#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 1.96 0.33 4.61 0.00 -1.26 -5.09 121.76 122.31 2kdg s ALA -3 Ca 0.00 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.36 2kdg s ALA -3 Cb 0.00 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.77 2kdg s ALA -3 CO 0.00 -2.12 0.52 0.00 0.00 0.00 0.00 175.76 174.15 2kdg s MET -2 N -4.67 1.89 -0.03 0.00 0.23 -1.26 -5.05 119.30 110.41 2kdg s MET -2 Ca 0.65 -1.63 -0.31 0.00 -1.03 0.00 0.00 55.69 53.37 2kdg s MET -2 Cb -0.21 0.47 0.13 0.00 -1.53 0.00 0.00 34.83 33.69 2kdg s MET -2 CO 0.55 -0.80 1.32 0.20 -2.03 0.00 0.00 175.02 174.26 2kdg s GLY -1 N -3.18 -0.42 0.74 3.16 0.00 -0.32 -4.98 107.32 102.33 2kdg s GLY -1 Ca 0.27 0.72 -0.12 0.00 0.00 0.00 0.00 44.72 45.59 2kdg s GLY -1 CO 0.17 0.46 1.10 2.56 0.00 0.00 0.00 173.10 177.39 2kdg s PRO 249 N -2.31 2.38 0.40 2.90 0.04 -1.26 -1.49 135.00 135.67 2kdg s PRO 249 Ca 0.15 1.28 -0.26 0.00 0.04 0.00 0.00 61.00 62.21 2kdg s PRO 249 Cb 0.05 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.60 2kdg s PRO 249 CO -0.04 -1.56 1.25 -1.25 0.04 0.00 0.00 177.00 175.44 2kdg s PRO 250 N -4.58 4.00 0.14 0.56 0.04 -1.26 -4.43 135.00 129.46 2kdg s PRO 250 Ca 0.64 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.79 2kdg s PRO 250 Cb -0.19 -2.73 -0.04 0.00 0.04 0.00 0.00 34.50 31.58 2kdg s PRO 250 CO 0.51 -0.43 -0.03 0.50 0.04 0.00 0.00 177.00 177.59 2kdg s ARG 251 N -2.25 2.36 -1.28 4.56 3.52 -0.68 -4.40 118.95 120.78 2kdg s ARG 251 Ca 0.57 -1.04 -0.18 0.00 -0.13 0.00 0.00 55.73 54.95 2kdg s ARG 251 Cb -0.36 -2.38 0.01 0.00 -1.56 0.00 0.00 34.95 30.67 2kdg s ARG 251 CO 0.45 0.48 1.95 1.19 -0.81 0.00 0.00 175.30 178.56 2kdg n PHE 252 N 0.22 3.74 -1.53 5.12 3.01 -1.26 -4.42 117.46 122.33 2kdg n PHE 252 Ca -0.11 -2.59 -0.30 0.00 1.01 0.00 0.00 57.45 55.46 2kdg n PHE 252 Cb 0.54 -2.51 0.21 0.00 -0.01 0.00 0.00 39.48 37.70 2kdg n PHE 252 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2kdg s ILE 253 N 4.87 1.82 -0.32 4.37 -1.09 -1.26 -4.95 121.20 124.63 2kdg s ILE 253 Ca 0.54 0.00 -0.37 0.00 -2.23 0.00 0.00 60.65 58.59 2kdg s ILE 253 Cb 0.08 -2.76 -0.13 0.00 -1.58 0.00 0.00 42.46 38.07 2kdg s ILE 253 CO 0.04 0.00 2.07 1.67 -1.23 0.00 0.00 174.94 177.48 2kdg n GLN 254 N -4.21 1.11 -2.22 2.79 7.27 -1.26 -4.84 117.38 116.01 2kdg n GLN 254 Ca 0.14 0.34 -0.33 0.00 0.07 0.00 0.00 57.00 57.22 2kdg n GLN 254 Cb 0.59 -2.34 -0.01 0.00 2.41 0.00 0.00 30.24 30.90 2kdg n GLN 254 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2kdg s VAL 255 N 6.15 4.07 0.83 1.69 -7.23 -1.26 -3.00 120.40 121.65 2kdg s VAL 255 Ca 1.06 1.02 -0.12 0.00 -1.81 0.00 0.00 61.98 62.13 2kdg s VAL 255 Cb -0.93 -3.51 0.09 0.00 0.56 0.00 0.00 36.38 32.59 2kdg s VAL 255 CO 0.54 -0.54 1.13 -2.16 -0.31 0.00 0.00 175.10 173.75 2kdg s PRO 256 N -3.99 1.81 0.90 4.82 0.04 -1.25 -5.04 135.00 132.29 2kdg s PRO 256 Ca 0.62 0.40 -0.12 0.00 0.04 0.00 0.00 61.00 61.94 2kdg s PRO 256 Cb -0.14 -1.91 0.13 0.00 0.04 0.00 0.00 34.50 32.63 2kdg s PRO 256 CO 0.33 -1.76 1.10 -1.21 0.04 0.00 0.00 177.00 175.51 2kdg s GLU 257 N -5.30 1.23 0.90 4.56 2.02 -1.26 -4.85 118.70 115.99 2kdg s GLU 257 Ca 0.62 0.57 -0.10 0.00 0.02 0.00 0.00 54.97 56.07 2kdg s GLU 257 Cb -0.14 -1.83 0.13 0.00 0.10 0.00 0.00 