#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 0.91 0.33 4.61 0.00 -1.26 -5.10 121.76 121.25 2kdg s ALA -3 Ca 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 51.98 2kdg s ALA -3 Cb 0.00 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 2kdg s ALA -3 CO 0.00 -2.89 0.40 0.00 0.00 0.00 0.00 175.76 173.27 2kdg n MET -2 N -4.26 0.57 -3.59 0.00 0.00 -1.26 -5.04 117.12 103.54 2kdg n MET -2 Ca 0.06 -2.94 0.03 0.00 0.00 0.00 0.00 57.70 54.85 2kdg n MET -2 Cb 0.55 2.65 -0.00 0.00 0.00 0.00 0.00 33.22 36.41 2kdg n MET -2 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2kdg s GLY -1 N -3.18 -0.46 0.78 3.17 0.00 -0.51 -4.94 107.32 102.20 2kdg s GLY -1 Ca 0.33 0.83 -0.10 0.00 0.00 0.00 0.00 44.72 45.77 2kdg s GLY -1 CO 0.23 0.15 1.10 2.56 0.00 0.00 0.00 173.10 177.14 2kdg s PRO 249 N -2.24 2.16 0.77 2.90 0.04 -1.26 -1.31 135.00 136.06 2kdg s PRO 249 Ca 0.14 1.20 -0.11 0.00 0.04 0.00 0.00 61.00 62.27 2kdg s PRO 249 Cb 0.06 -1.88 0.06 0.00 0.04 0.00 0.00 34.50 32.78 2kdg s PRO 249 CO -0.05 -1.72 1.11 -1.25 0.04 0.00 0.00 177.00 175.12 2kdg s PRO 250 N -4.88 2.14 0.02 0.56 0.04 -1.26 -3.90 135.00 127.71 2kdg s PRO 250 Ca 0.62 1.30 -0.04 0.00 0.04 0.00 0.00 61.00 62.92 2kdg s PRO 250 Cb -0.18 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 2kdg s PRO 250 CO 0.56 -1.75 0.05 0.50 0.04 0.00 0.00 177.00 176.40 2kdg s ARG 251 N -4.68 0.42 0.24 4.56 3.52 -1.25 -4.72 118.95 117.05 2kdg s ARG 251 Ca 0.64 -0.55 -0.30 0.00 -0.13 0.00 0.00 55.73 55.38 2kdg s ARG 251 Cb -0.19 0.16 -0.10 0.00 -1.56 0.00 0.00 34.95 33.26 2kdg s ARG 251 CO 0.53 -0.09 1.51 -0.06 -0.81 0.00 0.00 175.30 176.39 2kdg s PHE 252 N -1.60 2.96 0.20 5.12 0.08 -1.26 -3.15 117.98 120.33 2kdg s PHE 252 Ca -0.14 0.87 0.00 0.00 0.12 0.00 0.00 56.93 57.78 2kdg s PHE 252 Cb -0.08 -3.91 0.00 0.00 -0.57 0.00 0.00 43.02 38.46 2kdg s PHE 252 CO -0.00 -3.08 0.00 -0.89 -0.10 0.00 0.00 175.22 171.14 2kdg n ILE 253 N 2.66 0.55 -3.72 0.64 2.08 -1.22 -4.92 119.36 115.44 2kdg n ILE 253 Ca 0.09 0.18 -0.13 0.00 0.56 0.00 0.00 62.75 63.44 2kdg n ILE 253 Cb 0.39 -1.00 -0.09 0.00 -0.75 0.00 0.00 39.64 38.19 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 -2.00 0.57 0.12 0.38 0.74 -1.22 -5.02 119.66 113.23 2kdg s GLN 254 Ca 0.00 0.51 0.07 0.00 0.05 0.00 0.00 55.36 55.99 2kdg s GLN 254 Cb 0.00 0.27 -0.04 0.00 1.10 0.00 0.00 33.01 34.35 2kdg s GLN 254 CO 0.00 -0.09 -0.17 0.14 -0.55 0.00 0.00 175.29 174.62 2kdg s VAL 255 N -0.02 1.50 0.58 1.34 -7.23 -1.26 -2.11 120.40 113.21 2kdg s VAL 255 Ca -0.02 -1.65 -0.17 0.00 -1.81 0.00 0.00 61.98 58.33 2kdg s VAL 255 Cb -0.03 -1.53 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 2kdg s VAL 255 CO 0.02 -0.27 1.09 -2.16 -0.31 0.00 0.00 175.10 173.47 2kdg s PRO 256 N -2.34 3.24 1.05 4.82 0.04 -1.26 -5.07 135.00 135.48 2kdg s PRO 256 Ca 0.08 1.40 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 2kdg s PRO 256 Cb -0.07 -2.01 0.22 0.00 0.04 0.00 0.00 34.50 32.67 2kdg s PRO 256 CO 0.04 -0.90 1.15 -1.83 0.04 0.00 0.00 177.00 175.50 2kdg s GLU 257 N -3.74 0.00 0.73 4.56 -1.05 -1.26 -4.87 118.70 113.07 2kdg s GLU 257 Ca 0.68 0.08 -0.16 0.00 -0.15 0.00 0.00 54.97 55.42 2kdg s GLU 257 Cb -0.20 -1.73 0.04 0.00 -0.44 0.00 0.00 