#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g76 s THR 254 N 0.00 2.53 -0.13 2.46 2.01 -1.26 -5.14 115.64 116.11 3g76 s THR 254 Ca 0.00 -1.51 -0.04 0.00 0.31 0.00 0.00 61.69 60.44 3g76 s THR 254 Cb 0.00 -3.00 0.07 0.00 0.01 0.00 0.00 72.50 69.58 3g76 s THR 254 CO 0.00 -0.01 0.24 0.20 -0.69 0.00 0.00 174.62 174.36 3g76 s ASN 255 N -4.02 0.61 -0.14 3.53 0.02 -1.26 -5.14 114.94 108.55 3g76 s ASN 255 Ca 0.44 0.39 -0.07 0.00 -1.02 0.00 0.00 52.86 52.60 3g76 s ASN 255 Cb -0.00 0.56 -0.04 0.00 0.02 0.00 0.00 41.25 41.79 3g76 s ASN 255 CO 0.25 -0.26 0.12 -0.76 0.02 0.00 0.00 177.10 176.48 3g76 s LEU 256 N 2.38 4.25 0.33 0.60 1.43 -1.26 -4.98 118.68 121.43 3g76 s LEU 256 Ca 0.03 0.37 -0.17 0.00 -1.03 0.00 0.00 54.13 53.32 3g76 s LEU 256 Cb -0.13 -2.05 -0.13 0.00 0.03 0.00 0.00 46.19 43.92 3g76 s LEU 256 CO -0.09 0.34 0.08 -2.65 0.23 0.00 0.00 176.35 174.27 3g76 n PRO 257 N 2.41 0.00 0.18 1.29 -0.02 -1.26 -4.88 135.00 132.72 3g76 n PRO 257 Ca -0.19 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.36 3g76 n PRO 257 Cb 0.54 -0.82 0.10 0.00 -0.02 0.00 0.00 33.50 33.30 3g76 n PRO 257 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3g76 h ARG 258 N 0.28 0.00 -2.80 -0.52 2.43 -0.54 -3.40 114.38 109.83 3g76 h ARG 258 Ca -0.30 0.00 -0.59 0.00 -0.81 0.00 0.00 59.98 58.29 3g76 h ARG 258 Cb 1.18 0.00 -0.39 0.00 -0.42 0.00 0.00 29.97 30.34 3g76 h ARG 258 CO 0.38 0.29 -0.80 1.21 -1.51 0.00 0.00 179.97 179.54 3g76 s ASN 259 N -6.35 3.31 0.00 -3.80 2.47 -0.38 -5.01 114.94 105.18 3g76 s ASN 259 Ca 0.05 -2.20 0.19 0.00 0.42 0.00 0.00 52.86 51.32 3g76 s ASN 259 Cb 0.07 -0.63 1.13 0.00 -1.45 0.00 0.00 41.25 40.37 3g76 s ASN 259 CO 0.71 -0.32 1.65 -0.81 -3.72 0.00 0.00 177.10 174.62 3g76 n PRO 260 N 4.06 0.88 0.01 0.43 -0.05 -1.26 -2.43 135.00 136.64 3g76 n PRO 260 Ca 0.08 0.00 0.11 0.00 -0.05 0.00 0.00 63.50 63.64 3g76 n PRO 260 Cb 0.37 -1.33 0.05 0.00 -0.05 0.00 0.00 33.50 32.54 3g76 n PRO 260 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 3g76 n SER 261 N -0.83 0.70 -1.74 3.54 3.41 -1.26 -3.72 113.62 113.71 3g76 n SER 261 Ca 0.14 -0.51 -0.10 0.00 -0.26 0.00 0.00 58.87 58.14 3g76 n SER 261 Cb 0.07 0.68 0.23 0.00 -0.26 0.00 0.00 64.21 64.92 3g76 n SER 261 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3g76 n MET 262 N -1.62 2.61 0.12 4.33 2.81 -1.02 -4.64 117.12 119.71 3g76 n MET 262 Ca 0.04 -3.07 0.13 0.00 -1.81 0.00 0.00 57.70 52.99 3g76 n MET 262 Cb 0.36 -2.06 0.38 0.00 -0.71 0.00 0.00 33.22 31.19 3g76 n MET 262 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3g76 h ALA 263 N 1.54 1.00 -3.12 3.04 0.00 -1.70 -3.44 119.26 116.57 3g76 h ALA 263 Ca 0.36 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.62 3g76 h ALA 263 Cb 2.25 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 19.80 3g76 h ALA 263 CO 0.72 0.00 -0.69 -0.51 0.00 0.00 0.00 179.25 178.78 3g76 s ASP 264 N -4.75 4.63 0.27 0.00 -0.00 -1.26 -4.99 116.67 110.56 3g76 s ASP 264 Ca 0.10 -0.25 0.11 0.00 -0.00 0.00 0.00 52.55 52.51 3g76 s ASP 264 Cb 0.11 -1.78 0.89 0.00 -0.00 0.00 0.00 42.92 42.13 3g76 s ASP 264 CO 0.60 0.06 1.21 0.00 -0.00 0.00 0.00 175.17 177.04 3g76 n