34.13 32.40 2kdg s GLU 257 CO 0.53 -2.20 1.14 0.54 0.02 0.00 0.00 175.26 175.29 2kdg s ASN 258 N -3.70 3.13 0.13 -0.19 4.22 -1.26 -4.77 114.94 112.49 2kdg s ASN 258 Ca 0.63 2.13 0.07 0.00 -2.14 0.00 0.00 52.86 53.55 2kdg s ASN 258 Cb -0.16 -2.56 -0.04 0.00 1.28 0.00 0.00 41.25 39.77 2kdg s ASN 258 CO 0.55 -2.96 -0.16 -0.04 -2.04 0.00 0.00 177.10 172.45 2kdg s MET 259 N -4.69 1.09 -0.09 3.55 -1.94 -0.02 -4.99 119.30 112.22 2kdg s MET 259 Ca 0.66 -1.26 -0.04 0.00 -1.71 0.00 0.00 55.69 53.34 2kdg s MET 259 Cb -0.22 -1.07 0.05 0.00 2.01 0.00 0.00 34.83 35.60 2kdg s MET 259 CO 0.58 0.22 0.18 -1.54 -0.01 0.00 0.00 175.02 174.45 2kdg s SER 260 N -2.41 0.64 -0.06 3.03 1.04 -1.26 -0.97 113.70 113.71 2kdg s SER 260 Ca 0.10 0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.95 2kdg s SER 260 Cb -0.06 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.45 2kdg s SER 260 CO 0.04 -0.24 -0.12 -0.63 0.98 0.00 0.00 173.24 173.27 2kdg s ILE 261 N 2.31 1.10 0.14 -1.02 -1.09 -1.20 -4.94 121.20 116.50 2kdg s ILE 261 Ca 0.02 -0.46 -0.31 0.00 -2.23 0.00 0.00 60.65 57.67 2kdg s ILE 261 Cb -0.12 -1.01 -0.11 0.00 -1.58 0.00 0.00 42.46 39.64 2kdg s ILE 261 CO -0.06 0.35 1.81 -0.62 -1.23 0.00 0.00 174.94 175.19 2kdg s ASP 262 N 0.65 6.41 0.14 3.58 2.15 -1.26 -0.75 116.67 127.60 2kdg s ASP 262 Ca -0.14 2.79 -0.35 0.00 0.43 0.00 0.00 52.55 55.28 2kdg s ASP 262 Cb -0.16 -2.57 -0.15 0.00 -0.30 0.00 0.00 42.92 39.74 2kdg s ASP 262 CO 0.04 -1.00 1.45 1.21 -0.17 0.00 0.00 175.17 176.69 2kdg n GLU 263 N 5.33 1.72 0.00 4.34 2.13 -0.45 -2.61 120.64 131.11 2kdg n GLU 263 Ca 0.17 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.61 2kdg n GLU 263 Cb 0.37 -2.32 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 2.89 0.76 3.77 8.31 0.00 0.16 -4.92 105.19 116.16 2kdg n GLY 264 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.82 2.11 0.27 1.61 0.52 -1.07 -4.51 118.95 117.06 2kdg s ARG 265 Ca 0.00 0.95 -0.29 0.00 -0.52 0.00 0.00 55.73 55.87 2kdg s ARG 265 Cb 0.00 -1.90 -0.09 0.00 0.52 0.00 0.00 34.95 33.48 2kdg s ARG 265 CO 0.00 -1.68 1.11 0.12 0.02 0.00 0.00 175.30 174.87 2kdg s PHE 266 N -2.98 3.55 0.27 -0.53 2.19 -1.24 -1.92 117.98 117.32 2kdg s PHE 266 Ca 0.61 1.67 -0.08 0.00 0.33 0.00 0.00 56.93 59.46 2kdg s PHE 266 Cb -0.16 -3.31 -0.01 0.00 -1.31 0.00 0.00 43.02 38.23 2kdg s PHE 266 CO 0.56 -0.64 0.42 0.00 1.83 0.00 0.00 175.22 177.39 2kdg s ARG 268 N -3.73 1.85 0.21 0.00 1.70 -1.26 -0.66 118.95 117.06 2kdg s ARG 268 Ca 0.28 -1.51 0.05 0.00 -0.47 0.00 0.00 55.73 54.08 2kdg s ARG 268 Cb 0.01 0.49 -0.05 0.00 -0.57 0.00 0.00 34.95 34.83 2kdg s ARG 268 CO 0.13 -0.79 -0.08 -1.64 -1.08 0.00 0.00 175.30 171.84 2kdg s MET 269 N -3.26 1.29 -0.20 3.89 -1.94 -1.16 -4.97 119.30 112.96 2kdg s MET 269 Ca 0.25 -1.60 -0.04 0.00 -1.71 0.00 0.00 55.69 52.59 2kdg s MET 269 Cb -0.01 -0.84 0.06 0.00 2.01 0.00 0.00 34.83 36.05 2kdg s MET 269 CO 0.14 0.05 0.06 -0.51 -0.01 0.00 0.00 175.02 174.76 2kdg s ASP 270 N -3.29 2.81 -0.21 3.03 1.01 -1.26 -4.24 116.67 114.52 2kdg s ASP 270 Ca 0.24 -0.82 0.01 0.00 0.71 0.00 0.00 52.55 52.69 2kdg s ASP 270 Cb 0.03 -0.47 0.05 0.00 1.01 0.00 0.00 42.92 43.53 2kdg s ASP 270 CO 0.06 -0.33 -0.09 -0.36 0.21 0.00 0.00 175.17 174.66 2kdg s PHE 