#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 0.00 -0.33 0.44 2.01 -1.26 -5.15 115.64 111.35 3g76 s THR 254 Ca 0.00 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.99 3g76 s THR 254 Cb 0.00 -1.00 0.13 0.00 0.01 0.00 0.00 72.50 71.64 3g76 s THR 254 CO 0.00 0.00 0.21 0.21 -0.69 0.00 0.00 174.62 174.35 3g76 s ASN 255 N 1.54 2.85 0.15 3.53 2.47 -1.26 -5.14 114.94 119.08 3g76 s ASN 255 Ca -0.09 -1.72 0.06 0.00 0.42 0.00 0.00 52.86 51.53 3g76 s ASN 255 Cb -0.05 -0.20 -0.04 0.00 -1.45 0.00 0.00 41.25 39.51 3g76 s ASN 255 CO -0.18 -0.35 -0.13 -0.76 -3.72 0.00 0.00 177.10 171.95 3g76 s LEU 256 N 1.54 2.48 0.22 3.21 1.43 -1.26 -5.12 118.68 121.19 3g76 s LEU 256 Ca 0.14 -0.93 -0.31 0.00 -1.03 0.00 0.00 54.13 52.01 3g76 s LEU 256 Cb -0.19 -0.53 -0.11 0.00 0.03 0.00 0.00 46.19 45.40 3g76 s LEU 256 CO -0.14 -0.21 1.55 -2.16 0.23 0.00 0.00 176.35 175.62 3g76 s PRO 257 N -3.26 4.20 0.34 1.29 0.04 -1.26 -4.92 135.00 131.44 3g76 s PRO 257 Ca 0.15 2.41 0.26 0.00 0.04 0.00 0.00 61.00 63.86 3g76 s PRO 257 Cb -0.02 -3.10 1.19 0.00 0.04 0.00 0.00 34.50 32.61 3g76 s PRO 257 CO 0.03 -0.57 1.78 0.00 0.04 0.00 0.00 177.00 178.28 3g76 h ARG 258 N 5.84 0.00 -1.90 4.56 3.08 -1.05 -3.34 114.38 121.57 3g76 h ARG 258 Ca -0.45 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.16 3g76 h ARG 258 Cb 1.21 0.00 -0.31 0.00 0.08 0.00 0.00 29.97 30.95 3g76 h ARG 258 CO 0.85 0.00 -0.82 -1.71 -1.07 0.00 0.00 179.97 177.22 3g76 n ASN 259 N -2.41 -1.44 -0.09 7.04 2.85 -0.49 -4.97 115.26 115.75 3g76 n ASN 259 Ca 0.00 -2.56 0.10 0.00 -0.11 0.00 0.00 54.58 52.02 3g76 n ASN 259 Cb 0.17 0.20 0.47 0.00 1.24 0.00 0.00 39.78 41.85 3g76 n ASN 259 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3g76 h PRO 260 N 5.37 0.47 -1.22 1.20 0.11 -1.77 0.64 132.00 136.80 3g76 h PRO 260 Ca 0.19 -0.03 0.35 0.00 0.11 0.00 0.00 66.00 66.62 3g76 h PRO 260 Cb 0.97 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 31.90 3g76 h PRO 260 CO 0.26 0.31 0.83 1.03 -0.21 0.00 0.00 178.00 180.22 3g76 h SER 261 N 0.48 0.19 -0.44 -2.05 0.87 -1.94 0.28 113.55 110.94 3g76 h SER 261 Ca 0.27 0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.79 3g76 h SER 261 Cb 0.45 0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 62.38 3g76 h SER 261 CO -0.08 0.00 0.07 0.23 -0.53 0.00 0.00 176.83 176.52 3g76 n MET 262 N -4.39 3.12 0.15 2.24 2.81 0.20 -4.54 117.12 116.71 3g76 n MET 262 Ca 0.29 -3.00 0.00 0.00 -1.81 0.00 0.00 57.70 53.18 3g76 n MET 262 Cb 1.21 -1.98 0.20 0.00 -0.71 0.00 0.00 33.22 31.93 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 2.08 0.96 -2.33 3.04 0.00 -0.27 -3.44 