2kdg s MET -2 CO 0.51 -0.81 1.35 0.20 -2.03 0.00 0.00 175.02 174.24 2kdg s GLY -1 N -3.17 -0.40 0.81 3.16 0.00 -0.47 -4.98 107.32 102.27 2kdg s GLY -1 Ca 0.27 0.68 -0.11 0.00 0.00 0.00 0.00 44.72 45.56 2kdg s GLY -1 CO 0.17 1.22 1.09 2.56 0.00 0.00 0.00 173.10 178.14 2kdg s PRO 249 N -2.20 1.98 0.59 2.90 0.04 -1.26 -1.26 135.00 135.79 2kdg s PRO 249 Ca 0.17 0.97 -0.18 0.00 0.04 0.00 0.00 61.00 62.00 2kdg s PRO 249 Cb 0.05 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.68 2kdg s PRO 249 CO -0.05 -1.78 1.17 -1.25 0.04 0.00 0.00 177.00 175.14 2kdg s PRO 250 N -4.96 3.01 0.04 0.56 0.04 -1.26 -4.29 135.00 128.15 2kdg s PRO 250 Ca 0.61 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2kdg s PRO 250 Cb -0.17 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2kdg s PRO 250 CO 0.56 -1.15 -0.05 0.50 0.04 0.00 0.00 177.00 176.91 2kdg s ARG 251 N -3.44 0.50 -0.14 4.56 3.52 -1.02 -4.62 118.95 118.32 2kdg s ARG 251 Ca 0.75 -0.89 -0.29 0.00 -0.13 0.00 0.00 55.73 55.17 2kdg s ARG 251 Cb -0.27 0.00 -0.04 0.00 -1.56 0.00 0.00 34.95 33.08 2kdg s ARG 251 CO 0.33 -0.04 1.66 -0.06 -0.81 0.00 0.00 175.30 176.38 2kdg s PHE 252 N -2.32 2.01 -0.04 5.12 0.08 -1.26 -4.04 117.98 117.52 2kdg s PHE 252 Ca -0.05 0.38 -0.07 0.00 0.12 0.00 0.00 56.93 57.30 2kdg s PHE 252 Cb -0.04 -3.94 -0.03 0.00 -0.57 0.00 0.00 43.02 38.44 2kdg s PHE 252 CO -0.03 -3.42 -0.15 -0.89 -0.10 0.00 0.00 175.22 170.62 2kdg n ILE 253 N 6.01 1.20 -3.74 0.64 2.08 -1.25 -5.06 119.36 119.24 2kdg n ILE 253 Ca 0.19 0.19 -0.12 0.00 0.56 0.00 0.00 62.75 63.56 2kdg n ILE 253 Cb 0.44 -1.86 -0.11 0.00 -0.75 0.00 0.00 39.64 37.36 2kdg n ILE 253 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2kdg s GLN 254 N -2.36 0.38 0.09 0.38 0.74 -1.25 -5.01 119.66 112.64 2kdg s GLN 254 Ca -0.14 0.54 0.04 0.00 0.05 0.00 0.00 55.36 55.85 2kdg s GLN 254 Cb 0.03 0.12 -0.03 0.00 1.10 0.00 0.00 33.01 34.23 2kdg s GLN 254 CO 0.19 -0.08 -0.12 0.14 -0.55 0.00 0.00 175.29 174.88 2kdg s VAL 255 N 0.51 1.03 0.76 1.34 -7.23 -1.26 -2.95 120.40 112.61 2kdg s VAL 255 Ca -0.03 -1.56 -0.11 0.00 -1.81 0.00 0.00 61.98 58.47 2kdg s VAL 255 Cb -0.04 -1.29 0.05 0.00 0.56 0.00 0.00 36.38 35.65 2kdg s VAL 255 CO -0.03 -0.45 1.08 -2.16 -0.31 0.00 0.00 175.10 173.23 2kdg s PRO 256 N -2.49 2.38 1.22 4.82 0.04 -1.26 -5.10 135.00 134.62 2kdg s PRO 256 Ca 0.04 0.77 -0.20 0.00 0.04 0.00 0.00 61.00 61.64 2kdg s PRO 256 Cb -0.05 -1.94 0.30 0.00 0.04 0.00 0.00 34.50 32.85 2kdg s PRO 256 CO 0.01 -1.44 1.15 -1.21 0.04 0.00 0.00 177.00 175.54 2kdg s GLU 257 N -5.10 -1.38 0.44 4.56 0.41 -1.26 -4.91 118.70 111.45 2kdg s GLU 257 Ca 0.60 -0.26 -0.25 0.00 -0.41 0.00 0.00 54.97 54.65 2kdg s GLU 257 Cb -0.14 -1.60 -0.09 0.00 -1.78 0.00 0.00 34.13 30.52 2kdg s GLU 257 CO 0.55 -3.78 1.34 0.27 -0.49 0.00 0.00 175.26 173.15 2kdg n ASN 258 N -4.77 2.89 -4.40 -0.19 6.94 -1.26 -4.69 115.26 109.78 2kdg n ASN 258 Ca 0.16 1.11 -0.23 0.00 -0.02 0.00 0.00 54.58 55.60 2kdg n ASN 258 Cb 0.60 -1.55 -0.11 0.00 -2.36 0.00 0.00 39.78 36.37 2kdg n ASN 258 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 2kdg s MET 259 N -2.32 1.47 -0.08 -3.83 -1.94 -0.08 -5.00 119.30 