271 N 1.96 2.41 0.48 4.23 0.08 -0.54 -3.96 117.98 122.63 2kdg s PHE 271 Ca 0.01 -1.63 -0.23 0.00 0.12 0.00 0.00 56.93 55.20 2kdg s PHE 271 Cb -0.17 -1.62 -0.07 0.00 -0.57 0.00 0.00 43.02 40.60 2kdg s PHE 271 CO -0.11 -0.75 1.21 0.15 -0.10 0.00 0.00 175.22 175.63 2kdg s LYS 272 N 1.40 3.60 -0.12 0.44 1.02 -1.16 -0.79 119.74 124.12 2kdg s LYS 272 Ca -0.03 1.89 -0.11 0.00 0.02 0.00 0.00 55.97 57.74 2kdg s LYS 272 Cb -0.17 -2.37 0.03 0.00 -0.52 0.00 0.00 37.83 34.80 2kdg s LYS 272 CO -0.08 -0.71 0.33 0.54 -0.92 0.00 0.00 175.35 174.52 2kdg s VAL 273 N -1.49 -0.00 -0.13 3.17 0.11 -0.25 -4.44 120.40 117.38 2kdg s VAL 273 Ca 0.66 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.67 2kdg s VAL 273 Cb -0.31 -0.47 0.06 0.00 -1.53 0.00 0.00 36.38 34.13 2kdg s VAL 273 CO 0.38 0.00 0.14 -0.44 -3.33 0.00 0.00 175.10 171.85 2kdg s SER 274 N 0.20 1.40 -0.05 3.54 0.01 -1.26 -4.47 113.70 113.06 2kdg s SER 274 Ca -0.00 -0.09 -0.31 0.00 1.31 0.00 0.00 55.95 56.85 2kdg s SER 274 Cb -0.02 0.08 0.12 0.00 0.21 0.00 0.00 66.02 66.41 2kdg s SER 274 CO 0.00 -0.29 1.22 -0.83 0.41 0.00 0.00 173.24 173.75 2kdg s GLY 275 N 2.24 -0.37 -0.13 3.44 0.00 -1.26 -1.68 107.32 109.56 2kdg s GLY 275 Ca 0.04 0.91 -0.07 0.00 0.00 0.00 0.00 44.72 45.60 2kdg s GLY 275 CO -0.07 0.23 0.31 -2.27 0.00 0.00 0.00 173.10 171.30 2kdg s LEU 276 N -2.73 0.21 1.06 0.66 2.96 -0.55 -4.41 118.68 115.87 2kdg s LEU 276 Ca 0.12 0.67 -0.13 0.00 -0.22 0.00 0.00 54.13 54.57 2kdg s LEU 276 Cb 0.02 0.97 0.22 0.00 0.50 0.00 0.00 46.19 47.90 2kdg s LEU 276 CO -0.04 -0.18 1.07 -2.16 -1.32 0.00 0.00 176.35 173.73 2kdg s PRO 277 N 1.34 -0.04 -0.06 0.98 0.04 -1.26 -1.18 135.00 134.82 2kdg s PRO 277 Ca -0.09 0.60 -0.34 0.00 0.04 0.00 0.00 61.00 61.22 2kdg s PRO 277 Cb -0.10 -1.67 -0.11 0.00 0.04 0.00 0.00 34.50 32.65 2kdg s PRO 277 CO -0.10 -3.07 1.88 0.00 0.04 0.00 0.00 177.00 175.74 2kdg n ALA 278 N -4.43 1.02 -1.37 8.56 0.00 -1.26 -4.83 120.51 118.20 2kdg n ALA 278 Ca 0.04 0.28 -0.31 0.00 0.00 0.00 0.00 53.44 53.46 2kdg n ALA 278 Cb 0.56 -2.52 0.08 0.00 0.00 0.00 0.00 19.45 17.57 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 3.96 2.49 1.01 0.00 0.04 -1.26 -4.91 135.00 136.33 2kdg s PRO 279 Ca 0.91 1.10 -0.12 0.00 0.04 0.00 0.00 61.00 62.94 2kdg s PRO 279 Cb -0.65 -1.93 0.19 0.00 0.04 0.00 0.00 34.50 32.15 2kdg s PRO 279 CO 0.49 -1.45 1.08 0.34 0.04 0.00 0.00 177.00 177.50 2kdg s ASP 280 N -3.50 2.44 -0.23 6.66 2.15 0.05 -4.82 116.67 119.42 2kdg s ASP 280 Ca 0.60 1.43 -0.02 0.00 0.43 0.00 0.00 52.55 54.99 2kdg s ASP 280 Cb -0.16 -2.11 0.07 0.00 -0.30 0.00 0.00 42.92 40.42 2kdg s ASP 280 CO 0.55 -3.28 0.05 -0.69 -0.17 0.00 0.00 175.17 171.63 2kdg s VAL 281 N -2.80 0.63 -0.34 1.11 1.01 -1.26 -3.60 120.40 115.16 2kdg s VAL 281 Ca 0.66 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.84 2kdg s VAL 281 Cb -0.20 -1.23 0.10 0.00 0.00 0.00 0.00 36.38 35.05 2kdg s VAL 281 CO 0.59 -0.35 0.08 -0.44 0.00 0.00 0.00 175.10 174.98 2kdg s SER 282 N 1.79 4.46 0.43 3.32 0.01 -0.80 -5.03 113.70 117.88 2kdg s SER 282 Ca 0.02 -2.00 -0.17 0.00 1.31 0.00 0.00 55.95 55.11 2kdg s SER 282 Cb -0.17 -1.33 -0.09 0.00 0.21 0.00 0.00 66.02 64.63 2kdg s SER 282 CO -0.14 -0.39 0.90 0.26 0.41 0.00 0.00 173.24 174.28 