119.26 119.29 3g76 h ALA 263 Ca 0.12 -0.52 -0.51 0.00 0.00 0.00 0.00 54.91 54.00 3g76 h ALA 263 Cb 1.79 -0.09 0.11 0.00 0.00 0.00 0.00 17.79 19.59 3g76 h ALA 263 CO 0.42 0.71 0.35 -0.51 0.00 0.00 0.00 179.25 180.22 3g76 s ASP 264 N -6.74 5.01 -0.04 0.00 1.11 -1.26 -4.97 116.67 109.78 3g76 s ASP 264 Ca -0.01 1.67 -0.06 0.00 0.18 0.00 0.00 52.55 54.33 3g76 s ASP 264 Cb 0.12 -2.48 -0.28 0.00 1.07 0.00 0.00 42.92 41.35 3g76 s ASP 264 CO 0.75 -1.69 0.69 0.22 1.18 0.00 0.00 175.17 176.31 3g76 h TYR 265 N -0.89 0.54 -0.38 4.23 3.20 -1.93 -3.26 116.97 118.48 3g76 h TYR 265 Ca -0.44 -0.40 -0.04 0.00 3.14 0.00 0.00 58.73 60.99 3g76 h TYR 265 Cb 1.22 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 3g76 h TYR 265 CO 0.60 1.55 0.07 0.93 -1.64 0.00 0.00 178.16 179.66 3g76 h GLU 266 N 0.08 0.58 0.00 1.82 3.07 -1.97 0.22 114.58 118.37 3g76 h GLU 266 Ca -0.32 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 58.41 3g76 h GLU 266 Cb 2.06 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 29.87 3g76 h GLU 266 CO 0.15 0.55 -0.15 0.00 -1.40 0.00 0.00 179.01 178.17 3g76 h ALA 267 N 1.52 1.74 0.00 3.43 0.00 -1.91 -3.07 119.26 120.97 3g76 h ALA 267 Ca 0.13 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 3g76 h ALA 267 Cb 0.26 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3g76 h ALA 267 CO 0.00 0.18 -1.18 0.00 0.00 0.00 0.00 179.25 178.25 3g76 h ARG 268 N 0.00 0.00 0.00 0.00 3.08 -0.71 -3.33 114.38 113.42 3g76 h ARG 268 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g76 h ARG 268 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3g76 h ARG 268 CO 0.02 0.96 0.00 -0.84 -1.07 0.00 0.00 179.97 179.04 3g76 h ILE 269 N -1.00 0.00 -0.73 2.04 -0.00 -1.13 0.30 117.51 116.99 3g76 h ILE 269 Ca -0.32 -0.06 -0.06 0.00 -0.00 0.00 0.00 64.86 64.42 3g76 h ILE 269 Cb 1.26 0.75 -0.03 0.00 -0.00 0.00 0.00 36.82 38.80 3g76 h ILE 269 CO -0.19 0.00 0.23 0.15 -0.00 0.00 0.00 178.15 178.34 3g76 h PHE 270 N 0.00 1.17 -0.62 0.16 3.57 -1.64 -2.63 116.94 116.95 3g76 h PHE 270 Ca 0.00 -0.11 0.02 0.00 3.53 0.00 0.00 57.97 61.40 3g76 h PHE 270 Cb 0.07 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 38.44 3g76 h PHE 270 CO 0.00 0.92 0.41 1.79 -2.23 0.00 0.00 178.31 179.20 3g76 h THR 271 N 1.09 1.13 -0.37 4.41 1.35 -1.04 -1.71 112.91 117.77 3g76 h THR 271 Ca 0.24 -0.27 -0.17 0.00 -0.55 0.00 0.00 66.41 65.65 3g76 h THR 271 Cb 0.29 0.26 -0.10 0.00 -1.73 0.00 0.00 68.15 66.87 3g76 h THR 271 CO -0.01 0.15 0.22 0.49 -0.25 0.00 0.00 175.52 176.12 3g76 n PHE 272 N -4.45 1.15 0.32 4.73 3.01 -0.99 -4.24 117.46 116.99 3g76 n PHE 272 Ca 0.07 -0.92 0.14 