#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 1.51 0.29 4.61 0.00 -1.26 -5.10 121.76 121.81 2kdg s ALA -3 Ca 0.00 0.23 -0.04 0.00 0.00 0.00 0.00 51.96 52.15 2kdg s ALA -3 Cb 0.00 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.81 2kdg s ALA -3 CO 0.00 -2.47 0.39 0.00 0.00 0.00 0.00 175.76 173.67 2kdg s MET -2 N -4.79 1.66 -0.05 0.00 0.23 -1.26 -5.05 119.30 110.04 2kdg s MET -2 Ca 0.64 -1.62 -0.30 0.00 -1.03 0.00 0.00 55.69 53.38 2kdg s MET -2 Cb -0.20 0.40 0.11 0.00 -1.53 0.00 0.00 34.83 33.62 2kdg s MET -2 CO 0.58 -0.66 1.34 0.20 -2.03 0.00 0.00 175.02 174.45 2kdg s GLY -1 N -3.18 -0.27 0.75 3.16 0.00 -0.20 -5.01 107.32 102.56 2kdg s GLY -1 Ca 0.31 0.36 -0.13 0.00 0.00 0.00 0.00 44.72 45.27 2kdg s GLY -1 CO 0.16 3.96 1.13 2.56 0.00 0.00 0.00 173.10 180.91 2kdg s PRO 249 N -2.08 2.24 0.78 2.90 0.04 -1.26 -2.72 135.00 134.90 2kdg s PRO 249 Ca 0.25 1.41 -0.10 0.00 0.04 0.00 0.00 61.00 62.59 2kdg s PRO 249 Cb 0.02 -1.88 0.06 0.00 0.04 0.00 0.00 34.50 32.75 2kdg s PRO 249 CO -0.03 -1.69 1.10 -1.25 0.04 0.00 0.00 177.00 175.16 2kdg s PRO 250 N -4.40 2.15 0.40 0.56 0.04 -1.26 -4.60 135.00 127.88 2kdg s PRO 250 Ca 0.66 1.20 0.08 0.00 0.04 0.00 0.00 61.00 62.98 2kdg s PRO 250 Cb -0.21 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 2kdg s PRO 250 CO 0.49 -1.73 0.20 1.03 0.04 0.00 0.00 177.00 177.04 2kdg s ARG 251 N -4.88 2.30 -0.51 4.56 3.00 -0.52 -4.63 118.95 118.26 2kdg s ARG 251 Ca 0.62 -1.74 -0.07 0.00 0.00 0.00 0.00 55.73 54.54 2kdg s ARG 251 Cb -0.18 -2.08 0.13 0.00 0.00 0.00 0.00 34.95 32.83 2kdg s ARG 251 CO 0.56 -0.09 0.36 -0.06 0.00 0.00 0.00 175.30 176.08 2kdg s PHE 252 N -2.55 3.49 0.43 -0.53 0.40 -1.26 -4.61 117.98 113.35 2kdg s PHE 252 Ca 0.42 -2.16 0.07 0.00 -0.60 0.00 0.00 56.93 54.66 2kdg s PHE 252 Cb 0.02 -3.41 -0.05 0.00 0.51 0.00 0.00 43.02 40.09 2kdg s PHE 252 CO 0.23 -0.96 0.15 0.42 0.70 0.00 0.00 175.22 175.76 2kdg s ILE 253 N 0.97 2.09 -0.29 0.64 1.09 -1.26 -5.07 121.20 119.36 2kdg s ILE 253 Ca 0.09 -1.77 -0.42 0.00 -1.10 0.00 0.00 60.65 57.45 2kdg s ILE 253 Cb -0.23 -2.86 -0.18 0.00 -1.06 0.00 0.00 42.46 38.13 2kdg s ILE 253 CO -0.03 0.00 1.58 1.67 -0.10 0.00 0.00 174.94 178.07 2kdg n GLN 254 N -1.23 0.62 -4.16 2.79 0.00 -1.26 -4.77 117.38 109.38 2kdg n GLN 254 Ca -0.04 0.23 -0.23 0.00 -0.00 0.00 0.00 57.00 56.96 2kdg n GLN 254 Cb 0.65 -1.82 -0.05 0.00 0.00 0.00 0.00 30.24 29.02 2kdg n GLN 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2kdg s VAL 255 N 2.68 4.19 0.69 1.69 -7.23 -1.26 -2.99 120.40 118.18 2kdg s VAL 255 Ca 0.99 -1.47 -0.12 0.00 -1.81 0.00 0.00 61.98 59.57 2kdg s VAL 255 Cb -1.23 -3.23 0.01 0.00 0.56 0.00 0.00 36.38 32.49 2kdg s VAL 255 CO 0.69 -0.30 1.07 -2.16 -0.31 0.00 0.00 175.10 174.08 2kdg s PRO 256 N -3.63 2.85 1.04 4.82 0.04 -1.26 -5.08 135.00 133.77 2kdg s PRO 256 Ca 0.32 1.05 -0.14 0.00 0.04 0.00 0.00 61.00 62.27 2kdg s PRO 256 Cb -0.08 -1.98 0.21 0.00 0.04 0.00 0.00 34.50 32.69 2kdg s PRO 256 CO 0.23 -1.17 1.12 -1.21 0.04 0.00 0.00 177.00 176.01 2kdg s GLU 257 N -4.83 0.09 0.69 4.56 2.02 -1.26 -4.83 118.70 115.13 2kdg s GLU 257 Ca 0.60 0.25 -0.17 0.00 0.02 0.00 0.00 54.97 55.67 2kdg s GLU 257 Cb -0.15 -1.72 0.01 0.00 0.10 0.00 0.00 