107.52 2kdg s MET 259 Ca 0.61 -1.58 -0.04 0.00 -1.71 0.00 0.00 55.69 52.97 2kdg s MET 259 Cb -0.48 -1.55 0.04 0.00 2.01 0.00 0.00 34.83 34.85 2kdg s MET 259 CO 0.58 0.30 0.18 -1.54 -0.01 0.00 0.00 175.02 174.53 2kdg s SER 260 N -3.05 -0.12 -0.03 3.03 1.04 -1.26 -0.86 113.70 112.45 2kdg s SER 260 Ca 0.23 0.37 0.02 0.00 0.48 0.00 0.00 55.95 57.04 2kdg s SER 260 Cb -0.05 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.34 2kdg s SER 260 CO 0.10 -0.16 -0.05 -0.63 0.98 0.00 0.00 173.24 173.48 2kdg s ILE 261 N 1.25 0.54 0.18 -1.02 -1.09 -1.22 -4.95 121.20 114.88 2kdg s ILE 261 Ca -0.09 -0.19 -0.31 0.00 -2.23 0.00 0.00 60.65 57.83 2kdg s ILE 261 Cb -0.11 -0.52 -0.10 0.00 -1.58 0.00 0.00 42.46 40.15 2kdg s ILE 261 CO -0.07 0.20 1.57 -0.62 -1.23 0.00 0.00 174.94 174.78 2kdg s ASP 262 N 0.46 6.57 0.03 3.58 2.15 -1.26 -0.76 116.67 127.44 2kdg s ASP 262 Ca -0.06 2.66 -0.36 0.00 0.43 0.00 0.00 52.55 55.22 2kdg s ASP 262 Cb -0.10 -2.60 -0.14 0.00 -0.30 0.00 0.00 42.92 39.78 2kdg s ASP 262 CO 0.00 -0.83 1.59 1.21 -0.17 0.00 0.00 175.17 176.98 2kdg n GLU 263 N 3.69 1.74 0.00 4.34 2.13 -0.29 -2.45 120.64 129.80 2kdg n GLU 263 Ca 0.13 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.58 2kdg n GLU 263 Cb 0.38 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.73 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 3.46 0.12 3.79 8.31 0.00 -0.05 -4.82 105.19 116.00 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 -0.96 2.53 0.50 1.61 0.52 -1.03 -4.57 118.95 117.55 2kdg s ARG 265 Ca 0.00 1.01 -0.20 0.00 -0.52 0.00 0.00 55.73 56.01 2kdg s ARG 265 Cb 0.00 -1.94 -0.07 0.00 0.52 0.00 0.00 34.95 33.46 2kdg s ARG 265 CO 0.00 -1.40 1.08 0.12 0.02 0.00 0.00 175.30 175.12 2kdg s PHE 266 N -2.99 2.89 0.07 -0.53 2.19 -1.25 -2.02 117.98 116.33 2kdg s PHE 266 Ca 0.60 1.57 -0.12 0.00 0.33 0.00 0.00 56.93 59.31 2kdg s PHE 266 Cb -0.15 -3.18 0.01 0.00 -1.31 0.00 0.00 43.02 38.39 2kdg s PHE 266 CO 0.55 -1.14 0.26 0.00 1.83 0.00 0.00 175.22 176.72 2kdg s ARG 268 N -3.09 0.61 -0.20 0.00 1.70 -1.26 -0.62 118.95 116.08 2kdg s ARG 268 Ca -0.01 -0.69 0.01 0.00 -0.47 0.00 0.00 55.73 54.57 2kdg s ARG 268 Cb 0.01 0.25 0.05 0.00 -0.57 0.00 0.00 34.95 34.69 2kdg s ARG 268 CO -0.07 -0.16 -0.08 -1.64 -1.08 0.00 0.00 175.30 172.27 2kdg s MET 269 N -2.51 1.79 0.06 3.89 -1.94 -0.11 -5.00 119.30 115.49 2kdg s MET 269 Ca -0.06 -0.83 -0.31 0.00 -1.71 0.00 0.00 55.69 52.79 2kdg s MET 269 Cb -0.02 -2.40 -0.07 0.00 2.01 0.00 0.00 34.83 34.36 2kdg s MET 269 CO -0.04 -0.48 1.41 0.16 -0.01 0.00 0.00 175.02 176.06 2kdg s ASP 270 N 1.44 6.83 -0.34 3.03 -4.77 -1.26 -2.87 116.67 118.72 2kdg s ASP 270 Ca -0.02 2.23 -0.01 0.00 -3.30 0.00 0.00 52.55 51.45 2kdg s ASP 270 Cb -0.17 -2.57 0.12 0.00 -1.09 0.00 0.00 42.92 39.21 2kdg s ASP 270 CO -0.07 -0.69 0.18 -0.36 0.70 0.00 0.00 175.17 174.92 2kdg s PHE 271 N 1.78 0.84 -0.04 2.11 0.08 -0.74 -4.30 117.98 117.71 2kdg s PHE 271 Ca 0.65 -1.51 -0.30 0.00 0.12 0.00 0.00 56.93 55.89 2kdg s PHE 271 Cb -0.34 -1.10 -0.06 0.00 -0.57 0.00 0.00 43.02 40.95 2kdg s PHE 271 CO 0.29 -0.83 1.61 0.15 -0.10 0.00 0.00 175.22 176.34 2kdg s LYS 272 N 1.34 4.20 -0.13 