TYR 265 N 4.26 0.76 0.32 4.23 9.36 -1.26 0.46 117.16 135.29 3g76 n TYR 265 Ca -0.17 0.91 -0.17 0.00 3.32 0.00 0.00 57.90 61.79 3g76 n TYR 265 Cb 0.52 -1.24 -0.09 0.00 -0.63 0.00 0.00 39.34 37.90 3g76 n TYR 265 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 3g76 h GLU 266 N 0.00 -0.78 -0.30 2.98 4.57 -1.96 -0.48 114.58 118.61 3g76 h GLU 266 Ca 0.59 0.05 0.09 0.00 -1.18 0.00 0.00 59.36 58.91 3g76 h GLU 266 Cb 1.47 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 30.22 3g76 h GLU 266 CO -0.63 -0.52 0.39 0.00 -1.18 0.00 0.00 179.01 177.07 3g76 h ALA 267 N -0.39 1.93 0.00 2.92 0.00 -0.33 -0.77 119.26 122.61 3g76 h ALA 267 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3g76 h ALA 267 Cb 0.64 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3g76 h ALA 267 CO 0.10 -0.55 -0.00 0.00 0.00 0.00 0.00 179.25 178.81 3g76 h ARG 268 N 0.00 0.00 -0.46 0.00 3.08 -0.82 -3.29 114.38 112.89 3g76 h ARG 268 Ca 0.14 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.33 3g76 h ARG 268 Cb 0.92 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.95 3g76 h ARG 268 CO -0.00 0.00 0.65 -0.84 -1.07 0.00 0.00 179.97 178.71 3g76 h ILE 269 N -0.75 0.18 -0.96 2.04 -0.00 -0.78 0.18 117.51 117.42 3g76 h ILE 269 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 64.86 65.05 3g76 h ILE 269 Cb 0.00 0.45 -0.09 0.00 -0.00 0.00 0.00 36.82 37.18 3g76 h ILE 269 CO 0.00 0.00 0.61 0.15 -0.00 0.00 0.00 178.15 178.91 3g76 h PHE 270 N 0.00 0.84 -0.00 0.16 3.57 -1.21 -0.38 116.94 119.91 3g76 h PHE 270 Ca 0.22 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.74 3g76 h PHE 270 Cb 1.52 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 40.01 3g76 h PHE 270 CO 0.00 0.22 -0.33 0.25 -2.23 0.00 0.00 178.31 176.22 3g76 n THR 271 N -4.63 0.00 -1.17 4.41 -2.24 0.63 -3.88 114.28 107.40 3g76 n THR 271 Ca 0.21 -0.07 -0.16 0.00 -2.27 0.00 0.00 64.05 61.76 3g76 n THR 271 Cb 0.60 0.27 0.23 0.00 -2.10 0.00 0.00 70.33 69.33 3g76 n THR 271 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3g76 n PHE 272 N -1.02 2.72 0.09 4.78 0.99 -0.15 -4.34 117.46 120.53 3g76 n PHE 272 Ca 0.10 -1.58 -0.16 0.00 -0.00 0.00 0.00 57.45 55.80 3g76 n PHE 272 Cb 0.34 -0.82 -0.11 0.00 -1.00 0.00 0.00 39.48 37.89 3g76 n PHE 272 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 3g76 h GLY 273 N 1.65 0.42 -3.44 1.37 0.00 -1.67 -3.26 103.07 98.14 3g76 h GLY 273 Ca 0.47 -0.93 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3g76 h GLY 273 CO 0.92 0.82 0.00 -1.30 0.00 0.00 0.00 176.54 176.98 3g76 n THR 274 N -3.65 2.52 -2.22 4.70 -2.24 -1.26 -4.96 114.28 107.17 3g76 n THR 274 Ca -0.09 -1.34 -0.42 0.00 -2.27 0.00 0.00 64.05 59.93 3g76 n THR 274 Cb 0.96 -0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.99 3g76 n THR 274 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3g76 s TRP 275 N -2.52 2.94 -1.28 4.78 -0.11 -1.23 -4.91 118.94 116.61 3g76 s TRP 275 Ca 0.54 0.86 0.11 0.00 1.22 0.00 0.00 56.10 58.83 3g76 s TRP 275 Cb 0.39 -3.65 0.11 0.00 -1.50 0.00 0.00 33.47 28.82 3g76 s TRP 275 CO 0.18 -2.38 0.89 0.44 -4.62 0.00 0.00 176.95 171.46 3g76 n ILE 276 N 4.51 0.12 -4.06 5.86 -5.35 -1.26 -5.03 119.36 114.15 3g76 n ILE 276 Ca 0.13 -0.56 -0.32 0.00 -0.27 0.00 0.00 62.75 61.73 3g76 n ILE 276 Cb 0.44 1.13 -0.06 0.00 -1.74 0.00 0.00 39.64 39.41 3g76 n ILE 276 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 3g76 s TYR 277 N -0.90 3.27 -1.75 4.28 1.51 -1.26 -5.00 117.35 117.50 3g76 s TYR 277 Ca 0.14 0.16 0.16 0.00 -1.01 0.00 0.00 57.07 56.52 3g76 s TYR 277 Cb 0.09 -1.69 0.90 0.00 -0.11 0.00 0.00 41.96 41.15 3g76 s TYR 277 CO 0.14 0.54 1.42 -1.13 -1.11 0.00 0.00 175.55 175.41 3g76 n SER 278 N 0.78 0.00 -4.62 2.29 3.41 -1.26 -4.62 113.62 109.60 3g76 n SER 278 Ca -0.10 -0.26 -0.43 0.00 -0.26 0.00 0.00 58.87 57.82 3g76 n SER 278 Cb 0.52 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 3g76 n SER 278 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3g76 s VAL 279 N -2.25 4.19 -0.24 -3.33 -7.23 -1.26 -4.58 120.40 105.69 3g76 s VAL 279 Ca 0.20 1.32 -0.42 0.00 -1.81 0.00 0.00 61.98 61.27 3g76 s VAL 279 Cb 0.11 -4.30 -0.18 0.00 0.56 0.00 0.00 36.38 32.57 3g76 s VAL 279 CO 0.21 -0.61 1.50 -3.20 -0.31 0.00 0.00 175.10 172.69 3g76 n ASN 280 N 7.67 1.39 0.15 4.85 2.85 -1.26 -4.85 115.26 126.06 3g76 n ASN 280 Ca 0.14 1.14 0.01 0.00 -0.11 0.00 0.00 54.58 55.76 3g76 n ASN 280 Cb 0.47 -1.01 0.23 0.00 1.24 0.00 0.00 39.78 40.71 3g76 n ASN 280 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 3g76 h LYS 281 N 5.19 0.00 0.07 1.20 2.10 -1.90 -2.61 116.57 120.62 3g76 h LYS 281 Ca -0.47 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.18 3g76 h LYS 281 Cb 1.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 3g76 h LYS 281 CO 0.88 0.53 -0.03 0.93 -2.00 0.00 0.00 179.45 179.76 3g76 h GLU 282 N 0.00 -0.09 -0.22 0.07 3.07 -1.97 -3.19 114.58 112.24 3g76 h GLU 282 Ca -0.01 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.88 3g76 h GLU 282 Cb 1.03 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.95 3g76 h GLU 282 CO 0.07 0.48 0.15 1.96 -1.40 0.00 0.00 179.01 180.27 3g76 h GLN 283 N -0.79 0.20 0.02 2.33 4.20 -1.95 -0.52 115.11 118.61 3g76 h GLN 283 Ca -0.01 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 3g76 h GLN 283 Cb 0.61 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.35 3g76 h GLN 283 CO 0.02 0.13 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.23 3g76 h LEU 284 N 0.21 -0.02 -0.61 1.46 3.38 -1.57 -2.25 115.31 115.91 3g76 h LEU 284 Ca 0.09 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 3g76 h LEU 284 Cb 0.10 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3g76 h LEU 284 CO -0.02 0.31 0.32 0.00 0.09 0.00 0.00 178.44 179.15 3g76 h ALA 285 N 0.61 0.78 0.00 1.53 0.00 -1.42 0.12 119.26 120.88 3g76 h ALA 285 Ca -0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3g76 h ALA 285 Cb 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3g76 h ALA 285 CO 0.00 0.31 -0.17 -0.09 0.00 0.00 0.00 179.25 179.30 3g76 h ARG 286 N 0.83 0.00 -0.04 0.00 2.43 -1.13 -0.23 114.38 116.23 3g76 h ARG 286 Ca 0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3g76 h ARG 286 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3g76 h ARG 286 CO -0.03 0.17 0.00 0.00 -1.51 0.00 0.00 179.97 178.60 3g76 n ALA 287 N -2.44 