34.13 32.36 2kdg s GLU 257 CO 0.52 -2.90 1.20 0.27 0.02 0.00 0.00 175.26 174.37 2kdg n ASN 258 N -4.25 1.52 -4.18 -0.19 0.23 -1.26 -4.75 115.26 102.38 2kdg n ASN 258 Ca 0.08 0.75 -0.13 0.00 -0.53 0.00 0.00 54.58 54.76 2kdg n ASN 258 Cb 0.58 -1.51 -0.10 0.00 -2.08 0.00 0.00 39.78 36.67 2kdg n ASN 258 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 2kdg s MET 259 N -3.46 0.87 -0.04 -3.83 -1.94 -0.31 -4.99 119.30 105.59 2kdg s MET 259 Ca 0.79 -1.28 -0.02 0.00 -1.71 0.00 0.00 55.69 53.47 2kdg s MET 259 Cb -0.36 -0.39 0.03 0.00 2.01 0.00 0.00 34.83 36.12 2kdg s MET 259 CO 0.44 0.03 0.09 -1.54 -0.01 0.00 0.00 175.02 174.03 2kdg s SER 260 N -2.83 -0.03 -0.02 3.03 1.04 -1.26 -0.94 113.70 112.68 2kdg s SER 260 Ca 0.10 0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.71 2kdg s SER 260 Cb 0.02 0.07 0.01 0.00 0.10 0.00 0.00 66.02 66.22 2kdg s SER 260 CO -0.02 -0.13 -0.03 -0.63 0.98 0.00 0.00 173.24 173.42 2kdg s ILE 261 N 0.99 0.32 0.18 -1.02 -1.09 -1.20 -4.97 121.20 114.42 2kdg s ILE 261 Ca -0.08 -0.07 -0.31 0.00 -2.23 0.00 0.00 60.65 57.96 2kdg s ILE 261 Cb -0.11 -0.34 -0.10 0.00 -1.58 0.00 0.00 42.46 40.33 2kdg s ILE 261 CO -0.04 0.14 1.51 -0.62 -1.23 0.00 0.00 174.94 174.71 2kdg s ASP 262 N 0.55 6.63 -0.08 3.58 2.15 -1.26 -0.77 116.67 127.47 2kdg s ASP 262 Ca -0.06 2.60 -0.37 0.00 0.43 0.00 0.00 52.55 55.15 2kdg s ASP 262 Cb -0.09 -2.60 -0.14 0.00 -0.30 0.00 0.00 42.92 39.79 2kdg s ASP 262 CO -0.01 -0.77 1.69 1.21 -0.17 0.00 0.00 175.17 177.12 2kdg n GLU 263 N 3.53 1.66 0.00 4.34 2.13 -0.31 -2.44 120.64 129.56 2kdg n GLU 263 Ca 0.12 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.54 2kdg n GLU 263 Cb 0.39 -2.35 0.00 0.00 0.27 0.00 0.00 31.44 29.75 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 3.85 0.34 3.79 8.31 0.00 0.05 -4.85 105.19 116.68 2kdg n GLY 264 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.85 2.50 0.49 1.61 0.52 -1.02 -4.53 118.95 117.66 2kdg s ARG 265 Ca 0.00 0.98 -0.21 0.00 -0.52 0.00 0.00 55.73 55.98 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 -1.42 1.09 0.12 0.02 0.00 0.00 175.30 175.11 2kdg s PHE 266 N -3.01 2.89 0.06 -0.53 2.19 -1.24 -1.99 117.98 116.36 2kdg s PHE 266 Ca 0.60 1.57 -0.13 0.00 0.33 0.00 0.00 56.93 59.30 2kdg s PHE 266 Cb -0.15 -3.20 0.02 0.00 -1.31 0.00 0.00 43.02 38.37 2kdg s PHE 266 CO 0.55 -1.18 0.28 0.00 1.83 0.00 0.00 175.22 176.71 2kdg s ARG 268 N -2.85 1.00 -0.05 0.00 1.70 -1.26 -0.58 118.95 116.91 2kdg s ARG 268 Ca -0.03 -1.12 -0.01 0.00 -0.47 0.00 0.00 55.73 54.10 2kdg s ARG 268 Cb 0.00 0.35 0.03 0.00 -0.57 0.00 0.00 34.95 34.76 2kdg s ARG 268 CO -0.05 -0.34 0.02 -1.64 -1.08 0.00 0.00 175.30 172.21 2kdg s MET 269 N -3.93 0.31 -0.28 3.89 -1.94 -0.07 -5.00 119.30 112.27 2kdg s MET 269 Ca 0.13 0.20 -0.28 0.00 -1.71 0.00 0.00 55.69 54.03 2kdg s MET 269 Cb 0.04 -0.72 0.01 0.00 2.01 0.00 0.00 34.83 36.18 2kdg s MET 269 CO -0.04 -0.28 1.03 -0.51 -0.01 0.00 0.00 175.02 175.21 2kdg s ASP 270 N 1.88 6.97 -0.27 3.03 1.01 -1.26 -2.68 116.67 125.34 2kdg s ASP 270 Ca 0.02 1.14 0.00 0.00 0.71 0.00 0.00 52.55 54.42 2kdg s ASP 270 Cb -0.12 -2.53 0.08 0.00 1.01 0.00 0.00 42.92 41.36 2kdg s ASP 270 CO -0.04 -0.77 0.02 -0.36 0.21 0.00 0.00 175.17 