34.13 31.80 2kdg s GLU 257 CO 0.33 -2.92 1.25 0.54 0.95 0.00 0.00 175.26 175.40 2kdg s ASN 258 N -4.00 4.11 0.14 0.83 2.20 -1.26 -4.77 114.94 112.19 2kdg s ASN 258 Ca 0.68 2.49 0.05 0.00 -0.94 0.00 0.00 52.86 55.14 2kdg s ASN 258 Cb -0.12 -2.60 -0.04 0.00 -2.00 0.00 0.00 41.25 36.49 2kdg s ASN 258 CO 0.55 -2.33 -0.11 -0.04 -2.94 0.00 0.00 177.10 172.23 2kdg s MET 259 N -3.76 1.04 -0.08 3.55 -1.94 -0.26 -4.99 119.30 112.86 2kdg s MET 259 Ca 0.78 -1.37 -0.03 0.00 -1.71 0.00 0.00 55.69 53.35 2kdg s MET 259 Cb -0.33 -0.70 0.05 0.00 2.01 0.00 0.00 34.83 35.86 2kdg s MET 259 CO 0.45 0.10 0.16 -1.54 -0.01 0.00 0.00 175.02 174.18 2kdg s SER 260 N -2.93 0.72 -0.04 3.03 1.04 -1.26 -0.89 113.70 113.37 2kdg s SER 260 Ca 0.14 0.33 0.03 0.00 0.48 0.00 0.00 55.95 56.93 2kdg s SER 260 Cb 0.00 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.39 2kdg s SER 260 CO 0.01 -0.24 -0.12 -0.63 0.98 0.00 0.00 173.24 173.25 2kdg s ILE 261 N 2.24 1.02 0.18 -1.02 -1.09 -1.22 -4.94 121.20 116.39 2kdg s ILE 261 Ca 0.03 -0.47 -0.32 0.00 -2.23 0.00 0.00 60.65 57.65 2kdg s ILE 261 Cb -0.12 -0.90 -0.11 0.00 -1.58 0.00 0.00 42.46 39.75 2kdg s ILE 261 CO -0.06 0.31 1.63 -0.62 -1.23 0.00 0.00 174.94 174.98 2kdg s ASP 262 N 0.25 6.50 0.03 3.58 2.15 -1.26 -0.72 116.67 127.21 2kdg s ASP 262 Ca -0.06 2.73 -0.36 0.00 0.43 0.00 0.00 52.55 55.29 2kdg s ASP 262 Cb -0.11 -2.60 -0.15 0.00 -0.30 0.00 0.00 42.92 39.77 2kdg s ASP 262 CO 0.01 -0.89 1.55 1.21 -0.17 0.00 0.00 175.17 176.89 2kdg n GLU 263 N 3.97 1.62 0.00 4.34 2.13 -0.47 -2.57 120.64 129.67 2kdg n GLU 263 Ca 0.15 0.59 0.00 0.00 0.66 0.00 0.00 57.16 58.55 2kdg n GLU 263 Cb 0.37 -2.31 0.00 0.00 0.27 0.00 0.00 31.44 29.77 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 3.32 0.25 3.81 8.31 0.00 0.02 -4.89 105.19 116.01 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 -0.99 2.75 0.33 1.61 0.52 -1.06 -4.58 118.95 117.54 2kdg s ARG 265 Ca 0.00 0.92 -0.27 0.00 -0.52 0.00 0.00 55.73 55.86 2kdg s ARG 265 Cb 0.00 -1.97 -0.09 0.00 0.52 0.00 0.00 34.95 33.41 2kdg s ARG 265 CO 0.00 -1.22 1.08 0.12 0.02 0.00 0.00 175.30 175.30 2kdg s PHE 266 N -3.05 3.44 0.25 -0.53 2.19 -1.24 -1.73 117.98 117.30 2kdg s PHE 266 Ca 0.59 1.68 -0.11 0.00 0.33 0.00 0.00 56.93 59.41 2kdg s PHE 266 Cb -0.14 -3.22 -0.01 0.00 -1.31 0.00 0.00 43.02 38.34 2kdg s PHE 266 CO 0.55 -0.60 0.45 0.00 1.83 0.00 0.00 175.22 177.46 2kdg s ARG 268 N -3.97 0.99 -0.00 0.00 1.70 -1.26 -0.81 118.95 115.60 2kdg s ARG 268 Ca 0.24 -1.10 0.01 0.00 -0.47 0.00 0.00 55.73 54.42 2kdg s ARG 268 Cb -0.00 0.35 -0.00 0.00 -0.57 0.00 0.00 34.95 34.73 2kdg s ARG 268 CO 0.10 -0.33 -0.04 -1.64 -1.08 0.00 0.00 175.30 172.31 2kdg s MET 269 N -3.92 0.30 -0.07 3.89 -1.94 0.32 -5.00 119.30 112.88 2kdg s MET 269 Ca 0.12 -0.13 -0.00 0.00 -1.71 0.00 0.00 55.69 53.97 2kdg s MET 269 Cb 0.04 -0.29 0.02 0.00 2.01 0.00 0.00 34.83 36.62 2kdg s MET 269 CO -0.05 0.07 -0.03 -0.51 -0.01 0.00 0.00 175.02 174.49 2kdg s ASP 270 N -0.06 1.40 -0.24 3.03 1.01 -1.26 -1.10 116.67 119.45 2kdg s ASP 270 Ca 0.01 -0.13 0.01 0.00 0.71 0.00 0.00 52.55 53.15 2kdg s ASP 270 Cb -0.02 -0.50 0.06 0.00 1.01 0.00 0.00 42.92 43.47 2kdg s ASP 270 CO -0.00 -0.12 -0.07 -0.36 0.21 0.00 0.00 175.17 