2kdg s TRP 283 N 1.12 3.38 0.06 2.43 0.52 -1.26 -1.03 118.94 124.16 2kdg s TRP 283 Ca 0.11 1.43 -0.02 0.00 0.02 0.00 0.00 56.10 57.64 2kdg s TRP 283 Cb -0.19 -2.73 -0.04 0.00 -1.15 0.00 0.00 33.47 29.37 2kdg s TRP 283 CO -0.14 -0.14 -0.00 0.71 0.02 0.00 0.00 176.95 177.39 2kdg s TYR 284 N -2.29 0.50 -0.15 -1.98 1.51 0.16 -1.38 117.35 113.71 2kdg s TYR 284 Ca 0.58 -1.03 -0.04 0.00 -1.01 0.00 0.00 57.07 55.57 2kdg s TYR 284 Cb -0.10 -0.36 0.08 0.00 -0.11 0.00 0.00 41.96 41.47 2kdg s TYR 284 CO 0.21 -0.40 0.25 -1.17 -1.11 0.00 0.00 175.55 173.33 2kdg s LEU 285 N -2.92 -0.26 -0.43 -1.29 2.96 0.06 -1.28 118.68 115.51 2kdg s LEU 285 Ca 0.08 0.34 0.00 0.00 -0.22 0.00 0.00 54.13 54.33 2kdg s LEU 285 Cb 0.08 0.63 0.00 0.00 0.50 0.00 0.00 46.19 47.39 2kdg s LEU 285 CO -0.10 -0.27 0.00 0.59 -1.32 0.00 0.00 176.35 175.26 2kdg n ASN 286 N 5.34 -4.64 0.00 3.68 3.02 -0.34 -1.47 115.26 120.85 2kdg n ASN 286 Ca -0.06 0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 2kdg n ASN 286 Cb 0.50 -3.13 0.00 0.00 -0.61 0.00 0.00 39.78 36.54 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 0.52 1.76 3.86 7.41 0.00 -1.26 -5.07 105.19 112.41 2kdg n GLY 287 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 2kdg n GLY 287 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kdg s ARG 288 N -0.49 3.71 0.77 1.61 0.52 -0.54 -5.09 118.95 119.43 2kdg s ARG 288 Ca 0.00 0.75 -0.11 0.00 -0.52 0.00 0.00 55.73 55.85 2kdg s ARG 288 Cb 0.00 -2.14 0.05 0.00 0.52 0.00 0.00 34.95 33.39 2kdg s ARG 288 CO 0.00 -0.43 1.08 0.95 0.02 0.00 0.00 175.30 176.93 2kdg s THR 289 N -2.94 3.38 -0.01 0.02 -4.23 -1.26 -0.76 115.64 109.83 2kdg s THR 289 Ca 0.55 0.45 0.01 0.00 -1.18 0.00 0.00 61.69 61.53 2kdg s THR 289 Cb -0.11 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.57 2kdg s THR 289 CO 0.45 -0.59 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.21 2kdg s VAL 290 N -3.09 0.40 0.20 2.29 1.01 -0.48 -4.60 120.40 116.12 2kdg s VAL 290 Ca 0.60 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.47 2kdg s VAL 290 Cb -0.15 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2kdg s VAL 290 CO 0.55 0.13 0.10 -1.10 0.00 0.00 0.00 175.10 174.78 2kdg s GLN 291 N 0.15 2.71 0.66 2.72 1.11 -1.26 -4.24 119.66 121.50 2kdg s GLN 291 Ca -0.01 -1.03 -0.14 0.00 0.01 0.00 0.00 55.36 54.18 2kdg s GLN 291 Cb -0.05 -2.50 -0.00 0.00 -1.01 0.00 0.00 33.01 29.45 2kdg s GLN 291 CO -0.00 0.44 1.09 -1.54 0.01 0.00 0.00 175.29 175.29 2kdg s SER 292 N -3.29 5.23 0.24 5.90 1.04 -1.26 -4.98 113.70 116.58 2kdg s SER 292 Ca 0.30 1.92 -0.15 0.00 0.48 0.00 0.00 55.95 58.51 2kdg s SER 292 Cb -0.09 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.49 2kdg s SER 292 CO 0.22 -1.55 0.51 -0.62 0.98 0.00 0.00 173.24 172.79 2kdg s ASP 293 N -2.78 -0.14 0.38 7.02 2.15 -0.69 -4.96 116.67 117.66 2kdg s ASP 293 Ca 0.65 -0.81 0.07 0.00 0.43 0.00 0.00 52.55 52.90 2kdg s ASP 293 Cb -0.19 0.60 0.79 0.00 -0.30 0.00 0.00 42.92 43.82 2kdg s ASP 293 CO 0.42 -1.15 1.97 -0.78 -0.17 0.00 0.00 175.17 175.47 2kdg h ASP 294 N 2.22 0.60 1.45 -0.34 3.58 -2.01 -1.73 116.42 120.20 2kdg h ASP 294 Ca -0.26 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.20 2kdg h ASP 294 Cb 1.25 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.17 