#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 1.38 0.33 4.61 0.00 -1.26 -5.09 121.76 121.73 2kdg s ALA -3 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 51.96 52.16 2kdg s ALA -3 Cb 0.00 -3.30 0.01 0.00 0.00 0.00 0.00 23.12 19.82 2kdg s ALA -3 CO 0.00 -2.58 0.45 0.00 0.00 0.00 0.00 175.76 173.63 2kdg n MET -2 N -4.07 0.65 -3.60 0.00 0.00 -1.26 -5.06 117.12 103.78 2kdg n MET -2 Ca 0.08 -2.70 0.02 0.00 0.00 0.00 0.00 57.70 55.10 2kdg n MET -2 Cb 0.54 2.57 -0.00 0.00 0.00 0.00 0.00 33.22 36.32 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 -3.08 -0.43 0.80 3.17 0.00 -0.81 -4.95 107.32 102.02 2kdg s GLY -1 Ca 0.28 0.84 -0.11 0.00 0.00 0.00 0.00 44.72 45.73 2kdg s GLY -1 CO 0.20 0.17 1.09 2.56 0.00 0.00 0.00 173.10 177.12 2kdg s PRO 249 N -2.31 2.09 0.80 2.90 0.04 -1.26 -1.07 135.00 136.19 2kdg s PRO 249 Ca 0.14 0.86 -0.11 0.00 0.04 0.00 0.00 61.00 61.94 2kdg s PRO 249 Cb 0.05 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.77 2kdg s PRO 249 CO -0.05 -1.68 1.10 -1.25 0.04 0.00 0.00 177.00 175.16 2kdg s PRO 250 N -5.02 1.99 0.24 0.56 0.04 -1.26 -3.90 135.00 127.64 2kdg s PRO 250 Ca 0.61 1.19 -0.13 0.00 0.04 0.00 0.00 61.00 62.70 2kdg s PRO 250 Cb -0.16 -1.87 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 2kdg s PRO 250 CO 0.55 -1.84 0.48 0.50 0.04 0.00 0.00 177.00 176.74 2kdg s ARG 251 N -4.87 1.51 0.43 4.56 6.06 -1.26 -4.65 118.95 120.72 2kdg s ARG 251 Ca 0.62 -1.19 -0.23 0.00 -2.50 0.00 0.00 55.73 52.43 2kdg s ARG 251 Cb -0.18 0.47 -0.08 0.00 0.06 0.00 0.00 34.95 35.22 2kdg s ARG 251 CO 0.56 -0.63 1.10 -0.06 -2.50 0.00 0.00 175.30 173.77 2kdg s PHE 252 N -3.99 3.09 0.16 5.12 0.08 -1.26 -4.03 117.98 117.15 2kdg s PHE 252 Ca 0.20 1.59 0.00 0.00 0.12 0.00 0.00 56.93 58.84 2kdg s PHE 252 Cb -0.01 -3.22 0.00 0.00 -0.57 0.00 0.00 43.02 39.22 2kdg s PHE 252 CO 0.07 -1.00 0.00 -0.89 -0.10 0.00 0.00 175.22 173.30 2kdg n ILE 253 N -0.31 0.13 -3.72 0.64 -0.00 -1.26 -5.01 119.36 109.83 2kdg n ILE 253 Ca 0.06 0.04 -0.13 0.00 -0.00 0.00 0.00 62.75 62.73 2kdg n ILE 253 Cb 0.49 -0.49 -0.10 0.00 -0.00 0.00 0.00 39.64 39.55 2kdg n ILE 253 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.55 174.97 2kdg s GLN 254 N -1.59 0.48 0.07 0.38 0.74 -1.26 -5.07 119.66 113.40 2kdg s GLN 254 Ca 0.00 0.62 0.04 0.00 0.05 0.00 0.00 55.36 56.07 2kdg s GLN 254 Cb 0.00 0.20 -0.03 0.00 1.10 0.00 0.00 33.01 34.28 2kdg s GLN 254 CO 0.00 -0.07 -0.10 0.14 -0.55 0.00 0.00 175.29 174.70 2kdg s VAL 255 N 0.41 0.85 0.50 1.34 -7.23 -1.26 -2.72 120.40 112.29 2kdg s VAL 255 Ca -0.02 -1.35 -0.21 0.00 -1.81 0.00 0.00 61.98 58.59 2kdg s VAL 255 Cb -0.04 -1.02 -0.06 0.00 0.56 0.00 0.00 36.38 35.81 2kdg s VAL 255 CO -0.02 -0.40 1.16 -2.16 -0.31 0.00 0.00 175.10 173.37 2kdg s PRO 256 N -2.08 3.54 1.06 4.82 0.04 -1.26 -5.07 135.00 136.04 2kdg s PRO 256 Ca -0.02 1.73 -0.17 0.00 0.04 0.00 0.00 61.00 62.58 2kdg s PRO 256 Cb -0.07 -2.22 0.23 0.00 0.04 0.00 0.00 34.50 32.48 2kdg s PRO 256 CO 0.01 -0.72 1.20 -1.21 0.04 0.00 0.00 177.00 176.31 2kdg s GLU 257 N -2.97 -0.11 -0.04 4.56 2.02 -1.26 -4.77 118.70 116.13 2kdg s GLU 257 Ca 0.68 -0.13 -0.35 0.00 0.02 0.00 0.00 54.97 55.19 2kdg s GLU 257 Cb -0.27 -1.73 -0.13 0.00 0.10 0.00 0.00 