0.44 1.02 -1.15 -0.96 119.74 124.49 2kdg s LYS 272 Ca 0.15 2.16 -0.02 0.00 0.02 0.00 0.00 55.97 58.28 2kdg s LYS 272 Cb -0.21 -3.88 0.04 0.00 -0.52 0.00 0.00 37.83 33.27 2kdg s LYS 272 CO -0.12 -0.80 0.02 0.54 -0.92 0.00 0.00 175.35 174.07 2kdg s VAL 273 N 3.65 0.43 -0.25 3.17 0.11 -0.13 -3.75 120.40 123.63 2kdg s VAL 273 Ca 0.72 -0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.60 2kdg s VAL 273 Cb -0.33 -0.75 0.07 0.00 -1.53 0.00 0.00 36.38 33.84 2kdg s VAL 273 CO 0.29 0.05 -0.01 -0.44 -3.33 0.00 0.00 175.10 171.66 2kdg s SER 274 N 1.93 3.89 0.23 3.54 0.01 -1.26 -4.45 113.70 117.59 2kdg s SER 274 Ca 0.03 -1.33 -0.18 0.00 1.31 0.00 0.00 55.95 55.78 2kdg s SER 274 Cb -0.14 -1.12 0.02 0.00 0.21 0.00 0.00 66.02 64.99 2kdg s SER 274 CO -0.07 -0.29 0.58 -0.83 0.41 0.00 0.00 173.24 173.04 2kdg s GLY 275 N 1.42 0.06 -0.06 3.44 0.00 -1.26 -2.42 107.32 108.50 2kdg s GLY 275 Ca -0.01 -0.40 -0.02 0.00 0.00 0.00 0.00 44.72 44.29 2kdg s GLY 275 CO -0.10 -0.29 0.11 -2.27 0.00 0.00 0.00 173.10 170.56 2kdg s LEU 276 N -2.92 0.48 1.04 0.66 2.96 -0.39 -4.14 118.68 116.37 2kdg s LEU 276 Ca 0.13 0.22 -0.12 0.00 -0.22 0.00 0.00 54.13 54.13 2kdg s LEU 276 Cb -0.02 0.16 0.21 0.00 0.50 0.00 0.00 46.19 47.04 2kdg s LEU 276 CO 0.03 -0.19 1.07 -2.16 -1.32 0.00 0.00 176.35 173.78 2kdg s PRO 277 N 1.63 0.10 0.03 0.98 0.04 -1.26 -1.36 135.00 135.15 2kdg s PRO 277 Ca -0.03 0.75 -0.33 0.00 0.04 0.00 0.00 61.00 61.42 2kdg s PRO 277 Cb -0.12 -1.68 -0.12 0.00 0.04 0.00 0.00 34.50 32.62 2kdg s PRO 277 CO -0.05 -3.02 1.81 0.00 0.04 0.00 0.00 177.00 175.79 2kdg n ALA 278 N -4.41 1.33 -1.77 8.56 0.00 -1.26 -4.83 120.51 118.13 2kdg n ALA 278 Ca 0.05 0.32 -0.35 0.00 0.00 0.00 0.00 53.44 53.46 2kdg n ALA 278 Cb 0.55 -2.50 -0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 3.10 3.45 0.28 0.00 0.04 -1.26 -4.91 135.00 135.71 2kdg s PRO 279 Ca 0.87 1.64 -0.29 0.00 0.04 0.00 0.00 61.00 63.26 2kdg s PRO 279 Cb -0.62 -2.09 -0.10 0.00 0.04 0.00 0.00 34.50 31.73 2kdg s PRO 279 CO 0.45 -0.77 1.17 0.34 0.04 0.00 0.00 177.00 178.22 2kdg s ASP 280 N -1.68 7.11 0.01 6.66 2.15 -0.07 -4.80 116.67 126.04 2kdg s ASP 280 Ca 0.71 2.38 0.05 0.00 0.43 0.00 0.00 52.55 56.12 2kdg s ASP 280 Cb -0.25 -2.63 -0.02 0.00 -0.30 0.00 0.00 42.92 39.73 2kdg s ASP 280 CO 0.28 -0.28 -0.17 0.68 -0.17 0.00 0.00 175.17 175.51 2kdg s VAL 281 N -0.98 1.33 -0.11 1.11 -7.23 -1.26 -1.32 120.40 111.94 2kdg s VAL 281 Ca 0.47 -0.85 -0.04 0.00 -1.81 0.00 0.00 61.98 59.75 2kdg s VAL 281 Cb -0.34 -1.14 0.05 0.00 0.56 0.00 0.00 36.38 35.51 2kdg s VAL 281 CO 0.43 0.27 0.11 -0.44 -0.31 0.00 0.00 175.10 175.16 2kdg s SER 282 N -0.68 1.49 0.38 4.85 0.01 -0.51 -5.02 113.70 114.22 2kdg s SER 282 Ca 0.06 -0.14 -0.16 0.00 1.31 0.00 0.00 55.95 57.02 2kdg s SER 282 Cb -0.07 -0.02 -0.09 0.00 0.21 0.00 0.00 66.02 66.05 2kdg s SER 282 CO 0.00 -0.29 0.81 0.26 0.41 0.00 0.00 173.24 174.43 2kdg s TRP 283 N 2.21 3.38 0.08 2.43 0.52 -1.26 -1.60 118.94 124.69 2kdg s TRP 283 Ca 0.04 1.30 -0.02 0.00 0.02 0.00 0.00 56.10 57.43 2kdg s TRP 283 Cb -0.14 -2.61 -0.03 0.00 -1.15 0.00 0.00 33.47 29.54 2kdg s TRP 283 CO -0.07 -0.03 0.03 0.71 0.02 0.00 