2kdg h ASP 294 CO 0.34 0.39 -0.09 -0.07 -2.88 0.00 0.00 179.24 176.93 2kdg h LEU 295 N 0.69 0.00 -6.06 2.28 3.38 -1.96 -3.41 115.31 110.23 2kdg h LEU 295 Ca 0.29 -0.03 -0.57 0.00 0.09 0.00 0.00 57.88 57.66 2kdg h LEU 295 Cb 0.26 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.62 2kdg h LEU 295 CO -0.09 0.01 -0.98 1.41 0.09 0.00 0.00 178.44 178.88 2kdg n HIS 296 N -2.34 0.56 -2.20 1.13 8.25 -0.67 -1.15 115.22 118.80 2kdg n HIS 296 Ca 0.05 -3.70 -0.41 0.00 -0.26 0.00 0.00 57.72 53.40 2kdg n HIS 296 Cb 0.44 -0.38 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.44 4.40 -0.28 -0.41 1.02 -1.12 -1.70 119.74 120.21 2kdg s LYS 297 Ca 0.36 2.09 -0.02 0.00 0.02 0.00 0.00 55.97 58.42 2kdg s LYS 297 Cb 0.16 -3.15 0.09 0.00 -0.52 0.00 0.00 37.83 34.40 2kdg s LYS 297 CO -0.09 -0.19 0.09 -1.64 -0.92 0.00 0.00 175.35 172.59 2kdg s MET 298 N -0.73 0.61 0.14 1.68 -1.94 -1.26 -1.34 119.30 116.45 2kdg s MET 298 Ca 0.53 -0.81 0.02 0.00 -1.71 0.00 0.00 55.69 53.72 2kdg s MET 298 Cb -0.37 -1.86 -0.04 0.00 2.01 0.00 0.00 34.83 34.56 2kdg s MET 298 CO 0.43 -0.91 -0.02 0.96 -0.01 0.00 0.00 175.02 175.46 2kdg s ILE 299 N 1.77 0.65 -0.17 2.53 -0.00 -1.20 -5.03 121.20 119.76 2kdg s ILE 299 Ca 0.07 -1.96 -0.02 0.00 -0.00 0.00 0.00 60.65 58.75 2kdg s ILE 299 Cb -0.17 -1.92 0.05 0.00 -0.00 0.00 0.00 42.46 40.42 2kdg s ILE 299 CO -0.23 -0.65 -0.00 -0.69 -0.00 0.00 0.00 174.94 173.37 2kdg s VAL 300 N -3.67 0.75 0.47 8.37 1.01 -1.26 -2.00 120.40 124.07 2kdg s VAL 300 Ca 0.19 -0.53 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 2kdg s VAL 300 Cb 0.06 -1.09 -0.07 0.00 0.00 0.00 0.00 36.38 35.27 2kdg s VAL 300 CO 0.00 -0.03 1.18 -0.55 0.00 0.00 0.00 175.10 175.70 2kdg s SER 301 N 1.77 6.09 0.64 3.32 0.15 0.23 -4.95 113.70 120.95 2kdg s SER 301 Ca -0.00 2.34 0.41 0.00 0.70 0.00 0.00 55.95 59.40 2kdg s SER 301 Cb -0.16 -2.61 2.23 0.00 -1.71 0.00 0.00 66.02 63.78 2kdg s SER 301 CO -0.07 -0.98 2.26 1.05 1.20 0.00 0.00 173.24 176.70 2kdg h GLU 302 N 1.99 0.00 0.00 5.44 4.11 -2.01 -2.45 114.58 121.65 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 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2kdg h GLU 302 CO 0.60 0.00 0.00 1.63 0.07 0.00 0.00 179.01 181.31 2kdg n LYS 303 N -2.99 0.59 -1.43 1.06 4.76 -1.26 -4.91 118.16 113.99 2kdg n LYS 303 Ca -0.03 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 2kdg n LYS 303 Cb 0.11 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 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 0.90 0.49 2.91 0.72 0.00 -0.92 -4.97 105.19 104.31 2kdg n GLY 304 Ca 0.16 -0.35 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.36 -0.06 0.22 0.99 1.98 -1.24 -1.09 118.68 118.12 2kdg s LEU 305 Ca 0.00 0.43 0.09 0.00 -2.89 0.00 0.00 54.13 51.76 2kdg s LEU 305 Cb 0.00 0.45 -0.04 0.00 0.66 0.00 0.00 46.19 47.26 2kdg s LEU 305 CO 0.00 -0.23 -0.06 -1.38 -1.89 0.00 0.00 176.35 172.79 2kdg s HIS 306 N 2.19 2.64 0.06 5.38 -3.43 0.03 -0.60 115.29 121.55 2kdg s HIS 306 Ca 0.01 -0.23 -0.05 0.00 -0.80 0.00 0.00 55.06 53.99 2kdg s HIS 306 Cb -0.12 -1.23 -0.02 0.00 -1.43 0.00 0.00 32.58 29.79 2kdg s HIS 306 CO -0.07 0.58 0.08 -1.12 -2.00 0.00 0.00 174.74 172.20 2kdg s SER 307 N -3.24 0.28 -0.26 7.38 0.01 -0.84 -1.47 113.70 115.55 2kdg s SER 307 Ca 0.28 -0.76 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 2kdg s SER 307 Cb -0.07 0.25 0.08 0.00 0.21 0.00 0.00 66.02 66.49 2kdg s SER 307 CO 0.17 -0.62 0.05 -0.22 0.41 0.00 0.00 173.24 173.03 2kdg s LEU 308 N -2.68 2.10 0.46 2.44 0.20 -1.26 -3.20 118.68 116.73 2kdg s LEU 308 Ca 0.03 -1.33 -0.20 0.00 0.69 0.00 0.00 54.13 53.32 2kdg s LEU 308 Cb 0.04 -0.88 -0.10 0.00 -0.43 0.00 0.00 46.19 44.82 2kdg s LEU 308 CO -0.09 -0.35 0.97 -0.63 -0.29 0.00 0.00 176.35 175.96 2kdg s ILE 309 N 1.61 4.35 -0.32 6.68 1.09 -0.45 -2.98 121.20 131.18 2kdg s ILE 309 Ca 0.04 1.39 -0.00 0.00 -1.10 0.00 0.00 60.65 60.97 2kdg s ILE 309 Cb -0.18 -3.61 0.10 0.00 -1.06 0.00 0.00 42.46 37.72 2kdg s ILE 309 CO -0.16 -0.39 0.11 -0.36 -0.10 0.00 0.00 174.94 174.04 2kdg s PHE 310 N -2.26 1.77 0.31 3.97 0.40 0.17 -3.90 117.98 118.44 2kdg s PHE 310 Ca 0.62 -1.83 0.01 0.00 -0.60 0.00 0.00 56.93 55.13 2kdg s PHE 310 Cb -0.10 -1.75 0.51 0.00 0.51 0.00 0.00 43.02 42.19 2kdg s PHE 310 CO 0.18 -0.87 1.88 0.93 0.70 0.00 0.00 175.22 178.04 2kdg h GLU 311 N 7.93 0.76 -1.77 0.44 4.39 -1.38 -1.55 114.58 123.39 2kdg h GLU 311 Ca -0.12 -0.13 -0.37 0.00 0.34 0.00 0.00 59.36 59.09 2kdg h GLU 311 Cb 1.01 -0.13 -0.28 0.00 -0.10 0.00 0.00 28.75 29.24 2kdg h GLU 311 CO 0.47 0.65 -0.72 0.54 -1.16 0.00 0.00 179.01 178.79 2kdg s VAL 312 N -5.28 -0.33 0.37 3.13 0.11 -1.25 -3.70 120.40 113.44 2kdg s VAL 312 Ca -0.09 -1.50 -0.27 0.00 -2.93 0.00 0.00 61.98 57.19 2kdg s VAL 312 Cb 0.16 -0.64 -0.09 0.00 -1.53 0.00 0.00 36.38 34.28 2kdg s VAL 312 CO 0.78 -0.61 1.30 0.54 -3.33 0.00 0.00 175.10 173.78 2kdg s VAL 313 N 0.83 2.69 0.21 2.04 0.11 -0.81 -4.81 120.40 120.66 2kdg s VAL 313 Ca 0.26 0.65 0.07 0.00 -2.93 0.00 0.00 61.98 60.03 2kdg s VAL 313 Cb -0.04 -3.40 -0.05 0.00 -1.53 0.00 0.00 36.38 31.36 2kdg s VAL 313 CO -0.09 0.12 -0.12 -0.13 -3.33 0.00 0.00 175.10 171.55 2kdg s ARG 314 N -2.03 1.32 0.45 1.54 1.81 -1.26 -0.67 118.95 120.11 2kdg s ARG 314 Ca 0.53 -1.60 0.17 0.00 -1.72 0.00 0.00 55.73 53.11 2kdg s ARG 314 Cb -0.38 -1.04 1.12 0.00 -0.45 0.00 0.00 34.95 34.19 2kdg s ARG 314 CO 0.50 0.14 1.95 0.00 -0.68 0.00 0.00 175.30 177.21 2kdg h ALA 315 N 2.55 2.17 0.00 2.13 0.00 -1.95 -0.43 119.26 123.72 2kdg h ALA 315 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2kdg h ALA 315 Cb 1.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2kdg h ALA 315 CO 0.63 -0.34 0.00 0.77 0.00 0.00 0.00 179.25 180.31 2kdg h SER 316 N 0.33 0.00 0.63 0.00 0.02 -1.97 -2.91 113.55 109.65 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 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.35 2kdg h SER 316 CO -0.08 0.00 -0.05 0.47 -1.14 0.00 0.00 176.83 176.03 2kdg n ASP 317 N -2.39 0.12 -4.75 3.07 8.00 -0.17 -4.92 116.55 115.50 2kdg n ASP 317 Ca 0.01 -0.08 -0.36 0.00 0.71 0.00 0.00 54.79 55.07 2kdg n ASP 317 Cb 0.21 -0.26 0.03 0.00 -0.02 0.00 0.00 41.12 41.08 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 -2.68 2.57 0.00 2.24 0.00 -1.10 -4.94 121.76 117.85 2kdg s ALA 318 Ca 0.24 1.03 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2kdg s ALA 318 Cb 0.20 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2kdg s ALA 318 CO 0.49 -1.16 0.00 0.41 