0.00 1.01 0.00 0.00 57.45 57.75 3g76 n PHE 272 Cb 0.08 -0.49 0.62 0.00 -0.01 0.00 0.00 39.48 39.68 3g76 n PHE 272 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3g76 h GLY 273 N 3.08 0.00 -4.57 1.37 0.00 -1.32 -3.01 103.07 98.62 3g76 h GLY 273 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.17 3g76 h GLY 273 CO 0.40 0.00 -0.97 -0.37 0.00 0.00 0.00 176.54 175.60 3g76 n THR 274 N -2.55 1.84 -2.77 4.70 5.66 -1.26 -5.06 114.28 114.84 3g76 n THR 274 Ca 0.01 -3.49 -0.43 0.00 -3.05 0.00 0.00 64.05 57.09 3g76 n THR 274 Cb 0.21 0.17 -0.04 0.00 -1.55 0.00 0.00 70.33 69.12 3g76 n THR 274 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 3g76 s TRP 275 N -3.65 2.68 -2.32 1.09 -0.11 -1.14 -4.87 118.94 110.62 3g76 s TRP 275 Ca 0.38 -0.08 0.21 0.00 1.22 0.00 0.00 56.10 57.84 3g76 s TRP 275 Cb 0.36 -4.24 0.72 0.00 -1.50 0.00 0.00 33.47 28.81 3g76 s TRP 275 CO -0.01 -1.53 1.53 0.44 -4.62 0.00 0.00 176.95 172.77 3g76 n ILE 276 N 6.22 0.23 -3.56 5.86 -5.35 -1.26 -4.93 119.36 116.57 3g76 n ILE 276 Ca 0.02 -0.39 -0.23 0.00 -0.27 0.00 0.00 62.75 61.87 3g76 n ILE 276 Cb 0.47 0.46 -0.02 0.00 -1.74 0.00 0.00 39.64 38.82 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 -1.77 3.49 -0.02 4.28 1.51 -1.26 -5.03 117.35 118.54 3g76 s TYR 277 Ca 0.33 0.26 -0.24 0.00 -1.01 0.00 0.00 57.07 56.40 3g76 s TYR 277 Cb 0.18 -1.81 -0.18 0.00 -0.11 0.00 0.00 41.96 40.04 3g76 s TYR 277 CO 0.27 0.23 1.18 0.66 -1.11 0.00 0.00 175.55 176.78 3g76 h SER 278 N 0.98 -0.15 -0.22 2.29 4.64 -1.92 -3.44 113.55 115.73 3g76 h SER 278 Ca -0.50 -0.35 -0.65 0.00 -0.47 0.00 0.00 61.79 59.83 3g76 h SER 278 Cb 1.22 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.33 3g76 h SER 278 CO 0.62 0.30 0.92 0.52 -0.87 0.00 0.00 176.83 178.32 3g76 n VAL 279 N -4.96 0.00 -1.66 0.95 0.31 -1.26 -4.67 118.33 107.04 3g76 n VAL 279 Ca -0.09 0.00 -0.50 0.00 -0.01 0.00 0.00 64.34 63.74 3g76 n VAL 279 Cb 0.25 -0.40 -0.05 0.00 -0.91 0.00 0.00 33.84 32.73 3g76 n VAL 279 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3g76 n ASN 280 N 5.27 2.65 0.12 4.52 2.85 -1.26 -4.88 115.26 124.53 3g76 n ASN 280 Ca 0.39 1.07 -0.02 0.00 -0.11 0.00 0.00 54.58 55.90 3g76 n ASN 280 Cb -0.04 -1.30 0.18 0.00 1.24 0.00 0.00 39.78 39.87 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 6.53 0.11 -0.12 1.20 2.10 -1.89 -2.83 116.57 121.67 3g76 h LYS 281 Ca -0.47 -0.07 -0.07 0.00 -2.00 0.00 0.00 60.65 58.05 3g76 h LYS 281 Cb 1.29 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.63 3g76 h LYS 281 CO 0.88 0.64 -0.18 0.93 -2.00 0.00 0.00 179.45 179.72 3g76 h GLU 282 N 0.08 0.34 0.17 0.07 3.07 -1.98 -1.45 114.58 114.88 3g76 h GLU 282 Ca -0.00 -0.20 0.01 0.00 -0.50 0.00 0.00 59.36 58.67 3g76 h GLU 282 Cb 1.01 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.91 3g76 h GLU 282 CO 0.08 0.78 -0.25 1.96 -1.40 0.00 0.00 179.01 180.17 3g76 h GLN 283 N -0.07 -0.47 -0.22 2.33 4.20 -1.95 0.24 115.11 119.17 3g76 h GLN 283 Ca 0.01 0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.81 3g76 h GLN 283 Cb 0.75 0.11 -0.06 0.00 0.30 0.00 0.00 27.48 28.58 3g76 h GLN 283 CO 0.04 -0.32 -0.14 -0.07 -0.67 0.00 0.00 178.83 177.67 3g76 h LEU 284 N -0.49 -0.46 -0.70 1.46 3.38 -1.58 -0.13 115.31 116.78 3g76 h LEU 284 Ca 0.02 0.10 0.13 0.00 0.09 0.00 0.00 57.88 58.22 3g76 h LEU 284 Cb 0.49 0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.39 3g76 h LEU 284 CO -0.11 -0.18 0.22 0.00 0.09 0.00 0.00 178.44 178.46 3g76 h ALA 285 N 1.02 0.92 0.00 1.53 0.00 -0.85 -0.41 119.26 121.48 3g76 h ALA 285 Ca 0.12 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 3g76 h ALA 285 Cb 0.32 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3g76 h ALA 285 CO -0.30 -0.26 -0.41 0.00 0.00 0.00 0.00 179.25 178.27 3g76 h ARG 286 N 0.35 0.00 0.00 0.00 3.08 0.23 -3.02 114.38 115.03 3g76 h ARG 286 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 3g76 h ARG 286 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3g76 h ARG 286 CO -0.42 0.41 0.00 0.00 -1.07 0.00 0.00 179.97 178.89 3g76 n ALA 287 N -2.37 2.51 -0.08 0.04 0.00 -0.13 -4.80 120.51 115.68 3g76 n ALA 287 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3g76 n ALA 287 Cb 0.49 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 0.67 0.94 3.89 0.00 0.00 -1.14 -4.91 105.19 104.64 3g76 n GLY 288 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.01 3.56 0.00 1.61 0.08 -0.33 -0.44 117.98 120.47 3g76 s PHE 289 Ca 0.00 0.46 0.00 0.00 0.12 0.00 0.00 56.93 57.51 3g76 s PHE 289 Cb 0.00 -1.90 -0.00 0.00 -0.57 0.00 0.00 43.02 40.54 3g76 s PHE 289 CO 0.00 0.64 -0.02 1.52 -0.10 0.00 0.00 175.22 177.26 3g76 s TYR 290 N -1.29 0.15 1.09 0.36 -0.85 -0.74 -3.71 117.35 112.36 3g76 s TYR 290 Ca 0.26 -0.09 -0.15 0.00 -0.52 0.00 0.00 57.07 56.58 3g76 s TYR 290 Cb -0.13 -0.10 0.23 0.00 0.38 0.00 0.00 41.96 42.35 3g76 s TYR 290 CO 0.16 -0.02 1.09 0.00 -1.52 0.00 0.00 175.55 175.26 3g76 s ALA 291 N -0.22 0.68 0.00 9.51 0.00 -1.26 -2.05 121.76 128.43 3g76 s ALA 291 Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.39 3g76 s ALA 291 Cb -0.02 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.06 3g76 s ALA 291 CO -0.00 -3.20 0.44 1.28 0.00 0.00 0.00 175.76 174.28 3g76 n LEU 292 N -4.45 0.69 0.00 0.00 4.77 -0.83 -4.80 117.00 112.37 3g76 n LEU 292 Ca 0.07 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 3g76 n LEU 292 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 3g76 n LEU 292 CO 0.54 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 3g76 n GLY 293 N -0.10 2.57 3.72 -0.72 0.00 -1.26 -5.01 105.19 104.38 3g76 n GLY 293 Ca 0.00 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 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 4.47 0.00 1.61 8.01 -1.26 -4.92 118.70 126.61 3g76 s GLU 294 Ca 0.00 1.71 0.00 0.00 0.01 0.00 0.00 54.97 56.69 3g76 s GLU 294 Cb 0.00 -3.35 0.00 0.00 -4.31 0.00 0.00 34.13 26.47 3g76 s GLU 294 CO 0.00 -0.19 0.00 0.41 0.01 0.00 0.00 175.26 175.49 3g76 n GLY 295 N 3.02 0.24 1.51 -1.39 0.00 -1.26 -0.38 105.19 106.92 3g76 n GLY 295 Ca 0.08 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.21 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 0.19 4.88 -4.67 1.61 5.68 -1.26 -4.92 116.55 118.07 3g76 n ASP 296 Ca 0.00 -2.75 -0.46 0.00 -0.50 0.00 0.00 54.79 51.09 3g76 n ASP 296 Cb 0.00 -0.60 -0.04 0.00 -1.14 0.00 0.00 41.12 39.34 3g76 n ASP 296 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3g76 n LYS 297 N 0.53 2.14 -3.79 0.11 5.02 0.49 -4.64 118.16 118.00 3g76 n LYS 297 Ca 0.25 0.77 -0.13 0.00 -2.02 0.00 0.00 58.31 57.18 3g76 n LYS 297 Cb 0.99 -2.53 -0.10 0.00 -0.02 0.00 0.00 35.03 33.38 3g76 n LYS 297 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3g76 s VAL 298 N 0.82 0.04 0.18 -0.18 -7.23 -0.97 -1.97 120.40 111.09 3g76 s VAL 298 Ca 0.78 -0.36 0.11 0.00 -1.81 0.00 0.00 61.98 60.70 3g76 s VAL 298 Cb -0.68 -0.49 -0.04 0.00 0.56 0.00 0.00 36.38 35.73 3g76 s VAL 298 CO 0.39 -0.20 -0.25 -0.54 -0.31 0.00 0.00 175.10 174.19 3g76 s LYS 299 N -0.82 1.49 0.10 4.82 1.02 -0.87 -0.31 119.74 125.17 3g76 s LYS 299 Ca -0.09 -1.49 -0.25 0.00 0.02 0.00 0.00 55.97 54.16 3g76 s LYS 299 Cb -0.05 -1.86 -0.07 0.00 -0.52 0.00 0.00 37.83 35.34 3g76 s LYS 299 CO 0.02 0.41 0.77 0.00 -0.92 0.00 0.00 175.35 175.63 3g76 n PHE 301 N 2.27 0.88 -0.08 0.00 1.16 0.42 -1.77 117.46 120.34 3g76 n PHE 301 Ca -0.04 0.33 -0.16 0.00 -1.87 0.00 0.00 57.45 55.71 3g76 n PHE 301 Cb 0.50 -1.03 -0.05 0.00 -1.61 0.00 0.00 39.48 37.28 3g76 n PHE 301 CO 0.00 0.00 0.00 1.58 -1.87 0.00 0.00 176.76 176.47 3g76 n HIS 302 N -2.28 0.00 1.17 2.97 -0.00 -1.26 -1.39 115.22 114.42 3g76 n HIS 302 Ca 0.03 0.00 0.13 0.00 0.46 0.00 0.00 57.72 58.33 3g76 n HIS 302 Cb 0.27 -0.57 0.24 0.00 -0.12 0.00 0.00 29.99 29.81 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 1.30 1.45 3.79 0.00 0.00 -0.73 -4.98 105.19 106.01 3g76 n GLY 304 Ca 