34.13 32.10 2kdg s GLU 257 CO 0.32 -2.96 1.78 0.27 0.02 0.00 0.00 175.26 174.69 2kdg n ASN 258 N -4.21 3.22 -4.93 -0.19 6.94 -1.26 -4.70 115.26 110.13 2kdg n ASN 258 Ca 0.13 1.01 -0.22 0.00 -0.02 0.00 0.00 54.58 55.48 2kdg n ASN 258 Cb 0.59 -1.36 -0.03 0.00 -2.36 0.00 0.00 39.78 36.63 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 3.14 3.32 -0.17 -3.83 -1.94 -0.07 -5.00 119.30 114.76 2kdg s MET 259 Ca 0.89 -0.79 -0.04 0.00 -1.71 0.00 0.00 55.69 54.04 2kdg s MET 259 Cb -0.73 -2.83 0.08 0.00 2.01 0.00 0.00 34.83 33.37 2kdg s MET 259 CO 0.49 0.44 0.26 -1.54 -0.01 0.00 0.00 175.02 174.67 2kdg s SER 260 N -3.80 0.69 -0.05 3.03 1.04 -1.26 -0.91 113.70 112.44 2kdg s SER 260 Ca 0.34 0.26 0.04 0.00 0.48 0.00 0.00 55.95 57.07 2kdg s SER 260 Cb -0.09 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.67 2kdg s SER 260 CO 0.28 -0.28 -0.16 -0.63 0.98 0.00 0.00 173.24 173.44 2kdg s ILE 261 N 2.40 1.32 0.20 -1.02 -1.09 -1.22 -4.92 121.20 116.88 2kdg s ILE 261 Ca 0.05 -0.64 -0.31 0.00 -2.23 0.00 0.00 60.65 57.51 2kdg s ILE 261 Cb -0.14 -1.15 -0.10 0.00 -1.58 0.00 0.00 42.46 39.49 2kdg s ILE 261 CO -0.11 0.39 1.55 -0.62 -1.23 0.00 0.00 174.94 174.92 2kdg s ASP 262 N 0.18 6.57 -0.11 3.58 2.15 -1.26 -0.74 116.67 127.04 2kdg s ASP 262 Ca -0.06 2.68 -0.36 0.00 0.43 0.00 0.00 52.55 55.24 2kdg s ASP 262 Cb -0.12 -2.61 -0.13 0.00 -0.30 0.00 0.00 42.92 39.76 2kdg s ASP 262 CO 0.02 -0.81 1.79 1.21 -0.17 0.00 0.00 175.17 177.21 2kdg n GLU 263 N 3.36 1.83 0.00 4.34 2.13 -0.39 -2.49 120.64 129.42 2kdg n GLU 263 Ca 0.11 0.67 0.00 0.00 0.66 0.00 0.00 57.16 58.61 2kdg n GLU 263 Cb 0.39 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.64 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 4.16 0.31 3.79 8.31 0.00 0.09 -4.87 105.19 116.98 2kdg n GLY 264 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.81 2.60 0.46 1.61 0.52 -1.04 -4.54 118.95 117.75 2kdg s ARG 265 Ca 0.00 1.10 -0.22 0.00 -0.52 0.00 0.00 55.73 56.09 2kdg s ARG 265 Cb 0.00 -1.94 -0.08 0.00 0.52 0.00 0.00 34.95 33.45 2kdg s ARG 265 CO 0.00 -1.37 1.10 0.12 0.02 0.00 0.00 175.30 175.16 2kdg s PHE 266 N -2.91 2.98 0.14 -0.53 2.19 -1.24 -2.07 117.98 116.55 2kdg s PHE 266 Ca 0.60 1.58 -0.11 0.00 0.33 0.00 0.00 56.93 59.33 2kdg s PHE 266 Cb -0.16 -3.22 0.01 0.00 -1.31 0.00 0.00 43.02 38.34 2kdg s PHE 266 CO 0.54 -1.10 0.31 0.00 1.83 0.00 0.00 175.22 176.80 2kdg s ARG 268 N -3.90 0.96 0.21 0.00 1.70 -1.26 -0.79 118.95 115.87 2kdg s ARG 268 Ca 0.10 -1.29 0.08 0.00 -0.47 0.00 0.00 55.73 54.16 2kdg s ARG 268 Cb 0.03 0.29 -0.05 0.00 -0.57 0.00 0.00 34.95 34.65 2kdg s ARG 268 CO -0.05 -0.30 -0.15 -1.64 -1.08 0.00 0.00 175.30 172.08 2kdg s MET 269 N -3.99 1.35 -0.38 3.89 -1.94 0.16 -5.00 119.30 113.40 2kdg s MET 269 Ca 0.18 -1.60 0.01 0.00 -1.71 0.00 0.00 55.69 52.57 2kdg s MET 269 Cb 0.06 -1.17 0.14 0.00 2.01 0.00 0.00 34.83 35.87 2kdg s MET 269 CO -0.01 0.20 0.22 -0.51 -0.01 0.00 0.00 175.02 174.90 2kdg s ASP 270 N -3.33 3.17 -0.46 3.03 1.01 -1.26 -3.24 116.67 115.61 2kdg s ASP 270 Ca 0.23 -2.32 -0.15 0.00 0.71 0.00 0.00 52.55 51.02 2kdg s ASP 270 Cb -0.01 -0.59 0.06 0.00 1.01 0.00 0.00 42.92 43.39 2kdg s ASP 270 CO 0.07 -0.30 0.36 -0.36 0.21 0.00 0.00 175.17 175.16 