2.61 -1.32 2.80 0.00 -0.85 -4.91 120.51 116.40 3g76 n ALA 287 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3g76 n ALA 287 Cb 0.25 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.41 3g76 n ALA 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g76 n GLY 288 N 1.04 1.01 3.56 0.00 0.00 -0.10 -4.89 105.19 105.81 3g76 n GLY 288 Ca 0.19 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 3g76 n GLY 288 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g76 s PHE 289 N -2.36 2.63 -0.02 1.61 0.08 0.42 -1.31 117.98 119.03 3g76 s PHE 289 Ca 0.00 -0.22 -0.08 0.00 0.12 0.00 0.00 56.93 56.75 3g76 s PHE 289 Cb 0.00 -1.32 0.01 0.00 -0.57 0.00 0.00 43.02 41.14 3g76 s PHE 289 CO 0.00 0.48 0.18 1.52 -0.10 0.00 0.00 175.22 177.30 3g76 s TYR 290 N -1.53 -0.06 0.04 0.36 -0.85 -1.00 -3.49 117.35 110.82 3g76 s TYR 290 Ca 0.23 0.11 -0.30 0.00 -0.52 0.00 0.00 57.07 56.59 3g76 s TYR 290 Cb -0.09 0.01 -0.04 0.00 0.38 0.00 0.00 41.96 42.21 3g76 s TYR 290 CO 0.14 -0.25 1.00 0.00 -1.52 0.00 0.00 175.55 174.91 3g76 s ALA 291 N -0.97 3.21 0.19 9.51 0.00 -1.26 -2.10 121.76 130.34 3g76 s ALA 291 Ca -0.11 0.59 0.09 0.00 0.00 0.00 0.00 51.96 52.53 3g76 s ALA 291 Cb -0.06 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 19.83 3g76 s ALA 291 CO 0.02 -0.19 1.46 -0.07 0.00 0.00 0.00 175.76 176.98 3g76 h LEU 292 N 6.39 0.00 0.00 0.00 -0.00 -1.39 -3.48 115.31 116.82 3g76 h LEU 292 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.46 3g76 h LEU 292 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 3g76 h LEU 292 CO 0.74 0.79 0.00 0.61 -0.00 0.00 0.00 178.44 180.58 3g76 n GLY 293 N 0.77 3.94 3.87 0.83 0.00 -1.26 -5.12 105.19 108.21 3g76 n GLY 293 Ca -0.01 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 3g76 n GLY 293 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g76 s GLU 294 N 0.00 3.86 0.00 1.61 8.01 -1.26 -5.01 118.70 125.90 3g76 s GLU 294 Ca 0.00 0.36 0.00 0.00 0.01 0.00 0.00 54.97 55.34 3g76 s GLU 294 Cb 0.00 -2.67 0.00 0.00 -4.31 0.00 0.00 34.13 27.15 3g76 s GLU 294 CO 0.00 0.32 0.00 0.41 0.01 0.00 0.00 175.26 176.00 3g76 n GLY 295 N -0.00 1.53 1.82 -1.39 0.00 -1.26 -1.98 105.19 103.91 3g76 n GLY 295 Ca -0.00 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 45.95 3g76 n GLY 295 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g76 n ASP 296 N -0.69 5.49 -4.62 1.61 5.68 -1.26 -4.98 116.55 117.78 3g76 n ASP 296 Ca 0.00 -2.83 -0.43 0.00 -0.50 0.00 0.00 54.79 51.03 3g76 n ASP 296 Cb 0.00 -0.67 -0.03 0.00 -1.14 0.00 0.00 41.12 39.29 3g76 n ASP 296 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3g76 s LYS 297 N -2.58 3.53 0.43 0.11 1.02 -0.84 -4.51 119.74 116.91 3g76 s LYS 297 Ca 0.53 1.77 0.06 0.00 0.02 0.00 0.00 55.97 58.35 3g76 s LYS 297 Cb 0.39 -4.18 -0.06 0.00 -0.52 0.00 0.00 37.83 33.46 3g76 s LYS 297 CO 0.17 -1.62 0.05 0.14 -0.92 0.00 0.00 175.35 173.16 3g76 s VAL 298 N 6.37 1.92 0.03 3.17 -7.23 -0.86 -0.97 120.40 122.83 3g76 s VAL 298 Ca 0.83 -1.94 -0.04 0.00 -1.81 0.00 0.00 61.98 59.02 3g76 s VAL 298 Cb -0.28 -2.85 -0.01 0.00 0.56 0.00 0.00 36.38 33.80 3g76 s VAL 298 CO 0.33 0.00 0.07 -0.54 -0.31 0.00 0.00 175.10 