0.15 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.70 2.79 -0.02 -0.02 0.00 -1.26 -4.69 107.32 101.42 3g76 s GLY 305 Ca 0.00 0.43 0.06 0.00 0.00 0.00 0.00 44.72 45.21 3g76 s GLY 305 CO 0.00 0.87 -0.20 -0.32 0.00 0.00 0.00 173.10 173.45 3g76 s GLY 306 N -1.56 0.97 -0.03 0.20 0.00 -1.26 0.22 107.32 105.88 3g76 s GLY 306 Ca 0.47 -0.84 0.05 0.00 0.00 0.00 0.00 44.72 44.40 3g76 s GLY 306 CO 0.24 -0.66 -0.16 1.08 0.00 0.00 0.00 173.10 173.59 3g76 s LEU 307 N -0.39 1.97 0.34 0.66 1.43 0.58 -4.95 118.68 118.32 3g76 s LEU 307 Ca 0.06 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 52.88 3g76 s LEU 307 Cb -0.08 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.21 3g76 s LEU 307 CO -0.00 0.18 0.13 0.42 0.23 0.00 0.00 176.35 177.31 3g76 s THR 308 N -0.20 0.58 -1.33 5.49 -4.23 -1.26 -2.29 115.64 112.40 3g76 s THR 308 Ca 0.02 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.48 3g76 s THR 308 Cb -0.09 -2.50 0.02 0.00 1.34 0.00 0.00 72.50 71.27 3g76 s THR 308 CO 0.00 0.00 0.99 0.47 -0.54 0.00 0.00 174.62 175.54 3g76 n ASP 309 N -1.02 -3.64 -4.32 3.99 10.43 -1.26 -4.97 116.55 115.76 3g76 n ASP 309 Ca -0.02 -0.67 -0.32 0.00 2.57 0.00 0.00 54.79 56.35 3g76 n ASP 309 Cb 0.65 -4.64 0.18 0.00 1.84 0.00 0.00 41.12 39.15 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 -4.53 -1.38 -4.17 1.24 7.02 -1.26 -5.05 117.44 109.31 3g76 n TRP 310 Ca -0.14 0.12 -0.29 0.00 -1.02 0.00 0.00 57.50 56.17 3g76 n TRP 310 Cb 0.61 -1.62 -0.08 0.00 -2.42 0.00 0.00 31.31 27.80 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 -3.60 2.41 0.40 -0.99 -0.14 -1.26 -5.03 119.74 111.54 3g76 s LYS 311 Ca 0.58 -0.97 0.10 0.00 -1.36 0.00 0.00 55.97 54.31 3g76 s LYS 311 Cb -0.15 -2.43 0.83 0.00 -1.68 0.00 0.00 37.83 34.41 3g76 s LYS 311 CO 0.66 0.50 1.96 -1.35 -0.76 0.00 0.00 175.35 176.36 3g76 h PRO 312 N 3.20 0.27 0.00 -1.68 0.11 -1.96 -2.70 132.00 129.24 3g76 h PRO 312 Ca -0.48 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.42 3g76 h PRO 312 Cb 1.18 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 3g76 h PRO 312 CO 0.58 0.35 -1.15 0.66 -0.21 0.00 0.00 178.00 178.23 3g76 h SER 313 N 0.27 0.00 -2.73 -2.05 4.64 -1.96 -3.39 113.55 108.32 3g76 h SER 313 Ca 0.06 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.79 3g76 h SER 313 Cb 0.27 0.00 0.17 0.00 -0.31 0.00 0.00 62.40 62.53 3g76 h SER 313 CO 0.01 0.63 -0.54 -0.62 -0.87 0.00 0.00 176.83 175.45 3g76 n GLU 314 N -3.04 0.42 -3.92 4.77 1.02 -1.02 -4.98 120.64 113.89 3g76 n GLU 314 Ca -0.06 0.16 -0.36 0.00 -0.02 0.00 0.00 57.16 56.89 3g76 n GLU 314 Cb 0.84 -1.55 -0.12 0.00 -0.02 0.00 0.00 