2kdg s PHE 271 N 0.85 3.25 0.20 4.23 0.40 -1.00 -4.51 117.98 121.40 2kdg s PHE 271 Ca 0.18 -0.93 -0.30 0.00 -0.60 0.00 0.00 56.93 55.28 2kdg s PHE 271 Cb -0.23 -3.04 -0.09 0.00 0.51 0.00 0.00 43.02 40.16 2kdg s PHE 271 CO 0.01 -0.76 1.42 0.15 0.70 0.00 0.00 175.22 176.73 2kdg s LYS 272 N 1.63 4.30 -0.01 0.44 1.02 -1.10 -0.83 119.74 125.18 2kdg s LYS 272 Ca 0.04 2.20 -0.05 0.00 0.02 0.00 0.00 55.97 58.18 2kdg s LYS 272 Cb -0.23 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 33.91 2kdg s LYS 272 CO 0.07 -0.41 0.11 0.54 -0.92 0.00 0.00 175.35 174.74 2kdg s VAL 273 N 0.43 0.06 0.00 3.17 0.11 -0.46 -4.37 120.40 119.33 2kdg s VAL 273 Ca 0.61 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 59.19 2kdg s VAL 273 Cb -0.40 -0.32 0.00 0.00 -1.53 0.00 0.00 36.38 34.13 2kdg s VAL 273 CO 0.37 -0.26 0.00 -1.54 -3.33 0.00 0.00 175.10 170.34 2kdg n SER 274 N 2.02 1.14 0.00 3.54 3.41 -1.26 -4.31 113.62 118.17 2kdg n SER 274 Ca -0.19 -0.57 0.00 0.00 -0.26 0.00 0.00 58.87 57.85 2kdg n SER 274 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2kdg n SER 274 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kdg n GLY 275 N 2.85 1.71 2.86 5.00 0.00 -1.25 -4.21 105.19 112.15 2kdg n GLY 275 Ca 0.00 -1.91 -0.15 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 -0.22 0.56 1.06 0.99 2.96 -0.23 -4.26 118.68 119.54 2kdg s LEU 276 Ca 0.00 0.25 -0.12 0.00 -0.22 0.00 0.00 54.13 54.04 2kdg s LEU 276 Cb 0.00 0.24 0.23 0.00 0.50 0.00 0.00 46.19 47.15 2kdg s LEU 276 CO 0.00 -0.17 1.07 -2.16 -1.32 0.00 0.00 176.35 173.76 2kdg s PRO 277 N 1.48 -0.10 0.09 0.98 0.04 -1.26 -1.92 135.00 134.31 2kdg s PRO 277 Ca -0.05 0.66 -0.33 0.00 0.04 0.00 0.00 61.00 61.32 2kdg s PRO 277 Cb -0.12 -1.66 -0.12 0.00 0.04 0.00 0.00 34.50 32.63 2kdg s PRO 277 CO -0.05 -3.13 1.74 0.00 0.04 0.00 0.00 177.00 175.60 2kdg n ALA 278 N -4.47 1.54 -1.78 8.56 0.00 -1.26 -4.84 120.51 118.27 2kdg n ALA 278 Ca 0.04 0.36 -0.36 0.00 0.00 0.00 0.00 53.44 53.49 2kdg n ALA 278 Cb 0.56 -2.47 -0.01 0.00 0.00 0.00 0.00 19.45 17.53 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 2.30 3.59 0.19 0.00 0.04 -1.26 -4.93 135.00 134.93 2kdg s PRO 279 Ca 0.83 1.63 -0.31 0.00 0.04 0.00 0.00 61.00 63.20 2kdg s PRO 279 Cb -0.62 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 31.65 2kdg s PRO 279 CO 0.41 -0.66 1.41 0.34 0.04 0.00 0.00 177.00 178.54 2kdg s ASP 280 N -1.64 6.76 -0.03 6.66 2.15 0.26 -4.78 116.67 126.05 2kdg s ASP 280 Ca 0.68 2.49 0.06 0.00 0.43 0.00 0.00 52.55 56.21 2kdg s ASP 280 Cb -0.25 -2.61 -0.01 0.00 -0.30 0.00 0.00 42.92 39.76 2kdg s ASP 280 CO 0.29 -0.65 -0.21 0.68 -0.17 0.00 0.00 175.17 175.11 2kdg s VAL 281 N 0.48 1.64 0.07 1.11 -7.23 -1.26 -0.83 120.40 114.37 2kdg s VAL 281 Ca 0.61 -0.87 0.02 0.00 -1.81 0.00 0.00 61.98 59.94 2kdg s VAL 281 Cb -0.39 -1.