174.23 2kdg s PHE 271 N 3.40 2.18 0.18 4.23 0.40 -0.69 -4.19 117.98 123.49 2kdg s PHE 271 Ca 0.43 -1.80 -0.31 0.00 -0.60 0.00 0.00 56.93 54.66 2kdg s PHE 271 Cb -0.13 -1.73 -0.10 0.00 0.51 0.00 0.00 43.02 41.57 2kdg s PHE 271 CO 0.11 -0.81 1.48 0.15 0.70 0.00 0.00 175.22 176.86 2kdg s LYS 272 N 1.46 4.26 -0.02 0.44 1.02 -1.16 -0.68 119.74 125.07 2kdg s LYS 272 Ca 0.02 2.27 0.00 0.00 0.02 0.00 0.00 55.97 58.29 2kdg s LYS 272 Cb -0.18 -3.16 0.02 0.00 -0.52 0.00 0.00 37.83 33.99 2kdg s LYS 272 CO -0.13 -0.50 -0.00 0.54 -0.92 0.00 0.00 175.35 174.34 2kdg s VAL 273 N 0.74 0.13 0.06 3.17 0.11 -0.28 -4.45 120.40 119.88 2kdg s VAL 273 Ca 0.65 0.05 -0.09 0.00 -2.93 0.00 0.00 61.98 59.66 2kdg s VAL 273 Cb -0.41 -0.19 0.00 0.00 -1.53 0.00 0.00 36.38 34.24 2kdg s VAL 273 CO 0.35 0.10 0.19 -0.55 -3.33 0.00 0.00 175.10 171.87 2kdg s SER 274 N 0.68 0.07 0.00 3.54 0.15 -1.26 -4.54 113.70 112.34 2kdg s SER 274 Ca -0.06 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.09 2kdg s SER 274 Cb -0.09 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 2kdg s SER 274 CO -0.01 -0.64 0.00 0.61 1.20 0.00 0.00 173.24 174.40 2kdg n GLY 275 N 0.35 3.21 3.03 9.45 0.00 -1.26 -1.44 105.19 118.52 2kdg n GLY 275 Ca -0.17 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 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 0.07 1.03 0.99 2.96 -1.10 -4.27 118.68 118.36 2kdg s LEU 276 Ca 0.00 0.56 -0.12 0.00 -0.22 0.00 0.00 54.13 54.35 2kdg s LEU 276 Cb 0.00 0.72 0.20 0.00 0.50 0.00 0.00 46.19 47.61 2kdg s LEU 276 CO 0.00 -0.20 1.07 -2.16 -1.32 0.00 0.00 176.35 173.74 2kdg s PRO 277 N 1.80 0.20 -0.03 0.98 0.04 -1.26 -1.04 135.00 135.69 2kdg s PRO 277 Ca -0.04 0.75 -0.33 0.00 0.04 0.00 0.00 61.00 61.41 2kdg s PRO 277 Cb -0.11 -1.69 -0.11 0.00 0.04 0.00 0.00 34.50 32.62 2kdg s PRO 277 CO -0.09 -2.95 1.86 0.00 0.04 0.00 0.00 177.00 175.87 2kdg n ALA 278 N -4.36 1.12 -1.61 8.56 0.00 -1.26 -4.83 120.51 118.13 2kdg n ALA 278 Ca 0.05 0.29 -0.34 0.00 0.00 0.00 0.00 53.44 53.45 2kdg n ALA 278 Cb 0.55 -2.52 0.03 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 3.72 3.04 0.32 0.00 0.04 -1.26 -4.91 135.00 135.95 2kdg s PRO 279 Ca 0.90 1.42 -0.28 0.00 0.04 0.00 0.00 61.00 63.08 2kdg s PRO 279 Cb -0.64 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 31.83 2kdg s PRO 279 CO 0.48 -1.06 1.08 0.34 0.04 0.00 0.00 177.00 177.88 2kdg s ASP 280 N -2.39 7.10 -0.05 6.66 2.15 -0.03 -4.82 116.67 125.30 2kdg s ASP 280 Ca 0.68 2.20 0.02 0.00 0.43 0.00 0.00 52.55 55.88 2kdg s ASP 280 Cb -0.21 -2.61 0.01 0.00 -0.30 0.00 0.00 42.92 39.81 2kdg s ASP 280 CO 0.37 -0.26 -0.10 -0.69 -0.17 0.00 0.00 175.17 174.32 2kdg s VAL 281 N -1.31 0.90 0.12 1.11 1.01 -1.26 -1.12 120.40 119.85 2kdg s VAL 281 Ca 0.49 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.14 2kdg s VAL 281 Cb -0.29 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 2kdg s VAL 281 CO 0.37 0.30 -0.11 -0.44 0.00 0.00 0.00 175.10 175.22 2kdg s SER 282 N 0.57 1.69 0.18 3.32 0.01 -0.60 -5.01 113.70 113.86 2kdg s SER 282 Ca -0.10 -0.88 0.09 0.00 1.31 0.00 0.00 55.95 56.37 2kdg s SER 282 Cb -0.13 -0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.04 2kdg s SER 282 CO 0.02 -0.26 -0.20 