0.00 176.95 177.62 2kdg s TYR 284 N -2.15 0.53 -0.13 -1.98 1.51 0.32 -1.17 117.35 114.27 2kdg s TYR 284 Ca 0.56 -1.02 -0.05 0.00 -1.01 0.00 0.00 57.07 55.55 2kdg s TYR 284 Cb -0.10 -0.35 0.07 0.00 -0.11 0.00 0.00 41.96 41.47 2kdg s TYR 284 CO 0.20 -0.45 0.27 -1.17 -1.11 0.00 0.00 175.55 173.29 2kdg s LEU 285 N -2.94 -0.32 -0.89 -1.29 2.96 0.09 -1.51 118.68 114.80 2kdg s LEU 285 Ca 0.11 0.60 0.00 0.00 -0.22 0.00 0.00 54.13 54.61 2kdg s LEU 285 Cb 0.07 0.73 0.00 0.00 0.50 0.00 0.00 46.19 47.49 2kdg s LEU 285 CO -0.07 -0.24 0.00 0.59 -1.32 0.00 0.00 176.35 175.31 2kdg n ASN 286 N 5.35 -4.32 0.00 3.68 3.02 -0.30 -1.52 115.26 121.18 2kdg n ASN 286 Ca -0.06 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.70 2kdg n ASN 286 Cb 0.50 -3.30 0.00 0.00 -0.61 0.00 0.00 39.78 36.36 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 0.20 1.18 3.90 7.41 0.00 -1.26 -5.07 105.19 111.54 2kdg n GLY 287 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.63 3.60 0.71 1.61 0.52 -0.57 -5.10 118.95 119.09 2kdg s ARG 288 Ca 0.00 0.23 -0.12 0.00 -0.52 0.00 0.00 55.73 55.32 2kdg s ARG 288 Cb 0.00 -2.41 0.02 0.00 0.52 0.00 0.00 34.95 33.08 2kdg s ARG 288 CO 0.00 -0.12 1.09 0.95 0.02 0.00 0.00 175.30 177.24 2kdg s THR 289 N -2.59 3.49 -0.29 0.02 -4.23 -1.26 -0.73 115.64 110.05 2kdg s THR 289 Ca 0.48 0.55 -0.02 0.00 -1.18 0.00 0.00 61.69 61.52 2kdg s THR 289 Cb -0.10 -3.10 0.10 0.00 1.34 0.00 0.00 72.50 70.73 2kdg s THR 289 CO 0.40 -0.57 0.10 -0.69 -0.54 0.00 0.00 174.62 173.33 2kdg s VAL 290 N -2.76 0.56 0.66 2.29 1.01 -0.32 -4.62 120.40 117.23 2kdg s VAL 290 Ca 0.62 -1.14 -0.14 0.00 0.00 0.00 0.00 61.98 61.32 2kdg s VAL 290 Cb -0.17 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.80 2kdg s VAL 290 CO 0.51 -0.66 1.09 -1.10 0.00 0.00 0.00 175.10 174.94 2kdg s GLN 291 N 1.78 2.86 0.58 2.72 -0.21 -1.26 -4.20 119.66 121.94 2kdg s GLN 291 Ca 0.09 1.26 -0.18 0.00 0.02 0.00 0.00 55.36 56.55 2kdg s GLN 291 Cb -0.17 -1.97 -0.04 0.00 1.00 0.00 0.00 33.01 31.84 2kdg s GLN 291 CO -0.27 -1.19 1.12 -1.54 -2.12 0.00 0.00 175.29 171.29 2kdg s SER 292 N -2.88 5.53 0.28 5.90 1.04 -1.26 -4.97 113.70 117.33 2kdg s SER 292 Ca 0.64 2.09 -0.05 0.00 0.48 0.00 0.00 55.95 59.12 2kdg s SER 292 Cb -0.18 -2.57 0.02 0.00 0.10 0.00 0.00 66.02 63.39 2kdg s SER 292 CO 0.44 -1.35 0.46 -0.90 0.98 0.00 0.00 173.24 172.87 2kdg n ASP 293 N -1.71 -1.31 0.32 7.02 5.68 -0.82 -4.99 116.55 120.74 2kdg n ASP 293 Ca 0.11 -2.38 0.19 0.00 -0.50 0.00 0.00 54.79 52.21 2kdg n ASP 293 Cb 0.51 2.32 1.05 0.00 -1.14 0.00 0.00 41.12 43.87 2kdg n ASP 293 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 2kdg h ASP 294 N 1.53 0.00 0.00 -1.12 3.58 -2.02 -2.74 116.42 115.65 2kdg h ASP 294 Ca -0.23 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.04 2kdg h ASP 294 Cb 0.93 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.95 2kdg h ASP 294 CO 0.30 0.00 -1.98 0.18 -2.88 0.00 0.00 179.24 174.86 2kdg n LEU 295 N -3.48 0.00 -3.86 2.28 4.77 -1.26 -4.75 117.00 110.70 2kdg n LEU 295 Ca -0.03 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.60 2kdg n LEU 295 Cb 0.08 0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 