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.14 2kdg s VAL 281 CO 0.37 0.46 -0.08 -0.44 -0.31 0.00 0.00 175.10 175.10 2kdg s SER 282 N -0.36 1.08 0.14 4.85 0.01 -0.82 -5.00 113.70 113.60 2kdg s SER 282 Ca 0.05 -0.74 0.08 0.00 1.31 0.00 0.00 55.95 56.65 2kdg s SER 282 Cb -0.09 0.05 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 2kdg s SER 282 CO 0.00 -0.29 -0.19 0.26 0.41 0.00 0.00 173.24 173.43 2kdg s TRP 283 N -2.27 1.82 0.08 2.43 0.52 -1.26 -1.27 118.94 119.00 2kdg s TRP 283 Ca -0.00 -0.45 -0.07 0.00 0.02 0.00 0.00 56.10 55.60 2kdg s TRP 283 Cb -0.04 -0.94 -0.01 0.00 -1.15 0.00 0.00 33.47 31.33 2kdg s TRP 283 CO -0.01 0.29 0.13 0.71 0.02 0.00 0.00 176.95 178.09 2kdg s TYR 284 N -1.70 0.27 -0.16 -1.98 1.51 0.01 -0.85 117.35 114.44 2kdg s TYR 284 Ca 0.12 -0.72 -0.06 0.00 -1.01 0.00 0.00 57.07 55.39 2kdg s TYR 284 Cb -0.07 -0.15 0.07 0.00 -0.11 0.00 0.00 41.96 41.70 2kdg s TYR 284 CO 0.06 -0.51 0.35 -1.17 -1.11 0.00 0.00 175.55 173.17 2kdg s LEU 285 N -2.88 -0.36 0.00 -1.29 2.96 -0.03 -1.28 118.68 115.80 2kdg s LEU 285 Ca 0.06 0.81 0.00 0.00 -0.22 0.00 0.00 54.13 54.78 2kdg s LEU 285 Cb 0.06 1.09 0.00 0.00 0.50 0.00 0.00 46.19 47.83 2kdg s LEU 285 CO -0.10 -0.22 0.00 0.59 -1.32 0.00 0.00 176.35 175.30 2kdg n ASN 286 N 5.11 -3.13 0.00 3.68 3.02 -0.51 -1.57 115.26 121.86 2kdg n ASN 286 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.44 2kdg n ASN 286 Cb 0.51 -2.48 0.00 0.00 -0.61 0.00 0.00 39.78 37.19 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 1.23 3.81 7.41 0.00 -1.26 -5.07 105.19 111.45 2kdg n GLY 287 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2kdg n GLY 287 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kdg s ARG 288 N 0.00 2.59 0.69 1.61 1.70 -0.61 -5.14 118.95 119.79 2kdg s ARG 288 Ca 0.00 -1.40 -0.12 0.00 -0.47 0.00 0.00 55.73 53.74 2kdg s ARG 288 Cb 0.00 -2.37 0.01 0.00 -0.57 0.00 0.00 34.95 32.03 2kdg s ARG 288 CO 0.00 0.08 1.08 0.95 -1.08 0.00 0.00 175.30 176.33 2kdg s THR 289 N -2.36 3.65 -0.29 4.99 -4.23 -1.26 -0.85 115.64 115.29 2kdg s THR 289 Ca 0.40 0.62 -0.01 0.00 -1.18 0.00 0.00 61.69 61.53 2kdg s THR 289 Cb -0.04 -3.21 0.09 0.00 1.34 0.00 0.00 72.50 70.68 2kdg s THR 289 CO 0.25 -0.62 0.08 -0.69 -0.54 0.00 0.00 174.62 173.10 2kdg s VAL 290 N -2.77 0.97 0.57 2.29 1.01 -0.03 -4.65 120.40 117.80 2kdg s VAL 290 Ca 0.61 -1.36 -0.19 0.00 0.00 0.00 0.00 61.98 61.05 2kdg s VAL 290 Cb -0.16 -1.67 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 2kdg s VAL 290 CO 0.49 -0.59 1.18 -1.10 0.00 0.00 0.00 175.10 175.09 2kdg s GLN 291 N 1.58 3.13 0.32 2.72 1.11 -1.26 -4.25 119.66 123.01 2kdg s GLN 291 Ca 0.08 1.74 -0.29 0.00 0.01 0.00 0.00 55.36 56.90 2kdg s GLN 291 Cb -0.17 -1.97 -0.10 0.00 -1.01 0.00 0.00 33.01 29.76 2kdg s GLN 291 CO -0.21 -1.06 1.36 -1.54 0.01 0.00 0.00 175.29 173.85 2kdg s SER 292 N -1.66 6.68 0.20 5.90 1.04 -1.26 -4.94 113.70 119.66 2kdg s SER 292 Ca 0.75 2.74 -0.08 0.00 0.48 0.00 0.00 55.95 59.85 2kdg s SER 292 Cb -0.28 -2.65 -0.02 0.00 0.10 0.00 0.00 66.02 63.18 2kdg s SER 292 CO 0.31 -0.62 0.30 -0.62 0.98 0.00 0.00 173.24 173.58 2kdg s ASP 293 N -0.26 0.03 0.40 7.02 2.15 -0.62 -4.99 116.67 120.40 2kdg s ASP 293 Ca 0.52 -1.03 0.10 0.00 0.43 0.00 0.00 52.55 52.56 2kdg s ASP 293 Cb -0.41 0.47 0.88 0.00 -0.30 0.00 0.00 42.92 43.56 2kdg s ASP 293 CO 0.53 -0.95 1.96 -0.78 -0.17 0.00 0.00 175.17 175.76 2kdg h ASP 294 N 2.48 0.52 1.08 -0.34 3.58 -2.01 -2.03 116.42 119.70 2kdg h ASP 294 Ca -0.31 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.15 2kdg h ASP 294 Cb 1.24 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.19 