0.26 0.41 0.00 0.00 173.24 173.48 2kdg s TRP 283 N -2.66 1.96 0.09 2.43 0.52 -1.26 -1.20 118.94 118.82 2kdg s TRP 283 Ca 0.10 -0.44 -0.06 0.00 0.02 0.00 0.00 56.10 55.72 2kdg s TRP 283 Cb -0.02 -0.96 -0.01 0.00 -1.15 0.00 0.00 33.47 31.33 2kdg s TRP 283 CO 0.01 0.40 0.14 0.71 0.02 0.00 0.00 176.95 178.22 2kdg s TYR 284 N -2.02 0.30 -0.13 -1.98 1.51 0.19 -0.95 117.35 114.26 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 -0.06 -0.16 0.07 0.00 -0.11 0.00 0.00 41.96 41.70 2kdg s TYR 284 CO 0.08 -0.52 0.23 -1.17 -1.11 0.00 0.00 175.55 173.06 2kdg s LEU 285 N -2.89 -0.21 -1.02 -1.29 2.96 0.06 -1.28 118.68 114.99 2kdg s LEU 285 Ca 0.07 0.37 0.00 0.00 -0.22 0.00 0.00 54.13 54.35 2kdg s LEU 285 Cb 0.06 0.53 0.00 0.00 0.50 0.00 0.00 46.19 47.28 2kdg s LEU 285 CO -0.09 -0.26 0.00 0.59 -1.32 0.00 0.00 176.35 175.27 2kdg n ASN 286 N 5.34 -4.20 0.00 3.68 3.02 -0.29 -1.46 115.26 121.35 2kdg n ASN 286 Ca -0.05 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 2kdg n ASN 286 Cb 0.50 -3.34 0.00 0.00 -0.61 0.00 0.00 39.78 36.32 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 0.10 1.15 3.89 7.41 0.00 -1.26 -5.08 105.19 111.40 2kdg n GLY 287 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.70 3.65 0.67 1.61 0.52 -0.53 -5.09 118.95 119.08 2kdg s ARG 288 Ca 0.00 0.44 -0.13 0.00 -0.52 0.00 0.00 55.73 55.52 2kdg s ARG 288 Cb 0.00 -2.30 0.00 0.00 0.52 0.00 0.00 34.95 33.17 2kdg s ARG 288 CO 0.00 -0.24 1.08 0.95 0.02 0.00 0.00 175.30 177.11 2kdg s THR 289 N -2.72 3.58 -0.37 0.02 -4.23 -1.26 -0.76 115.64 109.90 2kdg s THR 289 Ca 0.51 0.64 0.00 0.00 -1.18 0.00 0.00 61.69 61.66 2kdg s THR 289 Cb -0.10 -3.20 0.12 0.00 1.34 0.00 0.00 72.50 70.66 2kdg s THR 289 CO 0.42 -0.55 0.19 -0.69 -0.54 0.00 0.00 174.62 173.44 2kdg s VAL 290 N -2.65 0.81 0.68 2.29 1.01 -0.13 -4.63 120.40 117.79 2kdg s VAL 290 Ca 0.63 -1.89 -0.15 0.00 0.00 0.00 0.00 61.98 60.57 2kdg s VAL 290 Cb -0.17 -1.59 0.01 0.00 0.00 0.00 0.00 36.38 34.63 2kdg s VAL 290 CO 0.46 -0.85 1.12 -1.10 0.00 0.00 0.00 175.10 174.74 2kdg s GLN 291 N 1.01 2.66 0.66 2.72 -0.21 -1.26 -4.19 119.66 121.04 2kdg s GLN 291 Ca 0.15 1.44 -0.14 0.00 0.02 0.00 0.00 55.36 56.83 2kdg s GLN 291 Cb -0.22 -1.93 -0.00 0.00 1.00 0.00 0.00 33.01 31.87 2kdg s GLN 291 CO -0.09 -1.37 1.09 -1.54 -2.12 0.00 0.00 175.29 171.26 2kdg s SER 292 N -2.52 5.20 0.26 5.90 1.04 -1.26 -4.97 113.70 117.35 2kdg s SER 292 Ca 0.68 1.91 -0.16 0.00 0.48 0.00 0.00 55.95 58.86 2kdg s SER 292 Cb -0.22 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.37 2kdg s SER 292 CO 0.43 -1.57 0.58 -0.62 0.98 0.00 0.00 173.24 173.03 2kdg s ASP 293 N -2.82 -0.15 0.41 7.02 2.15 -0.07 -4.97 116.67 118.25 2kdg s ASP 293 Ca 0.65 -0.81 0.12 0.00 0.43 0.00 0.00 52.55 52.94 2kdg s ASP 293 Cb -0.19 0.65 0.97 0.00 -0.30 0.00 0.00 42.92 44.05 2kdg s ASP 293 CO 0.43 -1.23 1.95 -0.78 -0.17 0.00 0.00 175.17 175.38 2kdg h ASP 294 N 2.15 0.45 0.92 -0.34 3.58 -2.03 -2.20 116.42 118.95 2kdg h ASP 294 Ca -0.23 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.23 2kdg h ASP 294 Cb 1.25 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 42.22 2kdg h ASP 294 CO 0.31 0.26 -0.40 0.18 -2.88 0.00 0.00 179.24 176.70 2kdg n LEU 295 N -4.48 0.59 -3.51 2.28 4.77 -1.26 -4.73 117.00 110.66 2kdg n LEU 295 Ca 0.11 0.28 -0.29 0.00 -0.03 0.00 0.00 56.01 56.09 2kdg n LEU 295 Cb 0.39 -0.26 -0.13 0.00 -2.33 0.00 0.00 43.42 41.09 2kdg n LEU 295 CO 0.33 -0.03 -0.31 -1.00 -1.33 0.00 0.00 177.39 175.04 2kdg s HIS 296 N -3.10 0.82 0.05 -1.77 3.76 -0.83 -1.09 115.29 113.14 2kdg s HIS 296 Ca 0.09 -1.60 -0.08 0.00 -0.15 0.00 0.00 55.06 53.32 2kdg s HIS 296 Cb 0.15 -1.04 -0.05 0.00 1.11 0.00 0.00 32.58 32.74 2kdg s HIS 296 CO 0.67 -0.83 0.34 0.15 -0.85 0.00 0.00 174.74 174.23 2kdg s LYS 297 N 1.17 3.68 -0.24 1.40 1.02 -1.20 -0.89 119.74 124.68 2kdg s LYS 297 Ca 0.16 0.06 -0.04 0.00 0.02 0.00 0.00 55.97 56.17 2kdg s LYS 297 Cb -0.22 -3.03 0.08 0.00 -0.52 0.00 0.00 37.83 34.15 2kdg s LYS 297 CO -0.06 0.60 0.11 -1.64 -0.92 0.00 0.00 175.35 173.44 2kdg s MET 298 N -1.87 0.16 0.14 1.68 -1.94 -1.26 -1.50 119.30 114.72 2kdg s MET 298 Ca 0.31 -0.37 0.02 0.00 -1.71 0.00 0.00 55.69 53.94 2kdg s MET 298 Cb -0.14 -1.45 -0.04 0.00 2.01 0.00 0.00 34.83 35.21 2kdg s MET 298 CO 0.18 -0.88 -0.02 0.96 -0.01 0.00 0.00 175.02 175.25 2kdg s ILE 299 N 2.10 0.64 -0.05 2.53 -0.00 -1.20 -5.01 121.20 120.21 2kdg s ILE 299 Ca 0.06 -1.96 0.04 0.00 -0.00 0.00 0.00 60.65 58.79 2kdg s ILE 299 Cb -0.16 -1.96 0.00 0.00 -0.00 0.00 0.00 42.46 40.34 2kdg s ILE 299 CO -0.26 -0.62 -0.17 -0.69 -0.00 0.00 0.00 174.94 173.21 2kdg s VAL 300 N -3.68 1.41 1.10 8.37 1.01 -1.26 -0.79 120.40 126.57 2kdg s VAL 300 Ca 0.20 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 2kdg s VAL 300 Cb 0.06 -1.23 0.24 0.00 0.00 0.00 0.00 36.38 35.45 2kdg s VAL 300 CO 0.01 0.41 1.06 -0.94 0.00 0.00 0.00 175.10 175.64 2kdg s SER 301 N 0.20 1.66 0.00 3.32 1.04 -0.59 -4.92 113.70 114.41 2kdg s SER 301 Ca -0.08 1.24 0.14 0.00 0.48 0.00 0.00 55.95 57.74 2kdg s SER 301 Cb -0.13 -1.94 0.72 0.00 0.10 0.00 0.00 66.02 64.78 2kdg s SER 301 CO 0.03 -3.74 1.34 -1.84 0.98 0.00 0.00 173.24 170.01 2kdg n GLU 302 N -4.58 0.25 0.00 4.02 0.00 -1.26 -3.27 120.64 115.80 2kdg n GLU 302 Ca 0.05 0.12 0.06 0.00 0.00 0.00 0.00 57.16 57.39 2kdg n GLU 302 Cb 0.56 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.52 2kdg n GLU 302 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2kdg n LYS 303 N -1.22 1.68 -1.53 3.44 4.76 -1.26 -5.02 118.16 119.00 2kdg n LYS 303 Ca 0.07 -0.82 0.00 0.00 -2.87 0.00 0.00 58.31 54.70 2kdg n LYS 303 Cb 0.10 -1.18 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 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 0.93 0.94 2.95 0.72 0.00 -1.20 -4.99 105.19 104.53 2kdg n GLY 304 Ca 0.06 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.67 3.09 0.35 0.99 2.96 -1.26 -1.12 118.68 123.02 2kdg s LEU 305 Ca 0.00 -1.46 -0.27 0.00 -0.22 0.00 0.00 54.13 52.19 2kdg s LEU 305 Cb 0.00 -1.28 -0.09 0.00 0.50 0.00 0.00 46.19 45.32 2kdg s LEU 305 CO 0.00 -0.28 1.12 -2.28 -1.32 0.00 0.00 176.35 173.59 2kdg s HIS 306 N 1.28 3.30 -0.38 5.38 5.65 0.15 -1.54 115.29 129.13 2kdg s HIS 306 Ca -0.01 1.62 0.03 0.00 0.25 0.00 0.00 55.06 56.95 2kdg s HIS 306 Cb -0.19 -3.31 0.11 0.00 -1.18 0.00 0.00 32.58 28.01 2kdg s HIS 306 CO -0.09 -0.91 0.12 -1.12 -0.65 0.00 0.00 174.74 172.09 2kdg s SER 307 N -1.10 4.41 -0.17 9.88 0.01 