174.65 3g76 s LYS 299 N -3.78 0.54 -0.05 4.82 1.02 -0.89 -2.43 119.74 118.96 3g76 s LYS 299 Ca 0.31 -0.76 -0.25 0.00 0.02 0.00 0.00 55.97 55.30 3g76 s LYS 299 Cb 0.07 0.21 -0.03 0.00 -0.52 0.00 0.00 37.83 37.56 3g76 s LYS 299 CO 0.17 -0.13 0.77 0.00 -0.92 0.00 0.00 175.35 175.24 3g76 h PHE 301 N 6.79 0.00 0.00 0.00 -5.15 -1.50 0.36 116.94 117.44 3g76 h PHE 301 Ca -0.41 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 57.30 3g76 h PHE 301 Cb 1.20 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.36 3g76 h PHE 301 CO 0.66 0.11 -0.81 1.58 -2.00 0.00 0.00 178.31 177.84 3g76 n HIS 302 N -3.75 0.74 0.93 6.09 -0.00 -1.26 -1.25 115.22 116.71 3g76 n HIS 302 Ca -0.02 0.32 0.11 0.00 0.46 0.00 0.00 57.72 58.59 3g76 n HIS 302 Cb 0.22 -0.79 0.03 0.00 -0.12 0.00 0.00 29.99 29.33 3g76 n HIS 302 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3g76 n GLY 304 N 1.31 -0.27 3.58 0.00 0.00 0.13 -4.92 105.19 105.02 3g76 n GLY 304 Ca 0.10 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3g76 n GLY 304 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g76 s GLY 305 N -2.68 0.78 0.01 -0.02 0.00 -1.25 -4.50 107.32 99.67 3g76 s GLY 305 Ca 0.20 -0.24 -0.24 0.00 0.00 0.00 0.00 44.72 44.44 3g76 s GLY 305 CO 0.24 3.06 0.72 -0.32 0.00 0.00 0.00 173.10 176.80 3g76 s GLY 306 N 5.51 2.72 -0.07 0.20 0.00 -1.26 -1.45 107.32 112.97 3g76 s GLY 306 Ca 0.66 0.20 -0.05 0.00 0.00 0.00 0.00 44.72 45.53 3g76 s GLY 306 CO 0.29 1.03 0.18 1.08 0.00 0.00 0.00 173.10 175.69 3g76 s LEU 307 N 0.06 1.04 0.00 0.66 1.43 -1.02 -5.00 118.68 115.86 3g76 s LEU 307 Ca 0.37 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.84 3g76 s LEU 307 Cb -0.20 0.58 -0.00 0.00 0.03 0.00 0.00 46.19 46.60 3g76 s LEU 307 CO 0.21 -0.10 0.01 0.35 0.23 0.00 0.00 176.35 177.05 3g76 n THR 308 N 3.45 0.00 -2.81 5.49 -2.24 -1.26 -2.02 114.28 114.89 3g76 n THR 308 Ca -0.18 -0.13 -0.19 0.00 -2.27 0.00 0.00 64.05 61.28 3g76 n THR 308 Cb 0.56 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 3g76 n THR 308 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3g76 n ASP 309 N -2.52 -4.74 -4.74 3.42 10.43 -1.26 -4.92 116.55 112.23 3g76 n ASP 309 Ca 0.00 -0.10 -0.42 0.00 2.57 0.00 0.00 54.79 56.84 3g76 n ASP 309 Cb 0.03 -3.92 -0.02 0.00 1.84 0.00 0.00 41.12 39.05 3g76 n ASP 309 CO 0.00 0.00 0.00 0.79 -1.07 0.00 0.00 177.20 176.92 3g76 n TRP 310 N -3.91 2.82 -3.02 1.24 7.02 -1.26 -5.00 117.44 115.33 3g76 n TRP 310 Ca -0.12 0.26 -0.34 0.00 -1.02 0.00 0.00 57.50 56.28 3g76 n TRP 310 Cb 0.61 -2.59 -0.06 0.00 -2.42 0.00 0.00 31.31 26.84 3g76 n TRP 310 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 3g76 s LYS 311 N -0.50 4.16 0.00 -0.99 -0.14 -1.26 -4.93 119.74 116.08 3g76 s LYS 311 Ca 0.64 0.88 0.00 0.00 -1.36 0.00 0.00 55.97 56.13 3g76 s LYS 311 Cb -0.50 -2.50 0.00 0.00 -1.68 0.00 0.00 37.83 33.15 3g76 s LYS 311 CO 0.49 0.17 0.53 -0.35 -0.76 0.00 0.00 175.35 175.42 3g76 n PRO 312 N -0.13 0.00 0.00 -1.68 -0.04 -1.26 -1.68 135.00 130.22 3g76 n PRO 312 Ca 0.03 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 3g76 n PRO 312 Cb 0.53 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 3g76 n PRO 312 