0.00 0.00 0.00 175.76 175.50 2kdg n GLY 319 N 0.53 0.98 3.51 0.00 0.00 -0.45 -5.00 105.19 104.75 2kdg n GLY 319 Ca 0.13 -1.95 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.04 3.06 0.44 4.61 0.00 -1.26 -1.16 121.76 126.41 2kdg s ALA 320 Ca 0.00 -1.40 -0.18 0.00 0.00 0.00 0.00 51.96 50.38 2kdg s ALA 320 Cb 0.00 -3.89 -0.10 0.00 0.00 0.00 0.00 23.12 19.14 2kdg s ALA 320 CO 0.00 -2.67 0.92 0.71 0.00 0.00 0.00 175.76 174.72 2kdg s TYR 321 N 4.37 3.37 0.14 0.00 2.02 -0.34 -1.20 117.35 125.70 2kdg s TYR 321 Ca 0.30 1.49 -0.05 0.00 -0.37 0.00 0.00 57.07 58.44 2kdg s TYR 321 Cb -0.13 -2.77 -0.02 0.00 -0.40 0.00 0.00 41.96 38.64 2kdg s TYR 321 CO 0.16 -0.16 0.18 0.00 -1.57 0.00 0.00 175.55 174.16 2kdg s ALA 322 N -2.29 0.36 -0.08 3.71 0.00 -0.40 -1.38 121.76 121.68 2kdg s ALA 322 Ca 0.60 -1.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.40 2kdg s ALA 322 Cb -0.09 0.83 0.04 0.00 0.00 0.00 0.00 23.12 23.89 2kdg s ALA 322 CO 0.20 -0.57 0.09 0.00 0.00 0.00 0.00 175.76 175.48 2kdg s VAL 324 N 2.19 5.00 -0.14 0.00 1.01 -0.20 -1.04 120.40 127.23 2kdg s VAL 324 Ca 0.04 1.29 0.00 0.00 0.00 0.00 0.00 61.98 63.31 2kdg s VAL 324 Cb -0.13 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.31 2kdg s VAL 324 CO -0.05 0.34 -0.11 0.00 0.00 0.00 0.00 175.10 175.27 2kdg s ALA 325 N 0.34 1.65 -0.02 5.51 0.00 -0.07 -1.91 121.76 127.25 2kdg s ALA 325 Ca 0.33 -0.77 0.03 0.00 0.00 0.00 0.00 51.96 51.55 2kdg s ALA 325 Cb -0.18 -1.01 -0.00 0.00 0.00 0.00 0.00 23.12 21.94 2kdg s ALA 325 CO 0.17 -0.42 -0.10 0.15 0.00 0.00 0.00 175.76 175.56 2kdg s LYS 326 N 1.58 0.97 0.30 0.00 1.02 -1.24 -0.90 119.74 121.47 2kdg s LYS 326 Ca 0.05 -0.34 0.04 0.00 0.02 0.00 0.00 55.97 55.73 2kdg s LYS 326 Cb -0.13 -0.91 -0.01 0.00 -0.52 0.00 0.00 37.83 36.25 2kdg s LYS 326 CO -0.10 0.16 0.13 0.27 -0.92 0.00 0.00 175.35 174.89 2kdg n ASN 327 N 3.13 0.81 0.20 2.83 0.23 -0.51 -0.77 115.26 121.18 2kdg n ASN 327 Ca -0.17 -2.65 0.13 0.00 -0.53 0.00 0.00 54.58 51.37 2kdg n ASN 327 Cb 0.55 0.88 0.70 0.00 -2.08 0.00 0.00 39.78 39.83 2kdg n ASN 327 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2kdg h ARG 328 N 0.00 0.00 0.00 -3.83 0.11 -1.92 -3.00 114.38 105.74 2kdg h ARG 328 Ca -0.23 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.84 2kdg h ARG 328 Cb 0.92 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.00 2kdg h ARG 328 CO 0.36 0.00 -1.62 0.00 0.10 0.00 0.00 179.97 178.81 2kdg n ALA 329 N -1.83 2.44 0.00 0.08 0.00 -1.26 -5.09 120.51 114.84 2kdg n ALA 329 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2kdg n ALA 329 Cb 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.07 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 -1.27 3.02 0.00 0.00 -1.14 -4.59 105.19 103.01 2kdg n GLY 330 Ca -0.04 -0.94 -0.16 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 -0.69 0.58 0.16 1.61 2.12 -1.26 -1.43 118.70 119.79 2kdg s GLU 331 Ca 0.00 -0.43 0.01 0.00 0.36 0.00 0.00 54.97 54.91 2kdg s GLU 331 Cb 0.00 -0.50 -0.04 0.00 0.26 0.00 0.00 34.13 33.84 2kdg s GLU 331 CO 0.00 0.13 0.01 0.00 -0.54 0.00 0.00 175.26 174.86 2kdg s ALA 332 N -0.56 1.23 -0.01 6.30 0.00 -0.08 -4.82 121.76 123.82 2kdg s ALA 332 Ca -0.01 -1.55 -0.01 0.00 0.00 0.00 0.00 51.96 50.39 2kdg s