0.03 -1.71 113.70 125.05 2kdg s SER 307 Ca 0.52 -2.26 -0.26 0.00 1.31 0.00 0.00 55.95 55.26 2kdg s SER 307 Cb -0.30 -1.41 -0.01 0.00 0.21 0.00 0.00 66.02 64.52 2kdg s SER 307 CO 0.38 -0.35 0.89 -0.22 0.41 0.00 0.00 173.24 174.35 2kdg s LEU 308 N 0.77 4.17 0.09 2.44 1.98 -1.09 -3.21 118.68 123.83 2kdg s LEU 308 Ca 0.13 1.25 0.08 0.00 -2.89 0.00 0.00 54.13 52.70 2kdg s LEU 308 Cb -0.21 -3.33 -0.03 0.00 0.66 0.00 0.00 46.19 43.28 2kdg s LEU 308 CO -0.09 -0.46 -0.21 -0.63 -1.89 0.00 0.00 176.35 173.07 2kdg s ILE 309 N 2.35 1.71 -0.19 6.68 1.01 -0.56 -0.89 121.20 131.31 2kdg s ILE 309 Ca 0.41 -1.50 0.00 0.00 0.00 0.00 0.00 60.65 59.56 2kdg s ILE 309 Cb -0.16 -1.55 0.05 0.00 0.01 0.00 0.00 42.46 40.80 2kdg s ILE 309 CO 0.12 -0.02 -0.07 -0.36 0.00 0.00 0.00 174.94 174.61 2kdg s PHE 310 N -1.11 2.04 0.12 3.97 0.40 0.26 -3.20 117.98 120.46 2kdg s PHE 310 Ca 0.07 -1.37 -0.13 0.00 -0.60 0.00 0.00 56.93 54.90 2kdg s PHE 310 Cb -0.10 -1.46 -0.05 0.00 0.51 0.00 0.00 43.02 41.92 2kdg s PHE 310 CO 0.04 -0.69 1.47 0.93 0.70 0.00 0.00 175.22 177.67 2kdg h GLU 311 N 8.05 0.82 -1.66 0.44 4.39 -1.37 -0.95 114.58 124.30 2kdg h GLU 311 Ca -0.24 -0.40 -0.29 0.00 0.34 0.00 0.00 59.36 58.77 2kdg h GLU 311 Cb 1.10 -0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 29.48 2kdg h GLU 311 CO 0.43 1.04 -0.63 0.54 -1.16 0.00 0.00 179.01 179.23 2kdg s VAL 312 N -4.48 -0.51 0.34 3.13 0.11 -1.25 -3.63 120.40 114.10 2kdg s VAL 312 Ca -0.12 -0.82 -0.28 0.00 -2.93 0.00 0.00 61.98 57.83 2kdg s VAL 312 Cb 0.10 -0.47 -0.09 0.00 -1.53 0.00 0.00 36.38 34.38 2kdg s VAL 312 CO 0.85 -0.43 1.19 0.54 -3.33 0.00 0.00 175.10 173.92 2kdg s VAL 313 N 1.42 3.12 0.28 2.04 0.11 -0.84 -4.85 120.40 121.68 2kdg s VAL 313 Ca 0.18 1.06 0.09 0.00 -2.93 0.00 0.00 61.98 60.38 2kdg s VAL 313 Cb -0.11 -3.65 -0.05 0.00 -1.53 0.00 0.00 36.38 31.04 2kdg s VAL 313 CO -0.04 0.20 -0.12 -0.13 -3.33 0.00 0.00 175.10 171.67 2kdg s ARG 314 N -1.87 1.59 0.42 1.54 1.81 -1.26 -0.77 118.95 120.41 2kdg s ARG 314 Ca 0.50 -1.77 0.13 0.00 -1.72 0.00 0.00 55.73 52.87 2kdg s ARG 314 Cb -0.34 -1.42 0.99 0.00 -0.45 0.00 0.00 34.95 33.72 2kdg s ARG 314 CO 0.44 0.17 1.95 0.00 -0.68 0.00 0.00 175.30 177.18 2kdg h ALA 315 N 2.28 2.00 0.00 2.13 0.00 -1.95 -0.80 119.26 122.92 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 1.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2kdg h ALA 315 CO 0.65 -0.16 0.00 0.77 0.00 0.00 0.00 179.25 180.51 2kdg h SER 316 N 0.47 0.00 0.51 0.00 0.02 -1.97 -2.81 113.55 109.77 2kdg h SER 316 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2kdg h SER 316 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2kdg h SER 316 CO -0.10 0.00 -0.11 0.47 -1.14 0.00 0.00 176.83 175.95 2kdg n ASP 317 N -2.72 0.31 -4.75 3.07 8.00 -0.30 -4.93 116.55 115.22 2kdg n ASP 317 Ca -0.01 -0.30 -0.35 0.00 0.71 0.00 0.00 54.79 54.84 2kdg n ASP 317 Cb 0.15 -0.15 0.05 0.00 -0.02 0.00 0.00 41.12 41.15 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 -2.62 2.45 0.00 2.24 0.00 -1.06 -4.95 121.76 117.82 2kdg s ALA 318 Ca 0.25 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.17 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 0.50 -1.33 0.00 0.41 0.00 0.00 