31.44 30.58 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 -1.12 5.02 0.54 1.62 3.68 -1.26 -4.88 116.67 120.27 3g76 s ASP 315 Ca 0.66 -0.18 0.23 0.00 2.13 0.00 0.00 52.55 55.39 3g76 s ASP 315 Cb -0.47 -1.88 1.41 0.00 -1.45 0.00 0.00 42.92 40.53 3g76 s ASP 315 CO 0.57 0.03 2.06 -0.65 0.13 0.00 0.00 175.17 177.31 3g76 h PRO 316 N 7.77 0.00 0.12 4.34 0.11 -1.94 -2.25 132.00 140.16 3g76 h PRO 316 Ca -0.37 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.57 3g76 h PRO 316 Cb 1.18 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.30 3g76 h PRO 316 CO 0.60 0.00 -0.73 -1.49 -0.21 0.00 0.00 178.00 176.18 3g76 h TRP 317 N 0.00 0.49 -0.60 0.65 -0.00 -1.94 -2.93 115.95 111.62 3g76 h TRP 317 Ca 0.14 -0.36 -0.00 0.00 -0.00 0.00 0.00 58.89 58.67 3g76 h TRP 317 Cb 0.60 -0.02 -0.03 0.00 -0.00 0.00 0.00 29.16 29.71 3g76 h TRP 317 CO 0.00 1.27 0.36 0.93 -0.00 0.00 0.00 178.44 181.00 3g76 h GLU 318 N -0.42 0.82 -0.20 0.49 5.08 -1.91 -2.61 114.58 115.82 3g76 h GLU 318 Ca -0.13 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 3g76 h GLU 318 Cb 1.57 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 3g76 h GLU 318 CO 0.14 0.59 0.07 1.96 -1.00 0.00 0.00 179.01 180.77 3g76 h GLN 319 N 0.81 0.31 -0.42 2.33 1.08 -1.55 0.19 115.11 117.86 3g76 h GLN 319 Ca 0.22 -0.07 0.08 0.00 -1.45 0.00 0.00 58.65 57.43 3g76 h GLN 319 Cb -0.01 -0.05 -0.09 0.00 -0.05 0.00 0.00 27.48 27.28 3g76 h GLN 319 CO -0.04 0.41 -0.32 1.25 -0.95 0.00 0.00 178.83 179.17 3g76 h HIS 320 N 0.16 -0.90 -0.00 2.96 2.76 -1.36 -0.85 115.15 117.91 3g76 h HIS 320 Ca 0.07 0.06 -0.13 0.00 -2.20 0.00 0.00 60.37 58.16 3g76 h HIS 320 Cb 0.22 0.46 -0.02 0.00 1.55 0.00 0.00 27.41 29.62 3g76 h HIS 320 CO -0.00 -0.38 -0.64 0.00 -1.30 0.00 0.00 177.93 175.61 3g76 h ALA 321 N 0.80 0.94 -0.83 5.26 0.00 -1.32 0.80 119.26 124.91 3g76 h ALA 321 Ca 0.18 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 3g76 h ALA 321 Cb 0.54 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3g76 h ALA 321 CO -0.56 0.80 0.44 -0.22 0.00 0.00 0.00 179.25 179.71 3g76 h LYS 322 N 0.00 1.15 0.00 0.00 3.64 0.27 -2.99 116.57 118.66 3g76 h LYS 322 Ca -0.01 -0.14 -0.34 0.00 -1.27 0.00 0.00 60.65 58.89 3g76 h LYS 322 Cb 1.13 -0.22 -0.06 0.00 -0.41 0.00 0.00 32.23 32.66 3g76 h LYS 322 CO 0.08 0.85 -2.29 0.91 -2.27 0.00 0.00 179.45 176.74 3g76 n TRP 323 N -4.34 0.00 -3.48 1.91 7.02 -0.41 -4.73 117.44 113.41 3g76 n TRP 323 Ca 0.09 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.30 3g76 n TRP 323 Cb 0.11 -0.89 -0.09 0.00 -2.42 0.00 0.00 31.31 28.02 3g76 n TRP 323 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 