2kdg h ASP 294 CO 0.46 0.32 -0.44 -0.07 -2.88 0.00 0.00 179.24 176.63 2kdg h LEU 295 N 0.58 0.00 -6.18 2.28 3.38 -1.96 -3.42 115.31 109.99 2kdg h LEU 295 Ca 0.30 -0.14 -0.58 0.00 0.09 0.00 0.00 57.88 57.56 2kdg h LEU 295 Cb 0.42 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.77 2kdg h LEU 295 CO -0.10 0.07 -0.97 1.41 0.09 0.00 0.00 178.44 178.95 2kdg n HIS 296 N -2.20 0.33 -2.42 1.13 8.25 -0.78 -1.12 115.22 118.41 2kdg n HIS 296 Ca 0.04 -3.64 -0.38 0.00 -0.26 0.00 0.00 57.72 53.48 2kdg n HIS 296 Cb 0.44 -0.25 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 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 -1.10 4.24 -0.24 -0.41 1.02 -1.13 -1.60 119.74 120.53 2kdg s LYS 297 Ca 0.35 1.72 -0.04 0.00 0.02 0.00 0.00 55.97 58.02 2kdg s LYS 297 Cb 0.12 -2.76 0.09 0.00 -0.52 0.00 0.00 37.83 34.76 2kdg s LYS 297 CO -0.12 -0.12 0.17 -1.64 -0.92 0.00 0.00 175.35 172.71 2kdg s MET 298 N -2.15 0.18 0.01 1.68 -1.94 -1.26 -1.66 119.30 114.16 2kdg s MET 298 Ca 0.54 -0.16 0.01 0.00 -1.71 0.00 0.00 55.69 54.37 2kdg s MET 298 Cb -0.28 -1.28 -0.01 0.00 2.01 0.00 0.00 34.83 35.27 2kdg s MET 298 CO 0.36 -0.83 -0.04 0.96 -0.01 0.00 0.00 175.02 175.45 2kdg s ILE 299 N 2.21 0.27 -0.58 2.53 -0.00 -0.93 -5.05 121.20 119.65 2kdg s ILE 299 Ca 0.07 -0.54 -0.19 0.00 -0.00 0.00 0.00 60.65 59.99 2kdg s ILE 299 Cb -0.16 -0.31 0.10 0.00 -0.00 0.00 0.00 42.46 42.10 2kdg s ILE 299 CO -0.22 -0.18 0.68 -0.69 -0.00 0.00 0.00 174.94 174.53 2kdg s VAL 300 N -0.71 4.86 1.09 8.37 1.01 -1.26 -1.05 120.40 132.70 2kdg s VAL 300 Ca -0.06 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.80 2kdg s VAL 300 Cb -0.05 -4.46 0.24 0.00 0.00 0.00 0.00 36.38 32.11 2kdg s VAL 300 CO -0.00 -1.08 1.06 -0.44 0.00 0.00 0.00 175.10 174.64 2kdg s SER 301 N 3.54 1.67 1.04 3.32 0.01 -0.02 -4.98 113.70 118.29 2kdg s SER 301 Ca 0.11 1.44 -0.12 0.00 1.31 0.00 0.00 55.95 58.69 2kdg s SER 301 Cb -0.24 -2.16 0.22 0.00 0.21 0.00 0.00 66.02 64.04 2kdg s SER 301 CO 0.06 -3.76 1.08 -1.83 0.41 0.00 0.00 173.24 169.20 2kdg s GLU 302 N -4.65 0.03 -1.84 12.44 1.03 -1.26 -3.86 118.70 120.58 2kdg s GLU 302 Ca 0.67 1.09 0.00 0.00 0.03 0.00 0.00 54.97 56.76 2kdg s GLU 302 Cb -0.22 -1.65 0.00 0.00 -0.80 0.00 0.00 34.13 31.46 2kdg s GLU 302 CO 0.62 -3.16 0.00 1.63 -1.33 0.00 0.00 175.26 173.02 2kdg n LYS 303 N -4.55 -1.42 -1.32 -4.83 5.02 -1.26 -3.53 118.16 106.28 2kdg n LYS 303 Ca 0.07 1.03 0.00 0.00 -2.02 0.00 0.00 58.31 57.38 2kdg n LYS 303 Cb 0.54 -5.37 0.00 0.00 -0.02 0.00 0.00 35.03 30.17 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 -0.37 0.63 3.00 0.72 0.00 -1.26 -4.98 105.19 102.94 2kdg n GLY 304 Ca -0.18 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.74 2.17 -0.17 0.99 2.96 -1.23 -1.35 118.68 120.30 2kdg s LEU 305 Ca 0.00 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.54 2kdg s LEU 305 Cb 0.00 -0.12 0.04 0.00 0.50 0.00 0.00 46.19 46.61 2kdg s LEU 305 CO 0.00 -0.14 -0.08 -2.28 -1.32 0.00 0.00 176.35 172.53 2kdg s HIS 306 N -0.95 2.01 -0.03 5.38 5.65 -0.01 -0.84 115.29 126.50 2kdg s HIS 306 Ca -0.07 -1.27 -0.29 0.00 0.25 0.00 0.00 55.06 53.68 2kdg s HIS 306 Cb -0.07 -1.46 -0.03 0.00 -1.18 0.00 0.00 32.58 29.84 2kdg s HIS 306 CO -0.00 -0.66 