174.82 2kdg s PHE 271 N 1.49 2.68 -0.13 4.23 0.40 -0.33 -4.32 117.98 121.99 2kdg s PHE 271 Ca -0.02 -1.94 -0.29 0.00 -0.60 0.00 0.00 56.93 54.08 2kdg s PHE 271 Cb -0.13 -1.69 -0.03 0.00 0.51 0.00 0.00 43.02 41.68 2kdg s PHE 271 CO -0.03 -0.81 1.42 0.15 0.70 0.00 0.00 175.22 176.64 2kdg s LYS 272 N 1.30 4.19 -0.18 0.44 1.02 -0.90 -1.19 119.74 124.42 2kdg s LYS 272 Ca -0.07 1.83 -0.04 0.00 0.02 0.00 0.00 55.97 57.71 2kdg s LYS 272 Cb -0.19 -3.86 0.06 0.00 -0.52 0.00 0.00 37.83 33.32 2kdg s LYS 272 CO -0.06 -0.79 0.07 0.54 -0.92 0.00 0.00 175.35 174.19 2kdg s VAL 273 N 3.79 0.14 0.10 3.17 0.11 -0.12 -3.42 120.40 124.17 2kdg s VAL 273 Ca 0.62 -0.30 -0.02 0.00 -2.93 0.00 0.00 61.98 59.35 2kdg s VAL 273 Cb -0.26 -0.74 0.02 0.00 -1.53 0.00 0.00 36.38 33.88 2kdg s VAL 273 CO 0.21 -0.25 0.11 -0.24 -3.33 0.00 0.00 175.10 171.60 2kdg n SER 274 N 5.19 -0.45 0.00 3.54 2.88 -1.19 -4.41 113.62 119.19 2kdg n SER 274 Ca -0.08 -0.84 0.00 0.00 -1.33 0.00 0.00 58.87 56.62 2kdg n SER 274 Cb 0.48 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 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 3.22 2.05 3.25 0.46 0.00 -1.25 -3.80 105.19 109.13 2kdg n GLY 275 Ca 0.01 -1.96 -0.12 0.00 0.00 0.00 0.00 46.02 43.96 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 0.17 1.04 0.99 2.96 -0.43 -4.50 118.68 118.91 2kdg s LEU 276 Ca 0.00 0.82 -0.12 0.00 -0.22 0.00 0.00 54.13 54.61 2kdg s LEU 276 Cb 0.00 1.28 0.21 0.00 0.50 0.00 0.00 46.19 48.19 2kdg s LEU 276 CO 0.00 -0.17 1.07 -2.16 -1.32 0.00 0.00 176.35 173.77 2kdg s PRO 277 N 0.97 0.10 0.04 0.98 0.04 -1.26 -1.42 135.00 134.45 2kdg s PRO 277 Ca -0.06 0.66 -0.33 0.00 0.04 0.00 0.00 61.00 61.31 2kdg s PRO 277 Cb -0.07 -1.69 -0.12 0.00 0.04 0.00 0.00 34.50 32.66 2kdg s PRO 277 CO -0.08 -2.99 1.76 0.00 0.04 0.00 0.00 177.00 175.73 2kdg n ALA 278 N -4.38 1.29 -1.51 8.56 0.00 -1.26 -4.85 120.51 118.35 2kdg n ALA 278 Ca 0.05 0.35 -0.33 0.00 0.00 0.00 0.00 53.44 53.51 2kdg n ALA 278 Cb 0.56 -2.46 0.05 0.00 0.00 0.00 0.00 19.45 17.59 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 2.64 2.82 -0.28 0.00 0.04 -1.26 -4.93 135.00 134.04 2kdg s PRO 279 Ca 0.86 1.35 -0.29 0.00 0.04 0.00 0.00 61.00 62.96 2kdg s PRO 279 Cb -0.65 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 31.93 2kdg s PRO 279 CO 0.44 -1.23 1.47 0.34 0.04 0.00 0.00 177.00 178.06 2kdg s ASP 280 N -2.67 6.48 -0.16 6.66 2.15 0.20 -4.82 116.67 124.52 2kdg s ASP 280 Ca 0.66 1.35 -0.05 0.00 0.43 0.00 0.00 52.55 54.94 2kdg s ASP 280 Cb -0.20 -2.54 -0.03 0.00 -0.30 0.00 0.00 42.92 39.85 2kdg s ASP 280 CO 0.42 -1.22 0.01 -0.69 -0.17 0.00 0.00 175.17 173.52 2kdg s VAL 281 N 4.94 4.32 0.13 1.11 1.01 -1.26 -1.72 120.40 128.94 2kdg s VAL 281 Ca 0.64 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.47 2kdg s VAL 281 Cb -0.20 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 2kdg s VAL 281 CO 0.27 0.50 -0.13 -0.44 0.00 0.00 0.00 175.10 175.29 2kdg s SER 282 N 0.19 2.02 0.18 3.32 0.01 -0.35 -5.01 113.70 114.07 2kdg s SER 282 Ca 0.01 -0.86 0.09 0.00 1.31 0.00 0.00 55.95 56.49 2kdg s SER 282 Cb -0.13 -0.07 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 2kdg s SER 282 CO 0.02 -0.18 -0.18 0.26 0.41 0.00 0.00 173.24 173.57 