0.00 175.76 175.34 2kdg n GLY 319 N 0.42 0.88 3.51 0.00 0.00 -0.50 -5.00 105.19 104.50 2kdg n GLY 319 Ca 0.13 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.15 2.96 0.45 4.61 0.00 -1.26 -1.19 121.76 126.17 2kdg s ALA 320 Ca 0.00 -1.47 -0.22 0.00 0.00 0.00 0.00 51.96 50.27 2kdg s ALA 320 Cb 0.00 -4.02 -0.09 0.00 0.00 0.00 0.00 23.12 19.01 2kdg s ALA 320 CO 0.00 -2.93 1.03 0.71 0.00 0.00 0.00 175.76 174.57 2kdg s TYR 321 N 4.82 3.14 0.04 0.00 1.51 0.04 -1.14 117.35 125.77 2kdg s TYR 321 Ca 0.30 1.61 -0.02 0.00 -1.01 0.00 0.00 57.07 57.96 2kdg s TYR 321 Cb -0.12 -3.05 -0.03 0.00 -0.11 0.00 0.00 41.96 38.66 2kdg s TYR 321 CO 0.15 -0.63 -0.00 0.00 -1.11 0.00 0.00 175.55 173.96 2kdg s ALA 322 N -1.90 0.30 -0.00 3.71 0.00 -0.41 -1.60 121.76 121.86 2kdg s ALA 322 Ca 0.63 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.68 2kdg s ALA 322 Cb -0.17 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 2kdg s ALA 322 CO 0.21 -0.32 -0.10 0.00 0.00 0.00 0.00 175.76 175.55 2kdg s VAL 324 N -0.30 0.92 -0.15 0.00 1.01 -0.34 -0.93 120.40 120.62 2kdg s VAL 324 Ca 0.03 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2kdg s VAL 324 Cb -0.04 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.43 2kdg s VAL 324 CO -0.00 0.33 -0.19 0.00 0.00 0.00 0.00 175.10 175.23 2kdg s ALA 325 N 1.20 2.35 -0.03 5.51 0.00 -0.31 -1.56 121.76 128.91 2kdg s ALA 325 Ca -0.05 -1.08 0.02 0.00 0.00 0.00 0.00 51.96 50.85 2kdg s ALA 325 Cb -0.14 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 21.90 2kdg s ALA 325 CO -0.02 -0.04 -0.07 0.15 0.00 0.00 0.00 175.76 175.78 2kdg s LYS 326 N 0.83 0.94 0.33 0.00 1.02 -0.28 -0.95 119.74 121.63 2kdg s LYS 326 Ca -0.06 -0.23 0.03 0.00 0.02 0.00 0.00 55.97 55.74 2kdg s LYS 326 Cb -0.15 -0.88 -0.01 0.00 -0.52 0.00 0.00 37.83 36.26 2kdg s LYS 326 CO -0.01 0.03 0.12 0.27 -0.92 0.00 0.00 175.35 174.84 2kdg n ASN 327 N 3.60 1.09 0.16 2.83 0.23 -0.53 -0.85 115.26 121.79 2kdg n ASN 327 Ca -0.21 -2.77 0.11 0.00 -0.53 0.00 0.00 54.58 51.18 2kdg n ASN 327 Cb 0.53 0.86 0.58 0.00 -2.08 0.00 0.00 39.78 39.67 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 -0.73 0.14 -0.00 -3.83 1.85 -1.26 -2.84 116.66 109.98 2kdg n ARG 328 Ca -0.04 0.64 0.05 0.00 -1.00 0.00 0.00 57.85 57.49 2kdg n ARG 328 Cb 0.50 -1.97 -0.07 0.00 -1.05 0.00 0.00 32.46 29.86 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 -1.77 2.55 0.00 2.89 0.00 -1.26 -5.09 120.51 117.84 2kdg n ALA 329 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2kdg n ALA 329 Cb 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.16 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 1.79 -1.24 3.05 0.00 0.00 -1.13 -4.50 105.19 103.16 2kdg n GLY 330 Ca -0.01 -0.96 -0.17 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.82 0.66 0.09 1.61 2.12 -1.26 -1.46 118.70 119.65 2kdg s GLU 331 Ca 0.00 -0.54 0.02 0.00 0.36 0.00 0.00 54.97 54.82 2kdg s GLU 331 Cb 0.00 -0.59 -0.04 0.00 0.26 0.00 0.00 34.13 33.76 2kdg s GLU 331 CO 0.00 0.15 -0.08 0.00 -0.54 0.00 0.00 175.26 174.79 2kdg s ALA 332 N -0.70 0.99 0.01 6.30 0.00 -0.12 -4.78 121.76 123.46 2kdg s ALA 332 Ca -0.01 -1.25 0.01 0.00 0.00 0.00 0.00 51.96 50.71 2kdg s ALA 332 Cb -0.06 