0.95 -1.12 -0.65 0.00 0.00 174.74 173.25 2kdg s SER 307 N 1.53 7.30 -0.13 9.88 0.01 -0.22 -2.36 113.70 129.71 2kdg s SER 307 Ca 0.01 1.58 -0.00 0.00 1.31 0.00 0.00 55.95 58.84 2kdg s SER 307 Cb -0.15 -2.55 0.03 0.00 0.21 0.00 0.00 66.02 63.56 2kdg s SER 307 CO -0.08 -0.27 -0.09 -0.22 0.41 0.00 0.00 173.24 172.99 2kdg s LEU 308 N 1.16 1.35 0.19 2.44 1.98 -1.20 -2.19 118.68 122.40 2kdg s LEU 308 Ca 0.50 -0.39 0.11 0.00 -2.89 0.00 0.00 54.13 51.46 2kdg s LEU 308 Cb -0.20 -0.93 -0.04 0.00 0.66 0.00 0.00 46.19 45.68 2kdg s LEU 308 CO 0.25 -0.11 -0.23 -0.63 -1.89 0.00 0.00 176.35 173.73 2kdg s ILE 309 N 1.65 2.40 -0.22 6.68 1.01 -0.67 -0.67 121.20 131.38 2kdg s ILE 309 Ca 0.04 -2.00 -0.01 0.00 0.00 0.00 0.00 60.65 58.68 2kdg s ILE 309 Cb -0.13 -2.15 0.07 0.00 0.01 0.00 0.00 42.46 40.26 2kdg s ILE 309 CO -0.09 -0.11 0.02 -0.36 0.00 0.00 0.00 174.94 174.40 2kdg s PHE 310 N -1.65 1.53 0.13 3.97 0.40 0.03 -3.72 117.98 118.67 2kdg s PHE 310 Ca 0.21 -1.24 -0.14 0.00 -0.60 0.00 0.00 56.93 55.15 2kdg s PHE 310 Cb -0.08 -1.29 -0.02 0.00 0.51 0.00 0.00 43.02 42.15 2kdg s PHE 310 CO 0.10 -0.69 1.57 0.93 0.70 0.00 0.00 175.22 177.82 2kdg h GLU 311 N 8.14 0.73 -1.65 0.44 4.39 -1.38 -0.42 114.58 124.84 2kdg h GLU 311 Ca -0.16 -0.24 -0.28 0.00 0.34 0.00 0.00 59.36 59.02 2kdg h GLU 311 Cb 1.09 -0.06 -0.27 0.00 -0.10 0.00 0.00 28.75 29.41 2kdg h GLU 311 CO 0.38 0.82 -0.62 0.54 -1.16 0.00 0.00 179.01 178.97 2kdg s VAL 312 N -4.98 -0.52 0.30 3.13 0.11 -1.25 -3.65 120.40 113.53 2kdg s VAL 312 Ca -0.13 -0.79 -0.29 0.00 -2.93 0.00 0.00 61.98 57.84 2kdg s VAL 312 Cb 0.10 -0.46 -0.10 0.00 -1.53 0.00 0.00 36.38 34.39 2kdg s VAL 312 CO 0.80 -0.42 1.22 0.54 -3.33 0.00 0.00 175.10 173.92 2kdg s VAL 313 N 1.44 3.06 0.30 2.04 0.11 -0.88 -4.85 120.40 121.63 2kdg s VAL 313 Ca 0.18 1.05 0.09 0.00 -2.93 0.00 0.00 61.98 60.38 2kdg s VAL 313 Cb -0.11 -3.67 -0.06 0.00 -1.53 0.00 0.00 36.38 31.01 2kdg s VAL 313 CO -0.04 0.24 -0.11 -0.13 -3.33 0.00 0.00 175.10 171.73 2kdg s ARG 314 N -1.50 1.69 0.52 1.54 1.81 -1.26 -0.73 118.95 121.00 2kdg s ARG 314 Ca 0.48 -1.84 0.19 0.00 -1.72 0.00 0.00 55.73 52.83 2kdg s ARG 314 Cb -0.36 -1.54 1.29 0.00 -0.45 0.00 0.00 34.95 33.88 2kdg s ARG 314 CO 0.47 0.16 2.09 0.00 -0.68 0.00 0.00 175.30 177.33 2kdg h ALA 315 N 2.18 2.16 0.00 2.13 0.00 -1.96 -0.77 119.26 122.99 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 0.67 -0.22 0.00 0.66 0.00 0.00 0.00 179.25 180.36 2kdg h SER 316 N 0.04 0.00 0.46 0.00 4.64 -1.97 -2.92 113.55 113.80 2kdg h SER 316 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2kdg h SER 316 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2kdg h SER 316 CO -0.01 0.00 -0.10 0.47 -0.87 0.00 0.00 176.83 176.32 2kdg n ASP 317 N -2.60 0.34 -4.74 4.97 8.00 -0.30 -4.94 116.55 117.28 2kdg n ASP 317 Ca 0.01 -0.39 -0.34 0.00 0.71 0.00 0.00 54.79 54.78 2kdg n ASP 317 Cb 0.21 -0.13 0.07 0.00 -0.02 0.00 0.00 41.12 41.26 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 -2.56 2.28 0.00 2.24 0.00 -1.10 -4.95 121.76 117.66 2kdg s ALA 318 Ca 0.27 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2kdg s ALA 318 Cb 0.20 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.92 2kdg s ALA 318 CO 0.49 -1.59 0.00 0.41 0.00 0.00 0.00 175.76 175.07 2kdg n GLY 319 N -0.01 0.69 3.51 0.00 0.00 -0.59 -4.99 105.19 103.79 2kdg n GLY 319 Ca 0.12 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.40 2.93 0.52 4.61 0.00 -1.26 -1.05 121.76 126.10 2kdg s ALA 320 Ca 0.00 -1.58 -0.19 0.00 0.00 0.00 0.00 51.96 50.20 2kdg s ALA 320 Cb 0.00 -4.06 -0.07 0.00 0.00 0.00 0.00 23.12 18.98 2kdg s ALA 320 CO 0.00 -3.03 1.04 0.71 0.00 0.00 0.00 175.76 174.48 2kdg s TYR 321 N 4.93 3.02 0.06 0.00 1.51 0.22 -1.43 117.35 125.67 2kdg s TYR 321 Ca 0.29 1.55 -0.05 0.00 -1.01 0.00 0.00 57.07 57.86 2kdg s TYR 321 Cb -0.12 -3.03 -0.02 0.00 -0.11 0.00 0.00 41.96 38.68 2kdg s TYR 321 CO 0.13 -0.87 0.08 0.00 -1.11 0.00 0.00 175.55 173.77 2kdg s ALA 322 N -2.15 0.12 0.03 3.71 0.00 -0.40 -1.52 121.76 121.54 2kdg s ALA 322 Ca 0.66 -0.86 0.04 0.00 0.00 0.00 0.00 51.96 51.80 2kdg s ALA 322 Cb -0.16 0.35 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 2kdg s ALA 322 CO 0.25 -0.41 -0.13 0.00 0.00 0.00 0.00 175.76 175.47 2kdg s VAL 324 N -0.73 1.38 -0.20 0.00 1.01 -0.39 -1.06 120.40 120.41 2kdg s VAL 324 Ca 0.02 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 2kdg s VAL 324 Cb -0.07 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2kdg s VAL 324 CO 0.01 0.21 0.03 0.00 0.00 0.00 0.00 175.10 175.35 2kdg s ALA 325 N 1.53 3.19 -0.06 5.51 0.00 -0.32 -1.95 121.76 129.65 2kdg s ALA 325 Ca 0.01 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.08 2kdg s ALA 325 Cb -0.15 -1.85 0.02 0.00 0.00 0.00 0.00 23.12 21.14 2kdg s ALA 325 CO -0.08 -0.03 -0.06 0.15 0.00 0.00 0.00 175.76 175.73 2kdg s LYS 326 N 0.78 1.11 0.36 0.00 1.02 -0.01 -0.91 119.74 122.10 2kdg s LYS 326 Ca 0.02 -0.18 0.05 0.00 0.02 0.00 0.00 55.97 55.88 2kdg s LYS 326 Cb -0.14 -1.09 -0.03 0.00 -0.52 0.00 0.00 37.83 36.06 2kdg s LYS 326 CO 0.02 -0.10 0.18 0.54 -0.92 0.00 0.00 175.35 175.08 2kdg s ASN 327 N 1.05 2.19 0.07 2.83 2.20 -0.33 -0.57 114.94 122.38 2kdg s ASN 327 Ca -0.08 -1.68 0.08 0.00 -0.94 0.00 0.00 52.86 50.23 2kdg s ASN 327 Cb -0.14 0.51 0.38 0.00 -2.00 0.00 0.00 41.25 40.00 2kdg s ASN 327 CO -0.00 -0.97 1.25 -2.11 -2.94 0.00 0.00 177.10 172.32 2kdg n ARG 328 N -0.76 0.04 -0.00 3.55 1.85 -1.26 -2.37 116.66 117.71 2kdg n ARG 328 Ca -0.00 0.47 0.07 0.00 -1.00 0.00 0.00 57.85 57.39 2kdg n ARG 328 Cb 0.64 -1.60 -0.10 0.00 -1.05 0.00 0.00 32.46 30.35 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 -1.57 3.16 0.00 2.89 0.00 -1.26 -5.09 120.51 118.64 2kdg n ALA 329 Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2kdg n ALA 329 Cb 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 1.51 -1.42 3.10 0.00 0.00 -1.00 -4.45 105.19 102.94 2kdg n GLY 330 Ca -0.00 -1.17 -0.15 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.69 0.63 0.11 1.61 2.12 -1.26 -1.18 118.70 119.03 2kdg s GLU 331 Ca 0.00 -0.81 -0.00 0.00 0.36 0.00 0.00 54.97 54.52 2kdg s GLU 331 Cb 0.00 -0.49 -0.04 0.00 0.26 0.00 0.00 34.13 33.86 2kdg s GLU 331 CO 0.00 0.10 0.00 0.00 -0.54 0.00 0.00 175.26 174.82 2kdg s ALA 332 N -1.29 0.86 -0.01 6.30 0.00 -0.09 -4.82 121.76 122.72 2kdg s ALA 332 Ca -0.07 -1.40 -0.00 0.00 0.00 0.00 0.00 51.96 50.49 2kdg s ALA 332 Cb -0.10 0.52 0.01 0.00 0.00 0.00 0.00 23.12 