2kdg s TRP 283 N -2.42 1.84 0.07 2.43 0.52 -1.25 -1.15 118.94 118.99 2kdg s TRP 283 Ca 0.12 -0.48 -0.06 0.00 0.02 0.00 0.00 56.10 55.70 2kdg s TRP 283 Cb -0.03 -0.90 -0.02 0.00 -1.15 0.00 0.00 33.47 31.38 2kdg s TRP 283 CO 0.03 0.36 0.11 0.71 0.02 0.00 0.00 176.95 178.18 2kdg s TYR 284 N -2.24 0.28 -0.12 -1.98 1.51 0.04 -0.95 117.35 113.88 2kdg s TYR 284 Ca 0.18 -0.75 -0.04 0.00 -1.01 0.00 0.00 57.07 55.45 2kdg s TYR 284 Cb -0.05 -0.18 0.06 0.00 -0.11 0.00 0.00 41.96 41.69 2kdg s TYR 284 CO 0.07 -0.48 0.23 -1.17 -1.11 0.00 0.00 175.55 173.09 2kdg s LEU 285 N -2.85 -0.22 -0.92 -1.29 2.96 -0.00 -1.30 118.68 115.05 2kdg s LEU 285 Ca 0.05 0.46 0.00 0.00 -0.22 0.00 0.00 54.13 54.42 2kdg s LEU 285 Cb 0.06 0.55 0.00 0.00 0.50 0.00 0.00 46.19 47.30 2kdg s LEU 285 CO -0.10 -0.25 0.00 0.59 -1.32 0.00 0.00 176.35 175.27 2kdg n ASN 286 N 5.34 -4.15 0.00 3.68 3.02 -0.32 -1.40 115.26 121.44 2kdg n ASN 286 Ca -0.06 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 2kdg n ASN 286 Cb 0.50 -3.24 0.00 0.00 -0.61 0.00 0.00 39.78 36.43 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 0.15 1.02 3.90 7.41 0.00 -1.26 -5.08 105.19 111.33 2kdg n GLY 287 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.62 3.62 0.60 1.61 0.52 -0.49 -5.10 118.95 119.08 2kdg s ARG 288 Ca 0.00 0.26 -0.17 0.00 -0.52 0.00 0.00 55.73 55.30 2kdg s ARG 288 Cb 0.00 -2.40 -0.03 0.00 0.52 0.00 0.00 34.95 33.03 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 -2.58 3.44 -0.30 0.02 -4.23 -1.26 -0.82 115.64 109.91 2kdg s THR 289 Ca 0.48 0.74 -0.01 0.00 -1.18 0.00 0.00 61.69 61.72 2kdg s THR 289 Cb -0.10 -3.26 0.10 0.00 1.34 0.00 0.00 72.50 70.58 2kdg s THR 289 CO 0.40 -0.35 0.09 -0.69 -0.54 0.00 0.00 174.62 173.53 2kdg s VAL 290 N -2.22 0.78 0.74 2.29 1.01 -0.13 -4.68 120.40 118.19 2kdg s VAL 290 Ca 0.67 -1.28 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 2kdg s VAL 290 Cb -0.20 -1.56 0.03 0.00 0.00 0.00 0.00 36.38 34.66 2kdg s VAL 290 CO 0.35 -0.64 1.07 -1.10 0.00 0.00 0.00 175.10 174.78 2kdg s GLN 291 N 1.67 2.56 0.69 2.72 -0.21 -1.26 -3.91 119.66 121.93 2kdg s GLN 291 Ca 0.09 0.98 -0.14 0.00 0.02 0.00 0.00 55.36 56.30 2kdg s GLN 291 Cb -0.17 -1.95 0.02 0.00 1.00 0.00 0.00 33.01 31.91 2kdg s GLN 291 CO -0.25 -1.37 1.12 -1.54 -2.12 0.00 0.00 175.29 171.13 2kdg s SER 292 N -3.67 4.84 0.24 5.90 1.04 -1.26 -4.98 113.70 115.81 2kdg s SER 292 Ca 0.59 2.03 -0.14 0.00 0.48 0.00 0.00 55.95 58.91 2kdg s SER 292 Cb -0.15 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.42 2kdg s SER 292 CO 0.55 -1.81 0.50 -0.62 0.98 0.00 0.00 173.24 172.84 2kdg s ASP 293 N -2.61 -0.13 0.39 7.02 2.15 -0.64 -4.96 116.67 117.89 2kdg s ASP 293 Ca 0.67 -0.82 0.09 0.00 0.43 0.00 0.00 52.55 52.92 2kdg s ASP 293 Cb -0.21 0.59 0.85 0.00 -0.30 0.00 0.00 42.92 43.85 2kdg s ASP 293 CO 0.44 -1.14 1.96 -0.78 -0.17 0.00 0.00 175.17 175.49 2kdg h ASP 294 N 2.23 0.55 1.10 -0.34 3.58 -2.01 -1.79 116.42 119.75 2kdg h ASP 294 Ca -0.26 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.20 2kdg h ASP 294 Cb 1.25 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.19 2kdg h ASP 294 CO 0.35 0.34 -0.32 0.18 -2.88 0.00 0.00 179.24 176.92 2kdg n LEU 295 N -4.48 0.69 -3.27 2.28 4.77 -1.26 -4.54 117.00 111.18 2kdg n LEU 295 Ca 0.11 0.37 -0.25 0.00 -0.03 0.00 0.00 56.01 56.21 2kdg n LEU 295 Cb 0.29 -0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 41.05 2kdg n LEU 295 CO 0.33 -0.09 -0.18 1.41 -1.33 0.00 0.00 177.39 177.53 2kdg n HIS 296 N -2.09 0.91 -2.33 -1.77 8.25 -0.68 -1.11 115.22 116.38 2kdg n HIS 296 Ca 0.05 -3.75 -0.38 0.00 -0.26 0.00 0.00 57.72 53.38 2kdg n HIS 296 Cb 0.42 -0.41 -0.02 0.00 1.12 0.00 0.00 29.99 31.10 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 -1.57 4.10 -0.22 -0.41 1.02 -1.15 -1.62 119.74 119.89 2kdg s LYS 297 Ca 0.36 1.80 -0.04 0.00 0.02 0.00 0.00 55.97 58.11 2kdg s LYS 297 Cb 0.16 -2.69 0.08 0.00 -0.52 0.00 0.00 37.83 34.87 2kdg s LYS 297 CO -0.08 -0.27 0.14 -1.64 -0.92 0.00 0.00 175.35 172.59 2kdg s MET 298 N -2.28 0.15 0.19 1.68 -1.94 -1.26 -1.58 119.30 114.26 2kdg s MET 298 Ca 0.56 -0.17 0.02 0.00 -1.71 0.00 0.00 55.69 54.39 2kdg s MET 298 Cb -0.30 -1.41 -0.05 0.00 2.01 0.00 0.00 34.83 35.08 2kdg s MET 298 CO 0.37 -0.81 0.01 0.96 -0.01 0.00 0.00 175.02 175.54 2kdg s ILE 299 N 2.18 0.75 -0.14 2.53 -0.00 -0.95 -5.02 121.20 120.55 2kdg s ILE 299 Ca 0.06 -1.99 -0.01 0.00 -0.00 0.00 0.00 60.65 58.70 2kdg s ILE 299 Cb -0.16 -2.20 0.04 0.00 -0.00 0.00 0.00 42.46 40.14 2kdg s ILE 299 CO -0.20 -0.41 -0.03 -0.69 -0.00 0.00 0.00 174.94 173.61 2kdg s VAL 300 N -3.61 0.83 0.37 8.37 1.01 -1.26 -0.79 120.40 125.31 2kdg s VAL 300 Ca 0.26 -0.40 -0.26 0.00 0.00 0.00 0.00 61.98 61.58 2kdg s VAL 300 Cb 0.06 -1.04 -0.09 0.00 0.00 0.00 0.00 36.38 35.32 2kdg s VAL 300 CO 0.06 0.13 1.12 -0.44 0.00 0.00 0.00 175.10 175.97 2kdg s SER 301 N 1.76 6.77 0.66 3.32 0.01 -0.26 -4.95 113.70 121.01 2kdg s SER 301 Ca 0.02 2.26 0.40 0.00 1.31 0.00 0.00 55.95 59.94 2kdg s SER 301 Cb -0.14 -2.61 2.20 0.00 0.21 0.00 0.00 66.02 65.67 2kdg s SER 301 CO -0.07 -0.50 2.25 1.05 0.41 0.00 0.00 173.24 176.38 2kdg h GLU 302 N 2.90 0.00 0.00 12.44 4.11 -2.01 -1.92 114.58 130.10 2kdg h GLU 302 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2kdg h GLU 302 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2kdg h GLU 302 CO 0.64 0.00 0.00 1.63 0.07 0.00 0.00 179.01 181.35 2kdg n LYS 303 N -3.07 0.37 -0.62 1.06 4.76 -1.26 -4.89 118.16 114.50 2kdg n LYS 303 Ca -0.03 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 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 0.69 0.51 2.67 0.72 0.00 -0.73 -4.97 105.19 104.07 2kdg n GLY 304 Ca 0.12 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.66 1.04 0.35 0.99 2.96 -1.17 -0.94 118.68 121.26 2kdg s LEU 305 Ca 0.00 -1.02 -0.26 0.00 -0.22 0.00 0.00 54.13 52.64 2kdg s LEU 305 Cb 0.00 -0.51 -0.09 0.00 0.50 0.00 0.00 46.19 46.08 2kdg s LEU 305 CO 0.00 -0.36 1.03 -2.28 -1.32 0.00 0.00 176.35 173.41 2kdg s HIS 306 N 1.93 3.45 -0.16 5.38 5.65 -0.33 -1.10 115.29 130.11 2kdg s HIS 306 Ca 0.04 1.70 -0.01 0.00 0.25 0.00 0.00 55.06 57.03 2kdg s HIS 306 Cb -0.17 -3.09 0.04 0.00 -1.18 0.00 0.00 32.58 28.18 2kdg s HIS 306 CO -0.17 -0.36 -0.03 -1.12 -0.65 0.00 0.00 174.74 172.41 2kdg s SER 307 N -1.46 2.73 -0.23 9.88 0.01 0.03 -1.18 113.70 123.48 2kdg s SER 307 Ca 0.53 -0.64 -0.06 0.00 1.31 0.00 0.00 55.95 57.10 2kdg s SER 307 Cb -0.23 -0.81 -0.02 0.00 0.21 0.00 