2kdg n LEU 295 CO 0.24 0.24 0.47 1.41 -1.33 0.00 0.00 177.39 178.43 2kdg n HIS 296 N -2.41 3.50 -2.65 -1.77 8.25 -1.03 -1.17 115.22 117.95 2kdg n HIS 296 Ca -0.17 -3.72 -0.36 0.00 -0.26 0.00 0.00 57.72 53.20 2kdg n HIS 296 Cb 0.80 -0.98 -0.05 0.00 1.12 0.00 0.00 29.99 30.89 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 -2.13 4.27 -0.27 -0.41 1.02 -1.22 -1.94 119.74 119.06 2kdg s LYS 297 Ca 0.33 1.40 -0.02 0.00 0.02 0.00 0.00 55.97 57.69 2kdg s LYS 297 Cb 0.03 -2.54 0.12 0.00 -0.52 0.00 0.00 37.83 34.92 2kdg s LYS 297 CO -0.03 -0.02 0.25 -1.64 -0.92 0.00 0.00 175.35 172.99 2kdg s MET 298 N -2.51 0.27 0.14 1.68 -1.94 -1.26 -1.65 119.30 114.03 2kdg s MET 298 Ca 0.57 -0.13 0.01 0.00 -1.71 0.00 0.00 55.69 54.43 2kdg s MET 298 Cb -0.19 -0.89 -0.04 0.00 2.01 0.00 0.00 34.83 35.72 2kdg s MET 298 CO 0.24 -0.93 -0.01 0.96 -0.01 0.00 0.00 175.02 175.27 2kdg s ILE 299 N 2.30 0.59 -0.23 2.53 -0.00 -1.22 -5.03 121.20 120.14 2kdg s ILE 299 Ca 0.09 -1.95 0.02 0.00 -0.00 0.00 0.00 60.65 58.80 2kdg s ILE 299 Cb -0.15 -1.98 0.05 0.00 -0.00 0.00 0.00 42.46 40.38 2kdg s ILE 299 CO -0.29 -0.59 -0.12 -0.69 -0.00 0.00 0.00 174.94 173.25 2kdg s VAL 300 N -3.71 1.99 0.58 8.37 1.01 -1.26 -1.10 120.40 126.28 2kdg s VAL 300 Ca 0.20 -1.36 -0.18 0.00 0.00 0.00 0.00 61.98 60.64 2kdg s VAL 300 Cb 0.06 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 2kdg s VAL 300 CO 0.01 0.10 1.13 -0.44 0.00 0.00 0.00 175.10 175.90 2kdg s SER 301 N 1.22 5.48 0.65 3.32 0.01 -0.08 -4.91 113.70 119.39 2kdg s SER 301 Ca -0.05 2.15 0.39 0.00 1.31 0.00 0.00 55.95 59.75 2kdg s SER 301 Cb -0.18 -2.57 2.13 0.00 0.21 0.00 0.00 66.02 65.60 2kdg s SER 301 CO -0.07 -1.39 2.20 1.05 0.41 0.00 0.00 173.24 175.44 2kdg h GLU 302 N 0.81 0.00 0.00 12.44 4.11 -2.01 -2.02 114.58 127.92 2kdg h GLU 302 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2kdg h GLU 302 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2kdg h GLU 302 CO 0.56 0.00 0.00 1.63 0.07 0.00 0.00 179.01 181.27 2kdg n LYS 303 N -2.97 0.48 -1.43 1.06 4.76 -1.26 -4.89 118.16 113.91 2kdg n LYS 303 Ca -0.03 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 2kdg n LYS 303 Cb 0.16 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 2kdg n LYS 303 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2kdg n GLY 304 N 0.72 0.51 2.64 0.72 0.00 -0.77 -4.98 105.19 104.04 2kdg n GLY 304 Ca 0.14 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.32 1.08 0.47 0.99 2.96 -1.18 -0.95 118.68 120.73 2kdg s LEU 305 Ca 0.00 -1.18 -0.22 0.00 -0.22 0.00 0.00 54.13 52.51 2kdg s LEU 305 Cb 0.00 -0.52 -0.07 0.00 0.50 0.00 0.00 46.19 46.10 2kdg s LEU 305 CO 0.00 -0.39 1.14 -2.28 -1.32 0.00 0.00 176.35 173.50 2kdg s HIS 306 N 1.93 2.87 -0.30 5.38 5.65 -0.14 -0.90 115.29 129.79 2kdg s HIS 306 Ca 0.06 1.55 -0.02 0.00 0.25 0.00 0.00 55.06 56.90 2kdg s HIS 306 Cb -0.17 -3.32 0.10 0.00 -1.18 0.00 0.00 32.58 28.01 2kdg s HIS 306 CO -0.24 -1.41 0.12 0.45 -0.65 0.00 0.00 174.74 173.01 2kdg s SER 307 N -1.49 3.76 -0.23 9.88 0.15 -0.26 -1.80 113.70 123.71 2kdg s SER 307 Ca 0.65 -1.51 -0.27 0.00 0.70 0.00 0.00 55.95 55.52 2kdg s SER 307 Cb -0.26 -0.61 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 2kdg s SER 307 CO 0.32 -0.42 0.96 -0.22 1.20 0.00 0.00 173.24 175.07 2kdg s LEU 308 N 1.81 4.10 0.14 3.45 1.98 -1.14 -3.45 118.68 125.56 2kdg s LEU 308 Ca 0.10 1.26 0.09 0.00 -2.89 0.00 0.00 54.13 52.68 2kdg s LEU 308 Cb -0.17 -3.41 -0.04 0.00 0.66 0.00 0.00 46.19 43.23 2kdg s LEU 308 CO -0.30 -0.60 -0.15 -0.63 -1.89 0.00 0.00 176.35 172.78 2kdg s ILE 309 N 3.01 2.98 -0.24 6.68 1.01 -0.66 -0.93 121.20 133.04 2kdg s ILE 309 Ca 0.41 -1.56 -0.01 0.00 0.00 0.00 0.00 60.65 59.50 2kdg s ILE 309 Cb -0.15 -2.41 0.07 0.00 0.01 0.00 0.00 42.46 39.98 2kdg s ILE 309 CO 0.07 0.02 0.00 -0.36 0.00 0.00 0.00 174.94 174.68 2kdg s PHE 310 N -1.36 1.91 0.17 3.97 0.40 0.21 -3.57 117.98 119.71 2kdg s PHE 310 Ca 0.21 -1.52 -0.11 0.00 -0.60 0.00 0.00 56.93 54.91 2kdg s PHE 310 Cb -0.10 -1.48 0.08 0.00 0.51 0.00 0.00 43.02 42.03 2kdg s PHE 310 CO 0.12 -0.75 1.71 0.93 0.70 0.00 0.00 175.22 177.93 2kdg h GLU 311 N 8.05 0.94 -1.68 0.44 4.39 -1.40 -0.75 114.58 124.57 2kdg h GLU 311 Ca -0.16 -0.20 -0.28 0.00 0.34 0.00 0.00 59.36 59.06 2kdg h GLU 311 Cb 1.08 -0.14 -0.28 0.00 -0.10 0.00 0.00 28.75 29.31 2kdg h GLU 311 CO 0.40 0.83 -0.61 0.54 -1.16 0.00 0.00 179.01 179.01 2kdg s VAL 312 N -5.42 -0.53 0.33 3.13 0.11 -1.26 -3.79 120.40 112.97 2kdg s VAL 312 Ca -0.13 -0.69 -0.28 0.00 -2.93 0.00 0.00 61.98 57.95 2kdg s VAL 312 Cb 0.13 -0.52 -0.10 0.00 -1.53 0.00 0.00 36.38 34.37 2kdg s VAL 312 CO 0.81 -0.41 1.22 0.54 -3.33 0.00 0.00 175.10 173.93 2kdg s VAL 313 N 1.61 3.02 0.28 2.04 0.11 -0.86 -4.85 120.40 121.75 2kdg s VAL 313 Ca 0.16 0.99 0.11 0.00 -2.93 0.00 0.00 61.98 60.31 2kdg s VAL 313 Cb -0.12 -3.61 -0.05 0.00 -1.53 0.00 0.00 36.38 31.06 2kdg s VAL 313 CO -0.06 0.21 -0.18 -0.13 -3.33 0.00 0.00 175.10 171.61 2kdg s ARG 314 N -1.81 1.66 0.50 1.54 1.81 -1.26 -0.87 118.95 120.52 2kdg s ARG 314 Ca 0.49 -1.77 0.18 0.00 -1.72 0.00 0.00 55.73 52.91 2kdg s ARG 314 Cb -0.36 -1.68 1.25 0.00 -0.45 0.00 0.00 34.95 33.71 2kdg s ARG 314 CO 0.47 0.28 2.07 0.00 -0.68 0.00 0.00 175.30 177.44 2kdg h ALA 315 N 2.27 2.14 0.00 2.13 0.00 -1.95 -0.72 119.26 123.13 2kdg h ALA 315 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2kdg h ALA 315 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2kdg h ALA 315 CO 0.62 -0.20 0.00 0.66 0.00 0.00 0.00 179.25 180.32 2kdg h SER 316 N 0.10 0.00 0.43 0.00 4.64 -1.97 -3.02 113.55 113.73 2kdg h SER 316 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2kdg h SER 316 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2kdg h SER 316 CO -0.01 0.00 -0.08 0.47 -0.87 0.00 0.00 176.83 176.34 2kdg n ASP 317 N -2.39 0.30 -4.74 4.97 8.00 -0.27 -4.93 116.55 117.48 2kdg n ASP 317 Ca 0.01 -0.43 -0.35 0.00 0.71 0.00 0.00 54.79 54.73 2kdg n ASP 317 Cb 0.20 -0.14 0.05 0.00 -0.02 0.00 0.00 41.12 41.22 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 -2.51 2.40 0.00 2.24 0.00 -1.14 -4.95 121.76 117.80 2kdg s ALA 318 Ca 0.29 0.93 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2kdg s ALA 318 Cb 0.20 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2kdg s ALA 318 CO 0.47 -1.41 0.00 0.41 0.00 