23.55 2kdg s ALA 332 CO 0.01 -0.38 0.02 0.99 0.00 0.00 0.00 175.76 176.40 2kdg s THR 333 N -3.87 -0.02 0.11 0.00 2.01 -1.26 -1.18 115.64 111.43 2kdg s THR 333 Ca 0.17 0.09 0.06 0.00 0.31 0.00 0.00 61.69 62.31 2kdg s THR 333 Cb 0.07 -0.05 -0.04 0.00 0.01 0.00 0.00 72.50 72.49 2kdg s THR 333 CO -0.02 0.04 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.44 2kdg s PHE 334 N 0.44 1.36 -0.03 4.92 0.08 -0.23 -5.00 117.98 119.53 2kdg s PHE 334 Ca -0.04 -0.55 -0.07 0.00 0.12 0.00 0.00 56.93 56.40 2kdg s PHE 334 Cb -0.05 -0.72 0.01 0.00 -0.57 0.00 0.00 43.02 41.69 2kdg s PHE 334 CO -0.01 0.12 0.16 0.99 -0.10 0.00 0.00 175.22 176.38 2kdg s THR 335 N -2.04 0.05 -0.02 0.64 2.01 -1.26 -0.77 115.64 114.25 2kdg s THR 335 Ca 0.07 -0.39 -0.19 0.00 0.31 0.00 0.00 61.69 61.50 2kdg s THR 335 Cb -0.05 -0.36 0.03 0.00 0.01 0.00 0.00 72.50 72.13 2kdg s THR 335 CO 0.03 -0.21 0.40 0.54 -0.69 0.00 0.00 174.62 174.69 2kdg s VAL 336 N -0.74 0.04 -0.12 3.82 0.11 -0.58 -4.83 120.40 118.11 2kdg s VAL 336 Ca -0.08 -0.37 -0.07 0.00 -2.93 0.00 0.00 61.98 58.53 2kdg s VAL 336 Cb -0.05 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 2kdg s VAL 336 CO 0.01 -0.20 0.12 -1.58 -3.33 0.00 0.00 175.10 170.12 2kdg s GLN 337 N -1.41 3.44 -0.30 1.54 0.74 -1.26 -0.61 119.66 121.80 2kdg s GLN 337 Ca -0.12 -0.17 0.02 0.00 0.05 0.00 0.00 55.36 55.14 2kdg s GLN 337 Cb -0.04 -3.16 0.08 0.00 1.10 0.00 0.00 33.01 31.00 2kdg s GLN 337 CO 0.05 0.73 0.01 -1.17 -0.55 0.00 0.00 175.29 174.36 2kdg s LEU 338 N -0.90 3.64 -1.12 3.68 2.96 -0.21 -0.89 118.68 125.84 2kdg s LEU 338 Ca 0.14 -1.73 -0.15 0.00 -0.22 0.00 0.00 54.13 52.18 2kdg s LEU 338 Cb -0.12 -1.39 0.17 0.00 0.50 0.00 0.00 46.19 45.35 2kdg s LEU 338 CO 0.03 -0.32 1.31 -0.62 -1.32 0.00 0.00 176.35 175.43 2kdg s ASP 339 N 1.16 6.97 -0.20 3.68 2.15 -0.08 -1.54 116.67 128.82 2kdg s ASP 339 Ca 0.04 -2.80 -0.29 0.00 0.43 0.00 0.00 52.55 49.93 2kdg s ASP 339 Cb -0.19 -2.38 -0.05 0.00 -0.30 0.00 0.00 42.92 40.01 2kdg s ASP 339 CO -0.10 -0.78 1.97 -0.69 -0.17 0.00 0.00 175.17 175.39 2kdg s VAL 340 N 1.59 3.25 -0.72 1.11 1.01 -1.26 -3.38 120.40 121.99 2kdg s VAL 340 Ca 0.39 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.37 2kdg s VAL 340 Cb -0.04 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 33.06 2kdg s VAL 340 CO -0.03 -0.14 1.56 -0.76 0.00 0.00 0.00 175.10 175.73 2kdg s LEU 341 N 6.70 3.24 0.63 3.92 1.43 0.08 -4.86 118.68 129.82 2kdg s LEU 341 Ca 0.88 -0.24 -0.19 0.00 -1.03 0.00 0.00 54.13 53.56 2kdg s LEU 341 Cb -0.31 -2.55 -0.02 0.00 0.03 0.00 0.00 46.19 43.34 2kdg s LEU 341 CO 0.35 -2.08 1.29 0.00 0.23 0.00 0.00 176.35 176.13 2kdg s ALA 342 N 7.27 2.46 -1.78 4.21 0.00 -1.26 -1.26 121.76 131.40 2kdg s ALA 342 Ca 0.51 1.20 0.31 0.00 0.00 0.00 0.00 51.96 53.98 2kdg s ALA 342 Cb -0.09 -3.54 1.67 0.00 0.00 0.00 0.00 23.12 21.16 2kdg s ALA 342 CO 0.14 -1.50 2.11 0.36 0.00 0.00 0.00 175.76 176.87 2kdg n LYS 343 N -1.74 0.79 0.00 0.00 2.85 -1.26 -4.86 118.16 113.94 2kdg n LYS 343 Ca 0.15 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.35 2kdg n LYS 343 Cb 0.48 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.36 2kdg n LYS 343 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74