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3g76 n SER 313 N -1.03 0.06 -4.59 3.54 3.41 -1.26 -4.09 113.62 109.66 3g76 n SER 313 Ca 0.00 -0.92 -0.49 0.00 -0.26 0.00 0.00 58.87 57.20 3g76 n SER 313 Cb 0.07 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.97 3g76 n SER 313 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3g76 n GLU 314 N -0.00 1.72 -2.18 4.33 1.02 -0.67 -4.90 120.64 119.95 3g76 n GLU 314 Ca 0.00 0.56 -0.43 0.00 -0.02 0.00 0.00 57.16 57.27 3g76 n GLU 314 Cb 0.22 -2.66 -0.02 0.00 -0.02 0.00 0.00 31.44 28.95 3g76 n GLU 314 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3g76 s ASP 315 N 5.90 6.31 0.19 1.62 3.68 -1.26 -4.79 116.67 128.31 3g76 s ASP 315 Ca 1.00 1.34 -0.15 0.00 2.13 0.00 0.00 52.55 56.87 3g76 s ASP 315 Cb -0.70 -2.53 0.16 0.00 -1.45 0.00 0.00 42.92 38.40 3g76 s ASP 315 CO 0.49 -1.36 1.65 -0.65 0.13 0.00 0.00 175.17 175.43 3g76 h PRO 316 N 10.96 0.01 -0.73 4.34 0.11 -1.91 -1.58 132.00 143.21 3g76 h PRO 316 Ca -0.31 -0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.92 3g76 h PRO 316 Cb 1.14 -0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.11 3g76 h PRO 316 CO 1.03 0.01 -0.32 -1.49 -0.21 0.00 0.00 178.00 177.01 3g76 h TRP 317 N 0.01 -0.88 0.17 0.65 -0.00 -1.91 0.49 115.95 114.48 3g76 h TRP 317 Ca 0.24 0.08 0.02 0.00 -0.00 0.00 0.00 58.89 59.23 3g76 h TRP 317 Cb 0.37 0.49 -0.04 0.00 -0.00 0.00 0.00 29.16 29.99 3g76 h TRP 317 CO -0.41 -0.38 -0.39 1.49 -0.00 0.00 0.00 178.44 178.75 3g76 h GLU 318 N -0.09 -0.63 -0.81 0.49 4.81 -1.71 -2.00 114.58 114.64 3g76 h GLU 318 Ca 0.29 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.61 3g76 h GLU 318 Cb 0.57 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 30.04 3g76 h GLU 318 CO -0.78 -0.42 0.53 1.96 -0.73 0.00 0.00 179.01 179.57 3g76 h GLN 319 N -0.65 0.94 -0.01 1.92 1.08 -0.53 -0.70 115.11 117.16 3g76 h GLN 319 Ca 0.02 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.16 3g76 h GLN 319 Cb 0.66 -0.21 -0.00 0.00 -0.05 0.00 0.00 27.48 27.88 3g76 h GLN 319 CO -0.20 0.62 0.00 1.25 -0.95 0.00 0.00 178.83 179.56 3g76 h HIS 320 N 0.96 0.01 0.55 2.96 2.76 0.14 -0.34 115.15 122.19 3g76 h HIS 320 Ca 0.33 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.48 3g76 h HIS 320 Cb 0.10 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.05 3g76 h HIS 320 CO -0.00 0.12 -0.42 0.00 -1.30 0.00 0.00 177.93 176.33 3g76 h ALA 321 N 0.89 -1.15 -0.99 5.26 0.00 -0.93 -0.78 119.26 121.56 3g76 h ALA 321 Ca 0.00 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.87 3g76 h ALA 321 Cb 0.11 0.59 -0.15 0.00 0.00 0.00 0.00 17.79 18.34 3g76 h ALA 321 CO -0.00 -1.15 -0.42 1.17 0.00 0.00 0.00 179.25 178.85 3g76 n LYS 322 N -4.99 -0.27 0.01 0.00 4.81 -0.31 -2.53 118.16 114.88 3g76 n LYS 322 Ca -0.11 1.52 -0.05 0.00 -0.87 0.00 0.00 58.31 58.79 3g76 n LYS 322 Cb 0.40 -2.25 -0.11 0.00 0.02 0.00 0.00 35.03 33.09 3g76 n LYS 322 CO 0.00 0.00 0.00 -1.49 1.17 0.00 0.00 177.40 177.08 3g76 h TRP 323 N 0.00 0.00 -2.04 5.64 4.06 -0.93 -3.40 115.95 119.28 3g76 h TRP 323 Ca 0.31 0.00 -0.55 0.00 2.06 0.00 0.00 58.89 60.71 3g76 h TRP 323 Cb 0.56 0.00 -0.40 0.00 -1.00 0.00 0.00 