0.00 0.00 175.76 175.24 2kdg n GLY 319 N 0.38 0.96 3.47 0.00 0.00 -0.37 -5.00 105.19 104.63 2kdg n GLY 319 Ca 0.13 -1.96 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.06 3.12 0.48 4.61 0.00 -1.26 -1.05 121.76 126.60 2kdg s ALA 320 Ca 0.00 -1.70 -0.19 0.00 0.00 0.00 0.00 51.96 50.07 2kdg s ALA 320 Cb 0.00 -3.84 -0.09 0.00 0.00 0.00 0.00 23.12 19.20 2kdg s ALA 320 CO 0.00 -2.70 0.99 0.71 0.00 0.00 0.00 175.76 174.76 2kdg s TYR 321 N 4.07 3.25 0.06 0.00 1.51 0.26 -1.15 117.35 125.36 2kdg s TYR 321 Ca 0.24 1.55 -0.08 0.00 -1.01 0.00 0.00 57.07 57.77 2kdg s TYR 321 Cb -0.16 -2.89 -0.00 0.00 -0.11 0.00 0.00 41.96 38.79 2kdg s TYR 321 CO 0.12 -0.44 0.16 0.00 -1.11 0.00 0.00 175.55 174.28 2kdg s ALA 322 N -2.30 -0.19 -0.25 3.71 0.00 -0.57 -1.45 121.76 120.72 2kdg s ALA 322 Ca 0.62 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 52.02 2kdg s ALA 322 Cb -0.11 0.36 0.08 0.00 0.00 0.00 0.00 23.12 23.44 2kdg s ALA 322 CO 0.22 -0.41 0.08 0.00 0.00 0.00 0.00 175.76 175.64 2kdg s VAL 324 N 1.84 3.43 -0.09 0.00 1.01 -0.63 -1.33 120.40 124.63 2kdg s VAL 324 Ca 0.04 1.18 -0.01 0.00 0.00 0.00 0.00 61.98 63.20 2kdg s VAL 324 Cb -0.17 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.48 2kdg s VAL 324 CO -0.19 0.18 -0.02 0.00 0.00 0.00 0.00 175.10 175.07 2kdg s ALA 325 N 0.07 0.92 -0.02 5.51 0.00 0.08 -1.42 121.76 126.90 2kdg s ALA 325 Ca 0.55 -0.29 0.02 0.00 0.00 0.00 0.00 51.96 52.23 2kdg s ALA 325 Cb -0.34 -0.82 0.01 0.00 0.00 0.00 0.00 23.12 21.96 2kdg s ALA 325 CO 0.37 -0.48 -0.06 0.15 0.00 0.00 0.00 175.76 175.73 2kdg s LYS 326 N 1.88 0.68 0.34 0.00 1.02 -0.44 -0.97 119.74 122.26 2kdg s LYS 326 Ca 0.05 -0.20 0.04 0.00 0.02 0.00 0.00 55.97 55.88 2kdg s LYS 326 Cb -0.13 -0.67 -0.02 0.00 -0.52 0.00 0.00 37.83 36.50 2kdg s LYS 326 CO -0.06 0.07 0.15 0.27 -0.92 0.00 0.00 175.35 174.86 2kdg n ASN 327 N 3.33 0.83 0.16 2.83 0.23 -0.59 -0.89 115.26 121.16 2kdg n ASN 327 Ca -0.18 -2.90 0.11 0.00 -0.53 0.00 0.00 54.58 51.08 2kdg n ASN 327 Cb 0.55 1.02 0.59 0.00 -2.08 0.00 0.00 39.78 39.85 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 -0.75 0.15 -0.01 -3.83 1.85 -1.26 -2.79 116.66 110.01 2kdg n ARG 328 Ca -0.03 0.62 0.08 0.00 -1.00 0.00 0.00 57.85 57.52 2kdg n ARG 328 Cb 0.53 -1.96 -0.12 0.00 -1.05 0.00 0.00 32.46 29.87 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 -1.78 2.61 0.00 2.89 0.00 -1.26 -5.09 120.51 117.88 2kdg n ALA 329 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2kdg n ALA 329 Cb 0.05 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 1.62 -1.31 3.04 0.00 0.00 -1.12 -4.53 105.19 102.89 2kdg n GLY 330 Ca -0.03 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.97 0.59 0.07 1.61 2.12 -1.26 -1.54 118.70 119.33 2kdg s GLU 331 Ca 0.00 -0.51 0.00 0.00 0.36 0.00 0.00 54.97 54.82 2kdg s GLU 331 Cb 0.00 -0.50 -0.04 0.00 0.26 0.00 0.00 34.13 33.85 2kdg s GLU 331 CO 0.00 0.12 -0.05 0.00 -0.54 0.00 0.00 175.26 174.79 2kdg s ALA 332 N -0.72 0.74 -0.28 6.30 0.00 -0.14 -4.85 121.76 122.82 2kdg s ALA 332 Ca -0.02 -1.28 -0.04 0.00 0.00 0.00 0.00 51.96 50.62 2kdg s ALA 332 Cb -0.06 0.21 0.10 0.00 0.00 0.00 0.00 23.12 23.37 2kdg s