0.00 66.02 65.17 2kdg s SER 307 CO 0.29 -0.21 0.02 -0.22 0.41 0.00 0.00 173.24 173.53 2kdg s LEU 308 N 1.70 3.22 0.15 2.44 1.98 -0.26 -2.23 118.68 125.68 2kdg s LEU 308 Ca 0.01 -0.27 0.10 0.00 -2.89 0.00 0.00 54.13 51.08 2kdg s LEU 308 Cb -0.15 -1.84 -0.04 0.00 0.66 0.00 0.00 46.19 44.82 2kdg s LEU 308 CO -0.07 -0.01 -0.24 -0.63 -1.89 0.00 0.00 176.35 173.51 2kdg s ILE 309 N 1.43 2.14 -0.22 6.68 1.01 -0.62 -0.52 121.20 131.10 2kdg s ILE 309 Ca 0.05 -1.84 -0.00 0.00 0.00 0.00 0.00 60.65 58.86 2kdg s ILE 309 Cb -0.15 -1.95 0.06 0.00 0.01 0.00 0.00 42.46 40.44 2kdg s ILE 309 CO 0.01 -0.06 -0.04 -0.36 0.00 0.00 0.00 174.94 174.49 2kdg s PHE 310 N -1.42 2.05 0.18 3.97 0.40 0.01 -3.46 117.98 119.72 2kdg s PHE 310 Ca 0.15 -1.50 -0.09 0.00 -0.60 0.00 0.00 56.93 54.89 2kdg s PHE 310 Cb -0.09 -1.44 0.07 0.00 0.51 0.00 0.00 43.02 42.07 2kdg s PHE 310 CO 0.07 -0.72 1.65 0.93 0.70 0.00 0.00 175.22 177.84 2kdg h GLU 311 N 8.03 1.09 -1.70 0.44 4.39 -1.38 -1.71 114.58 123.74 2kdg h GLU 311 Ca -0.19 -0.34 -0.29 0.00 0.34 0.00 0.00 59.36 58.89 2kdg h GLU 311 Cb 1.09 -0.10 -0.28 0.00 -0.10 0.00 0.00 28.75 29.36 2kdg h GLU 311 CO 0.40 1.05 -0.62 0.54 -1.16 0.00 0.00 179.01 179.21 2kdg s VAL 312 N -5.04 -0.51 0.33 3.13 0.11 -1.25 -3.65 120.40 113.52 2kdg s VAL 312 Ca -0.12 -0.74 -0.28 0.00 -2.93 0.00 0.00 61.98 57.91 2kdg s VAL 312 Cb 0.14 -0.50 -0.10 0.00 -1.53 0.00 0.00 36.38 34.39 2kdg s VAL 312 CO 0.86 -0.43 1.21 0.54 -3.33 0.00 0.00 175.10 173.95 2kdg s VAL 313 N 1.53 3.05 0.26 2.04 0.11 -0.70 -4.86 120.40 121.83 2kdg s VAL 313 Ca 0.17 1.01 0.09 0.00 -2.93 0.00 0.00 61.98 60.32 2kdg s VAL 313 Cb -0.12 -3.63 -0.05 0.00 -1.53 0.00 0.00 36.38 31.05 2kdg s VAL 313 CO -0.04 0.21 -0.13 -0.13 -3.33 0.00 0.00 175.10 171.68 2kdg s ARG 314 N -1.81 1.52 0.43 1.54 1.81 -1.26 -0.80 118.95 120.38 2kdg s ARG 314 Ca 0.49 -1.72 0.14 0.00 -1.72 0.00 0.00 55.73 52.93 2kdg s ARG 314 Cb -0.35 -1.33 1.03 0.00 -0.45 0.00 0.00 34.95 33.85 2kdg s ARG 314 CO 0.46 0.17 1.96 0.00 -0.68 0.00 0.00 175.30 177.21 2kdg h ALA 315 N 2.36 2.04 0.00 2.13 0.00 -1.95 -0.70 119.26 123.15 2kdg h ALA 315 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2kdg h ALA 315 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2kdg h ALA 315 CO 0.64 -0.20 0.00 0.77 0.00 0.00 0.00 179.25 180.46 2kdg h SER 316 N 0.42 0.00 0.48 0.00 0.02 -1.97 -2.76 113.55 109.74 2kdg h SER 316 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2kdg h SER 316 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2kdg h SER 316 CO -0.09 0.00 -0.07 0.47 -1.14 0.00 0.00 176.83 176.00 2kdg n ASP 317 N -2.72 0.24 -4.75 3.07 8.00 -0.27 -4.93 116.55 115.20 2kdg n ASP 317 Ca -0.00 -0.34 -0.35 0.00 0.71 0.00 0.00 54.79 54.81 2kdg n ASP 317 Cb 0.17 -0.17 0.05 0.00 -0.02 0.00 0.00 41.12 41.14 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 -2.55 2.44 0.00 2.24 0.00 -1.04 -4.93 121.76 117.92 2kdg s ALA 318 Ca 0.28 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2kdg s ALA 318 Cb 0.20 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.90 2kdg s ALA 318 CO 0.48 -1.31 0.00 0.41 0.00 0.00 0.00 175.76 175.34 2kdg n GLY 319 N 0.24 0.82 3.52 0.00 0.00 -0.45 -4.99 105.19 104.32 2kdg n GLY 319 Ca 