ALA 332 Cb -0.05 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.65 2kdg s ALA 332 CO 0.00 -0.35 0.03 0.99 0.00 0.00 0.00 175.76 176.43 2kdg s THR 333 N -3.73 0.00 0.14 0.00 2.01 -1.26 -0.89 115.64 111.91 2kdg s THR 333 Ca 0.23 -0.02 0.08 0.00 0.31 0.00 0.00 61.69 62.30 2kdg s THR 333 Cb 0.06 -0.05 -0.04 0.00 0.01 0.00 0.00 72.50 72.48 2kdg s THR 333 CO 0.03 -0.01 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.39 2kdg s PHE 334 N -0.02 1.82 -0.05 4.92 0.08 -0.21 -4.95 117.98 119.58 2kdg s PHE 334 Ca -0.00 -0.45 -0.12 0.00 0.12 0.00 0.00 56.93 56.48 2kdg s PHE 334 Cb -0.00 -0.94 0.02 0.00 -0.57 0.00 0.00 43.02 41.52 2kdg s PHE 334 CO 0.00 0.28 0.28 0.99 -0.10 0.00 0.00 175.22 176.68 2kdg s THR 335 N -1.68 0.04 0.27 0.64 2.01 -1.26 -0.91 115.64 114.74 2kdg s THR 335 Ca 0.12 -0.33 -0.11 0.00 0.31 0.00 0.00 61.69 61.68 2kdg s THR 335 Cb -0.07 -0.52 -0.00 0.00 0.01 0.00 0.00 72.50 71.92 2kdg s THR 335 CO 0.06 -0.18 0.49 0.54 -0.69 0.00 0.00 174.62 174.83 2kdg s VAL 336 N -0.78 0.00 -0.01 3.82 0.11 -0.48 -4.63 120.40 118.43 2kdg s VAL 336 Ca -0.09 -1.43 0.04 0.00 -2.93 0.00 0.00 61.98 57.57 2kdg s VAL 336 Cb -0.04 -2.32 -0.01 0.00 -1.53 0.00 0.00 36.38 32.48 2kdg s VAL 336 CO 0.02 0.00 -0.12 -1.58 -3.33 0.00 0.00 175.10 170.10 2kdg s GLN 337 N -3.78 0.95 -0.23 1.54 0.74 -1.26 -1.20 119.66 116.42 2kdg s GLN 337 Ca 0.24 -0.42 0.00 0.00 0.05 0.00 0.00 55.36 55.23 2kdg s GLN 337 Cb -0.01 -0.92 0.06 0.00 1.10 0.00 0.00 33.01 33.24 2kdg s GLN 337 CO 0.11 0.25 -0.05 -1.17 -0.55 0.00 0.00 175.29 173.88 2kdg s LEU 338 N -0.28 2.43 -1.07 3.68 2.96 -0.31 -0.84 118.68 125.26 2kdg s LEU 338 Ca 0.05 -1.11 -0.11 0.00 -0.22 0.00 0.00 54.13 52.73 2kdg s LEU 338 Cb -0.05 -1.14 0.24 0.00 0.50 0.00 0.00 46.19 45.75 2kdg s LEU 338 CO -0.00 -0.23 1.11 -0.62 -1.32 0.00 0.00 176.35 175.28 2kdg s ASP 339 N 1.43 7.14 -0.16 3.68 2.15 -0.14 -1.35 116.67 129.43 2kdg s ASP 339 Ca -0.05 -3.24 -0.29 0.00 0.43 0.00 0.00 52.55 49.40 2kdg s ASP 339 Cb -0.18 -2.25 -0.05 0.00 -0.30 0.00 0.00 42.92 40.13 2kdg s ASP 339 CO -0.06 -0.46 1.89 -0.69 -0.17 0.00 0.00 175.17 175.68 2kdg s VAL 340 N -0.30 3.31 -0.91 1.11 1.01 -1.26 -3.23 120.40 120.13 2kdg s VAL 340 Ca 0.31 0.34 -0.24 0.00 0.00 0.00 0.00 61.98 62.38 2kdg s VAL 340 Cb -0.08 -3.32 0.03 0.00 0.00 0.00 0.00 36.38 33.01 2kdg s VAL 340 CO -0.07 -0.13 1.48 -0.76 0.00 0.00 0.00 175.10 175.61 2kdg s LEU 341 N 5.98 3.36 0.79 3.92 1.43 0.07 -4.83 118.68 129.40 2kdg s LEU 341 Ca 0.85 -0.99 -0.13 0.00 -1.03 0.00 0.00 54.13 52.83 2kdg s LEU 341 Cb -0.32 -2.56 0.07 0.00 0.03 0.00 0.00 46.19 43.41 2kdg s LEU 341 CO 0.34 -1.78 1.17 0.00 0.23 0.00 0.00 176.35 176.31 2kdg s ALA 342 N 5.96 1.96 0.00 4.21 0.00 -1.26 -1.34 121.76 131.30 2kdg s ALA 342 Ca 0.47 0.71 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2kdg s ALA 342 Cb -0.04 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2kdg s ALA 342 CO -0.00 -2.09 0.00 0.36 0.00 0.00 0.00 175.76 174.02 2kdg n LYS 343 N -3.24 3.42 0.00 0.00 2.85 -1.26 -4.88 118.16 115.05 2kdg n LYS 343 Ca 0.12 0.00 0.14 0.00 -1.05 0.00 0.00 58.31 57.52 2kdg n LYS 343 Cb 0.51 -0.61 0.82 0.00 -0.65 0.00 0.00 35.03 35.10 2kdg n LYS 343 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74