29.16 28.32 3g76 h TRP 323 CO -0.90 0.83 -1.05 0.66 -3.56 0.00 0.00 178.44 174.43 3g76 n TYR 324 N -3.01 0.48 0.18 0.49 4.02 -0.31 -4.99 117.16 114.03 3g76 n TYR 324 Ca -0.13 -3.72 0.12 0.00 -0.01 0.00 0.00 57.90 54.16 3g76 n TYR 324 Cb 0.96 -0.40 0.63 0.00 -0.02 0.00 0.00 39.34 40.51 3g76 n TYR 324 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 3g76 h PRO 325 N 3.71 0.00 -0.02 -0.72 0.11 -1.65 -1.90 132.00 131.52 3g76 h PRO 325 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3g76 h PRO 325 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3g76 h PRO 325 CO 0.53 0.00 -0.14 0.41 -0.21 0.00 0.00 178.00 178.59 3g76 n GLY 326 N -1.23 0.33 3.65 -0.55 0.00 -1.26 -4.91 105.19 101.22 3g76 n GLY 326 Ca -0.01 -0.58 -0.48 0.00 0.00 0.00 0.00 46.02 44.94 3g76 n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g76 h LYS 328 N 10.14 0.31 0.07 0.00 1.63 -1.92 0.54 116.57 127.34 3g76 h LYS 328 Ca -0.45 -0.14 0.02 0.00 -0.85 0.00 0.00 60.65 59.22 3g76 h LYS 328 Cb 1.28 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.88 3g76 h LYS 328 CO 0.96 0.66 -0.17 -0.92 -3.45 0.00 0.00 179.45 176.53 3g76 h TYR 329 N 0.26 -0.44 -0.46 1.91 3.20 -1.93 0.86 116.97 120.36 3g76 h TYR 329 Ca 0.03 0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.99 3g76 h TYR 329 Cb 0.81 0.19 -0.07 0.00 1.54 0.00 0.00 36.73 39.20 3g76 h TYR 329 CO 0.02 -0.25 0.02 1.25 -1.64 0.00 0.00 178.16 177.56 3g76 h LEU 330 N -0.31 -0.16 0.03 2.82 5.85 -1.84 0.22 115.31 121.92 3g76 h LEU 330 Ca 0.03 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.88 3g76 h LEU 330 Cb 0.35 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 3g76 h LEU 330 CO -0.11 -0.04 -0.18 0.25 -0.34 0.00 0.00 178.44 178.01 3g76 h LEU 331 N 0.13 -0.52 -0.79 2.25 6.46 -0.15 -1.41 115.31 121.29 3g76 h LEU 331 Ca 0.23 0.07 0.05 0.00 -0.12 0.00 0.00 57.88 58.11 3g76 h LEU 331 Cb 0.33 0.21 -0.05 0.00 -0.73 0.00 0.00 40.66 40.42 3g76 h LEU 331 CO -0.37 -0.25 0.49 -0.08 -0.62 0.00 0.00 178.44 177.61 3g76 h GLU 332 N -0.31 0.90 0.00 1.25 4.81 0.14 -0.86 114.58 120.51 3g76 h GLU 332 Ca 0.05 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3g76 h GLU 332 Cb 0.37 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.54 3g76 h GLU 332 CO -0.15 0.59 -0.23 1.96 -0.73 0.00 0.00 179.01 180.45 3g76 h GLN 333 N 0.92 0.00 0.00 1.92 1.08 -0.37 -3.41 115.11 115.25 3g76 h GLN 333 Ca 0.33 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 3g76 h GLN 333 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 3g76 h GLN 333 CO -0.14 0.00 -0.58 1.63 -0.95 0.00 0.00 178.83 178.79 3g76 n LYS 334 N -2.37 2.00 0.00 1.46 4.76 -0.55 -5.08 118.16 118.38 3g76 n LYS 334 Ca 0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 3g76 n LYS 334 Cb 0.45 -0.79 0.00 0.00 -1.84 0.00 0.00 35.03 32.86 3g76 n LYS 334 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3g76 n GLY 335 N 2.05 -1.15 0.34 0.72 0.00 -0.34 -4.33 105.19 102.48 3g76 n GLY 335 Ca 0.00 -1.22 0.17 0.00 0.00 0.00 0.00 46.02 44.97 3g76 n GLY 335 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g76 h GLN 336 N 0.00 0.00 -0.73 1.61 1.08 -1.93 0.21 115.11 115.35 3g76 