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 2kdg s ALA 332 CO 0.00 -0.15 -0.04 0.99 0.00 0.00 0.00 175.76 176.56 2kdg s THR 333 N -3.06 0.28 0.05 0.00 2.01 -1.26 -1.17 115.64 112.50 2kdg s THR 333 Ca 0.08 -0.56 0.02 0.00 0.31 0.00 0.00 61.69 61.53 2kdg s THR 333 Cb 0.01 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 2kdg s THR 333 CO -0.03 -0.19 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.29 2kdg s PHE 334 N -0.75 0.67 -0.02 4.92 0.08 -0.10 -4.96 117.98 117.81 2kdg s PHE 334 Ca -0.06 -0.63 -0.08 0.00 0.12 0.00 0.00 56.93 56.28 2kdg s PHE 334 Cb -0.06 -0.40 0.01 0.00 -0.57 0.00 0.00 43.02 42.00 2kdg s PHE 334 CO -0.00 -0.13 0.17 0.99 -0.10 0.00 0.00 175.22 176.15 2kdg s THR 335 N -2.06 0.06 0.13 0.64 2.01 -1.26 -0.83 115.64 114.33 2kdg s THR 335 Ca -0.05 -0.49 -0.14 0.00 0.31 0.00 0.00 61.69 61.32 2kdg s THR 335 Cb -0.05 -0.41 0.02 0.00 0.01 0.00 0.00 72.50 72.07 2kdg s THR 335 CO -0.02 -0.27 0.36 0.54 -0.69 0.00 0.00 174.62 174.54 2kdg s VAL 336 N -0.99 0.08 -0.08 3.82 0.11 -0.62 -4.78 120.40 117.94 2kdg s VAL 336 Ca -0.11 -0.78 0.04 0.00 -2.93 0.00 0.00 61.98 58.20 2kdg s VAL 336 Cb -0.06 -1.29 -0.02 0.00 -1.53 0.00 0.00 36.38 33.48 2kdg s VAL 336 CO 0.02 -0.37 -0.19 -1.58 -3.33 0.00 0.00 175.10 169.65 2kdg s GLN 337 N -3.84 2.77 -0.25 1.54 0.74 -1.26 -0.78 119.66 118.59 2kdg s GLN 337 Ca 0.05 -0.79 0.02 0.00 0.05 0.00 0.00 55.36 54.69 2kdg s GLN 337 Cb 0.02 -2.34 0.06 0.00 1.10 0.00 0.00 33.01 31.85 2kdg s GLN 337 CO -0.10 0.39 -0.11 -1.17 -0.55 0.00 0.00 175.29 173.75 2kdg s LEU 338 N -0.16 3.14 -0.97 3.68 2.96 -0.34 -1.17 118.68 125.82 2kdg s LEU 338 Ca -0.02 -1.27 -0.13 0.00 -0.22 0.00 0.00 54.13 52.49 2kdg s LEU 338 Cb -0.14 -1.47 0.22 0.00 0.50 0.00 0.00 46.19 45.30 2kdg s LEU 338 CO 0.04 -0.18 1.00 -0.62 -1.32 0.00 0.00 176.35 175.27 2kdg s ASP 339 N 1.17 6.96 -0.24 3.68 2.15 -0.12 -1.42 116.67 128.86 2kdg s ASP 339 Ca -0.07 -2.92 -0.29 0.00 0.43 0.00 0.00 52.55 49.71 2kdg s ASP 339 Cb -0.19 -2.26 -0.03 0.00 -0.30 0.00 0.00 42.92 40.14 2kdg s ASP 339 CO -0.06 -0.57 1.79 -0.69 -0.17 0.00 0.00 175.17 175.46 2kdg s VAL 340 N 0.24 3.47 -0.70 1.11 1.01 -1.26 -3.21 120.40 121.05 2kdg s VAL 340 Ca 0.27 0.51 -0.27 0.00 0.00 0.00 0.00 61.98 62.50 2kdg s VAL 340 Cb -0.08 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.77 2kdg s VAL 340 CO -0.08 -0.27 1.51 -0.76 0.00 0.00 0.00 175.10 175.50 2kdg s LEU 341 N 6.13 3.22 0.65 3.92 1.43 0.05 -4.85 118.68 129.23 2kdg s LEU 341 Ca 0.80 -0.19 -0.18 0.00 -1.03 0.00 0.00 54.13 53.53 2kdg s LEU 341 Cb -0.27 -2.55 -0.01 0.00 0.03 0.00 0.00 46.19 43.40 2kdg s LEU 341 CO 0.33 -2.05 1.28 0.00 0.23 0.00 0.00 176.35 176.14 2kdg s ALA 342 N 7.04 2.36 -0.80 4.21 0.00 -1.26 -1.16 121.76 132.15 2kdg s ALA 342 Ca 0.48 1.16 0.25 0.00 0.00 0.00 0.00 51.96 53.85 2kdg s ALA 342 Cb -0.09 -3.54 0.94 0.00 0.00 0.00 0.00 23.12 20.43 2kdg s ALA 342 CO 0.16 -1.59 1.78 0.36 0.00 0.00 0.00 175.76 176.47 2kdg n LYS 343 N -1.96 0.14 0.00 0.00 2.85 -1.26 -4.84 118.16 113.09 2kdg n LYS 343 Ca 0.15 0.19 0.00 0.00 -1.05 0.00 0.00 58.31 57.61 2kdg n LYS 343 Cb 0.48 -1.69 0.00 0.00 -0.65 0.00 0.00 35.03 33.17 2kdg n LYS 343 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74