0.13 -2.02 -0.43 0.00 0.00 0.00 0.00 46.02 43.70 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 -1.23 3.07 0.49 4.61 0.00 -1.26 -1.29 121.76 126.15 2kdg s ALA 320 Ca 0.00 -1.32 -0.19 0.00 0.00 0.00 0.00 51.96 50.45 2kdg s ALA 320 Cb 0.00 -3.88 -0.08 0.00 0.00 0.00 0.00 23.12 19.16 2kdg s ALA 320 CO 0.00 -2.63 0.99 0.71 0.00 0.00 0.00 175.76 174.84 2kdg s TYR 321 N 4.36 3.24 0.05 0.00 1.51 0.12 -1.17 117.35 125.46 2kdg s TYR 321 Ca 0.31 1.55 -0.00 0.00 -1.01 0.00 0.00 57.07 57.92 2kdg s TYR 321 Cb -0.12 -2.90 -0.03 0.00 -0.11 0.00 0.00 41.96 38.80 2kdg s TYR 321 CO 0.18 -0.48 -0.04 0.00 -1.11 0.00 0.00 175.55 174.10 2kdg s ALA 322 N -2.31 0.48 -0.02 3.71 0.00 -0.42 -1.77 121.76 121.42 2kdg s ALA 322 Ca 0.62 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 51.58 2kdg s ALA 322 Cb -0.12 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.21 2kdg s ALA 322 CO 0.23 -0.26 -0.07 0.00 0.00 0.00 0.00 175.76 175.66 2kdg s VAL 324 N 0.16 1.18 -0.16 0.00 1.01 -0.30 -0.81 120.40 121.48 2kdg s VAL 324 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2kdg s VAL 324 Cb -0.07 -1.11 0.03 0.00 0.00 0.00 0.00 36.38 35.24 2kdg s VAL 324 CO -0.00 0.37 -0.11 0.00 0.00 0.00 0.00 175.10 175.37 2kdg s ALA 325 N 0.99 1.78 -0.06 5.51 0.00 -0.20 -1.21 121.76 128.58 2kdg s ALA 325 Ca -0.08 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 50.97 2kdg s ALA 325 Cb -0.15 -1.12 -0.00 0.00 0.00 0.00 0.00 23.12 21.85 2kdg s ALA 325 CO -0.00 -0.60 -0.19 0.15 0.00 0.00 0.00 175.76 175.12 2kdg s LYS 326 N 1.51 2.09 0.41 0.00 1.02 -0.70 -0.97 119.74 123.09 2kdg s LYS 326 Ca 0.02 -0.67 0.04 0.00 0.02 0.00 0.00 55.97 55.38 2kdg s LYS 326 Cb -0.14 -1.74 -0.02 0.00 -0.52 0.00 0.00 37.83 35.40 2kdg s LYS 326 CO -0.09 0.23 0.16 0.54 -0.92 0.00 0.00 175.35 175.26 2kdg s ASN 327 N 0.14 2.69 0.00 2.83 2.20 -0.33 -0.63 114.94 121.85 2kdg s ASN 327 Ca -0.08 -1.71 0.05 0.00 -0.94 0.00 0.00 52.86 50.19 2kdg s ASN 327 Cb -0.13 0.56 0.23 0.00 -2.00 0.00 0.00 41.25 39.90 2kdg s ASN 327 CO 0.04 -0.97 1.17 -2.11 -2.94 0.00 0.00 177.10 172.28 2kdg n ARG 328 N -0.89 0.00 -0.01 3.55 1.85 -1.26 -2.81 116.66 117.09 2kdg n ARG 328 Ca -0.04 0.41 0.05 0.00 -1.00 0.00 0.00 57.85 57.27 2kdg n ARG 328 Cb 0.64 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.47 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 -1.50 2.38 0.00 2.89 0.00 -1.26 -5.09 120.51 117.93 2kdg n ALA 329 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2kdg n ALA 329 Cb 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.15 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 1.90 -1.23 2.98 0.00 0.00 -1.12 -4.48 105.19 103.24 2kdg n GLY 330 Ca -0.02 -0.91 -0.11 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.59 0.32 0.06 1.61 2.12 -1.26 -1.18 118.70 119.77 2kdg s GLU 331 Ca 0.00 -0.49 0.02 0.00 0.36 0.00 0.00 54.97 54.86 2kdg s GLU 331 Cb 0.00 -0.07 -0.03 0.00 0.26 0.00 0.00 34.13 34.29 2kdg s GLU 331 CO 0.00 0.00 -0.07 0.00 -0.54 0.00 0.00 175.26 174.66 2kdg s ALA 332 N -1.03 0.64 -0.00 6.30 0.00 -0.14 -4.79 121.76 122.73 2kdg s ALA 332 Ca -0.10 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 50.93 2kdg s ALA 332 Cb -0.07 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.15 