h GLN 336 Ca 0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 3g76 h GLN 336 Cb 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.40 3g76 h GLN 336 CO 0.00 0.00 0.27 1.49 -0.95 0.00 0.00 178.83 179.64 3g76 h GLU 337 N 0.00 1.11 0.17 1.46 4.81 -1.98 -1.44 114.58 118.70 3g76 h GLU 337 Ca 0.11 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 3g76 h GLU 337 Cb 0.60 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 3g76 h GLU 337 CO -0.00 0.92 -0.26 -0.92 -0.73 0.00 0.00 179.01 178.02 3g76 h TYR 338 N 1.06 -0.73 -0.88 0.92 3.20 -0.77 0.33 116.97 120.11 3g76 h TYR 338 Ca 0.24 0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.31 3g76 h TYR 338 Cb 0.24 0.30 -0.16 0.00 1.54 0.00 0.00 36.73 38.64 3g76 h TYR 338 CO 0.02 -0.32 -0.16 0.82 -1.64 0.00 0.00 178.16 176.88 3g76 h ILE 339 N -0.45 0.14 -0.17 1.81 2.04 -1.50 -0.51 117.51 118.88 3g76 h ILE 339 Ca -0.02 -0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 3g76 h ILE 339 Cb 0.41 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 3g76 h ILE 339 CO -0.08 0.00 0.09 0.78 0.00 0.00 0.00 178.15 178.94 3g76 h ASN 340 N 0.01 0.21 0.30 1.72 2.35 -0.76 -2.89 115.58 116.52 3g76 h ASN 340 Ca 0.44 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 56.08 3g76 h ASN 340 Cb 0.73 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 39.04 3g76 h ASN 340 CO -0.87 0.23 -0.13 0.78 -1.65 0.00 0.00 177.43 175.79 3g76 h ASN 341 N 0.17 0.00 -0.39 5.81 4.21 0.12 0.14 115.58 125.64 3g76 h ASN 341 Ca 0.06 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.47 3g76 h ASN 341 Cb 0.07 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.26 3g76 h ASN 341 CO -0.01 0.13 -0.15 0.40 -1.29 0.00 0.00 177.43 176.51 3g76 h ILE 342 N 0.00 1.28 0.01 2.81 1.08 -1.08 -2.68 117.51 118.93 3g76 h ILE 342 Ca -0.00 -1.26 -0.20 0.00 -0.39 0.00 0.00 64.86 63.00 3g76 h ILE 342 Cb 0.31 1.29 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 3g76 h ILE 342 CO 0.02 0.42 -0.90 0.45 -0.69 0.00 0.00 178.15 177.45 3g76 h HIS 343 N 0.58 0.29 -0.48 1.37 3.86 -1.07 -3.14 115.15 116.57 3g76 h HIS 343 Ca 0.09 -0.16 -0.08 0.00 -1.16 0.00 0.00 60.37 59.06 3g76 h HIS 343 Cb 0.69 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 3g76 h HIS 343 CO 0.05 0.99 -0.01 1.25 0.86 0.00 0.00 177.93 181.07 3g76 h LEU 344 N 0.10 0.78 -1.73 2.43 5.85 -0.81 -2.42 115.31 119.51 3g76 h LEU 344 Ca -0.05 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 3g76 h LEU 344 Cb 1.54 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.36 3g76 h LEU 344 CO 0.14 0.86 -0.16 0.71 -0.34 0.00 0.00 178.44 179.64 3g76 h THR 345 N 0.76 0.68 -2.94 1.05 1.35 -1.47 -3.44 112.91 108.90 3g76 h THR 345 Ca 0.14 -0.68 -0.52 0.00 -0.55 0.00 0.00 66.41 64.80 3g76 h THR 345 Cb 0.47 1.43 0.06 0.00 -1.73 0.00 0.00 68.15 68.39 3g76 h THR 345 CO 0.02 0.16 0.94 -2.28 -0.25 0.00 0.00 175.52 174.11 3g76 s HIS 346 N -4.16 2.88 0.00 4.73 5.65 -0.91 -5.12 115.29 118.35 3g76 s HIS 346 Ca -0.02 0.55 0.00 0.00 0.25 0.00 0.00 55.06 55.84 3g76 s HIS 346 Cb 0.13 -4.07 0.00 0.00 -1.18 0.00 0.00 32.58 27.46 3g76 s HIS 346 CO 0.61 -3.89 0.22 -1.13 -0.65 0.00 0.00 174.74 169.90