ALA 332 CO 0.00 -0.30 0.13 0.99 0.00 0.00 0.00 175.76 176.59 2kdg s THR 333 N -3.75 -0.09 0.57 0.00 2.01 -1.26 -0.74 115.64 112.38 2kdg s THR 333 Ca 0.09 -0.68 -0.15 0.00 0.31 0.00 0.00 61.69 61.26 2kdg s THR 333 Cb 0.06 -0.93 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 2kdg s THR 333 CO -0.07 -0.67 1.02 -0.36 -0.69 0.00 0.00 174.62 173.85 2kdg s PHE 334 N 2.12 3.29 -0.04 4.92 0.08 -0.44 -4.88 117.98 123.03 2kdg s PHE 334 Ca 0.08 1.46 -0.10 0.00 0.12 0.00 0.00 56.93 58.49 2kdg s PHE 334 Cb -0.16 -2.86 0.02 0.00 -0.57 0.00 0.00 43.02 39.44 2kdg s PHE 334 CO -0.34 -0.72 0.23 0.99 -0.10 0.00 0.00 175.22 175.28 2kdg s THR 335 N -2.66 0.05 -0.10 0.64 2.01 -1.26 -0.79 115.64 113.53 2kdg s THR 335 Ca 0.60 -0.38 -0.20 0.00 0.31 0.00 0.00 61.69 62.02 2kdg s THR 335 Cb -0.12 -0.46 0.05 0.00 0.01 0.00 0.00 72.50 71.97 2kdg s THR 335 CO 0.37 -0.21 0.49 0.54 -0.69 0.00 0.00 174.62 175.13 2kdg s VAL 336 N -0.82 0.02 -0.15 3.82 0.11 -0.53 -4.81 120.40 118.04 2kdg s VAL 336 Ca -0.09 -0.16 -0.08 0.00 -2.93 0.00 0.00 61.98 58.72 2kdg s VAL 336 Cb -0.05 -0.76 -0.04 0.00 -1.53 0.00 0.00 36.38 34.00 2kdg s VAL 336 CO 0.02 -0.09 0.13 -1.58 -3.33 0.00 0.00 175.10 170.25 2kdg s GLN 337 N -0.65 3.75 -0.23 1.54 0.74 -1.26 -0.57 119.66 122.98 2kdg s GLN 337 Ca -0.07 -0.19 0.02 0.00 0.05 0.00 0.00 55.36 55.17 2kdg s GLN 337 Cb -0.03 -3.27 0.05 0.00 1.10 0.00 0.00 33.01 30.86 2kdg s GLN 337 CO 0.04 0.56 -0.11 -1.17 -0.55 0.00 0.00 175.29 174.07 2kdg s LEU 338 N -0.39 2.79 -0.97 3.68 2.96 -0.22 -0.90 118.68 125.63 2kdg s LEU 338 Ca 0.11 -1.13 -0.12 0.00 -0.22 0.00 0.00 54.13 52.78 2kdg s LEU 338 Cb -0.12 -1.38 0.25 0.00 0.50 0.00 0.00 46.19 45.45 2kdg s LEU 338 CO 0.01 -0.17 0.94 -0.62 -1.32 0.00 0.00 176.35 175.19 2kdg s ASP 339 N 1.27 7.04 -0.17 3.68 2.15 -0.04 -1.24 116.67 129.36 2kdg s ASP 339 Ca -0.05 -3.14 -0.29 0.00 0.43 0.00 0.00 52.55 49.50 2kdg s ASP 339 Cb -0.18 -2.21 -0.05 0.00 -0.30 0.00 0.00 42.92 40.18 2kdg s ASP 339 CO -0.07 -0.43 1.87 -0.69 -0.17 0.00 0.00 175.17 175.67 2kdg s VAL 340 N -0.54 3.35 -0.69 1.11 1.01 -1.26 -3.41 120.40 119.96 2kdg s VAL 340 Ca 0.24 0.39 -0.27 0.00 0.00 0.00 0.00 61.98 62.35 2kdg s VAL 340 Cb -0.10 -3.36 0.01 0.00 0.00 0.00 0.00 36.38 32.92 2kdg s VAL 340 CO -0.09 -0.16 1.52 -0.76 0.00 0.00 0.00 175.10 175.62 2kdg s LEU 341 N 5.96 3.22 0.60 3.92 1.43 0.06 -4.86 118.68 129.01 2kdg s LEU 341 Ca 0.83 -0.15 -0.20 0.00 -1.03 0.00 0.00 54.13 53.59 2kdg s LEU 341 Cb -0.31 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.33 2kdg s LEU 341 CO 0.34 -2.06 1.31 0.00 0.23 0.00 0.00 176.35 176.17 2kdg s ALA 342 N 7.11 2.59 -0.41 4.21 0.00 -1.26 -1.14 121.76 132.86 2kdg s ALA 342 Ca 0.48 1.25 0.04 0.00 0.00 0.00 0.00 51.96 53.73 2kdg s ALA 342 Cb -0.10 -3.55 0.17 0.00 0.00 0.00 0.00 23.12 19.64 2kdg s ALA 342 CO 0.17 -1.45 0.39 0.21 0.00 0.00 0.00 175.76 175.08 2kdg s LYS 343 N -3.16 0.83 0.00 0.00 2.20 -1.26 -4.83 119.74 113.52 2kdg s LYS 343 Ca 0.77 -1.63 0.04 0.00 -0.36 0.00 0.00 55.97 54.79 2kdg s LYS 343 Cb -0.38 -1.07 0.25 0.00 -1.51 0.00 0.00 37.83 35.12 2kdg s LYS 343 CO 0.42 -1.32 0.72 -0.85 -0.36 0.00 0.00 175.35 173.96