2kdg s ALA 332 CO -0.00 -0.12 -0.04 0.99 0.00 0.00 0.00 175.76 176.58 2kdg s THR 333 N -2.22 0.34 0.12 0.00 2.01 -1.26 -1.03 115.64 113.60 2kdg s THR 333 Ca -0.03 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 61.81 2kdg s THR 333 Cb -0.04 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 2kdg s THR 333 CO -0.02 0.09 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.56 2kdg s PHE 334 N -0.11 1.08 -0.02 4.92 0.40 0.01 -5.00 117.98 119.26 2kdg s PHE 334 Ca 0.02 -0.81 -0.05 0.00 -0.60 0.00 0.00 56.93 55.49 2kdg s PHE 334 Cb -0.02 -0.58 0.01 0.00 0.51 0.00 0.00 43.02 42.94 2kdg s PHE 334 CO -0.00 -0.02 0.11 0.99 0.70 0.00 0.00 175.22 176.99 2kdg s THR 335 N -3.31 0.04 0.13 0.64 2.01 -1.26 -1.05 115.64 112.83 2kdg s THR 335 Ca 0.13 -0.31 -0.12 0.00 0.31 0.00 0.00 61.69 61.69 2kdg s THR 335 Cb 0.03 -0.27 0.01 0.00 0.01 0.00 0.00 72.50 72.29 2kdg s THR 335 CO -0.02 -0.17 0.32 0.54 -0.69 0.00 0.00 174.62 174.60 2kdg s VAL 336 N -0.55 0.09 -0.03 3.82 0.11 -0.73 -4.92 120.40 118.20 2kdg s VAL 336 Ca -0.06 -0.96 0.06 0.00 -2.93 0.00 0.00 61.98 58.09 2kdg s VAL 336 Cb -0.04 -1.39 -0.01 0.00 -1.53 0.00 0.00 36.38 33.41 2kdg s VAL 336 CO 0.00 -0.41 -0.21 -1.58 -3.33 0.00 0.00 175.10 169.57 2kdg s GLN 337 N -3.86 1.84 -0.25 1.54 0.74 -1.26 -0.70 119.66 117.71 2kdg s GLN 337 Ca 0.07 -0.75 0.01 0.00 0.05 0.00 0.00 55.36 54.74 2kdg s GLN 337 Cb 0.03 -1.70 0.06 0.00 1.10 0.00 0.00 33.01 32.50 2kdg s GLN 337 CO -0.09 0.40 -0.04 -1.17 -0.55 0.00 0.00 175.29 173.84 2kdg s LEU 338 N -0.34 2.74 -1.09 3.68 2.96 -0.41 -1.10 118.68 125.12 2kdg s LEU 338 Ca 0.04 -1.27 -0.13 0.00 -0.22 0.00 0.00 54.13 52.55 2kdg s LEU 338 Cb -0.10 -1.22 0.20 0.00 0.50 0.00 0.00 46.19 45.58 2kdg s LEU 338 CO 0.00 -0.25 1.21 -0.62 -1.32 0.00 0.00 176.35 175.37 2kdg s ASP 339 N 1.36 7.03 -0.16 3.68 2.15 -0.07 -1.34 116.67 129.31 2kdg s ASP 339 Ca -0.04 -2.96 -0.29 0.00 0.43 0.00 0.00 52.55 49.69 2kdg s ASP 339 Cb -0.19 -2.32 -0.05 0.00 -0.30 0.00 0.00 42.92 40.06 2kdg s ASP 339 CO -0.07 -0.65 1.89 -0.69 -0.17 0.00 0.00 175.17 175.48 2kdg s VAL 340 N 0.80 3.31 -0.85 1.11 1.01 -1.26 -3.39 120.40 121.13 2kdg s VAL 340 Ca 0.35 0.34 -0.25 0.00 0.00 0.00 0.00 61.98 62.42 2kdg s VAL 340 Cb -0.06 -3.32 0.01 0.00 0.00 0.00 0.00 36.38 33.01 2kdg s VAL 340 CO -0.05 -0.14 1.63 -0.76 0.00 0.00 0.00 175.10 175.78 2kdg s LEU 341 N 6.02 3.29 0.67 3.92 1.43 0.10 -4.85 118.68 129.26 2kdg s LEU 341 Ca 0.85 -0.68 -0.17 0.00 -1.03 0.00 0.00 54.13 53.10 2kdg s LEU 341 Cb -0.32 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.35 2kdg s LEU 341 CO 0.34 -2.09 1.25 0.00 0.23 0.00 0.00 176.35 176.08 2kdg s ALA 342 N 7.32 2.31 0.02 4.21 0.00 -1.26 -1.36 121.76 133.00 2kdg s ALA 342 Ca 0.54 1.05 -0.25 0.00 0.00 0.00 0.00 51.96 53.30 2kdg s ALA 342 Cb -0.06 -3.50 -0.17 0.00 0.00 0.00 0.00 23.12 19.38 2kdg s ALA 342 CO 0.04 -1.62 1.40 -0.22 0.00 0.00 0.00 175.76 175.36 2kdg h LYS 343 N 0.29 -0.21 0.00 0.00 3.64 -1.94 -3.46 116.57 114.89 2kdg h LYS 343 Ca -0.50 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2kdg h LYS 343 Cb 1.31 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 2kdg h LYS 343 CO 0.52 0.07 0.00 0.39 -2.27 0.00 0.00 179.45 178.16