3g76 n TYR 324 N -2.99 2.58 0.15 -5.99 0.53 0.28 -4.88 117.16 106.84 3g76 n TYR 324 Ca -0.37 -4.03 0.00 0.00 -1.02 0.00 0.00 57.90 52.48 3g76 n TYR 324 Cb 0.99 -0.48 0.24 0.00 -1.03 0.00 0.00 39.34 39.05 3g76 n TYR 324 CO 0.00 0.00 0.00 -1.00 -1.02 0.00 0.00 176.86 174.84 3g76 h PRO 325 N 4.49 0.00 0.00 -0.72 0.13 -1.67 -3.14 132.00 131.09 3g76 h PRO 325 Ca 0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.28 3g76 h PRO 325 Cb 0.73 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 3g76 h PRO 325 CO 0.72 0.53 -0.08 0.78 -0.23 0.00 0.00 178.00 179.72 3g76 h GLY 326 N 1.68 0.00 -4.75 1.56 0.00 -1.89 -3.45 103.07 96.21 3g76 h GLY 326 Ca -0.01 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.71 3g76 h GLY 326 CO 0.07 0.00 0.35 0.00 0.00 0.00 0.00 176.54 176.96 3g76 h LYS 328 N 3.28 0.31 0.00 0.00 6.56 -1.92 -3.22 116.57 121.58 3g76 h LYS 328 Ca -0.43 -0.54 -0.06 0.00 -1.06 0.00 0.00 60.65 58.57 3g76 h LYS 328 Cb 1.32 0.20 -0.01 0.00 -0.57 0.00 0.00 32.23 33.17 3g76 h LYS 328 CO 0.69 1.20 -0.28 -0.92 -2.06 0.00 0.00 179.45 178.08 3g76 h TYR 329 N 0.09 0.00 0.00 -1.35 3.20 -1.96 -0.35 116.97 116.60 3g76 h TYR 329 Ca -0.27 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.55 3g76 h TYR 329 Cb 2.05 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.31 3g76 h TYR 329 CO 0.08 0.28 -0.25 1.25 -1.64 0.00 0.00 178.16 177.88 3g76 h LEU 330 N 0.00 0.00 0.00 2.82 5.85 -1.91 -2.57 115.31 119.50 3g76 h LEU 330 Ca -0.00 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.47 3g76 h LEU 330 Cb 0.51 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 3g76 h LEU 330 CO 0.04 0.25 -1.52 0.25 -0.34 0.00 0.00 178.44 177.11 3g76 h LEU 331 N 0.00 0.00 -0.30 2.25 7.12 -1.17 -1.63 115.31 121.58 3g76 h LEU 331 Ca -0.00 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 57.84 3g76 h LEU 331 Cb 0.63 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.75 3g76 h LEU 331 CO 0.03 0.89 -0.45 -0.08 -0.13 0.00 0.00 178.44 178.71 3g76 h GLU 332 N 0.00 0.84 -0.01 1.25 4.81 -1.03 -0.55 114.58 119.89 3g76 h GLU 332 Ca -0.22 -0.50 0.00 0.00 -0.13 0.00 0.00 59.36 58.52 3g76 h GLU 332 Cb 1.87 0.04 0.00 0.00 0.63 0.00 0.00 28.75 31.30 3g76 h GLU 332 CO 0.08 1.13 -0.43 1.04 -0.73 0.00 0.00 179.01 180.10 3g76 n GLN 333 N -4.09 0.79 0.00 1.92 1.13 -0.98 -4.56 117.38 111.59 3g76 n GLN 333 Ca -0.04 -0.56 0.00 0.00 -1.94 0.00 0.00 57.00 54.46 3g76 n GLN 333 Cb 0.57 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.43 3g76 n GLN 333 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3g76 n LYS 334 N -0.62 0.77 0.00 -1.09 4.76 -0.61 -5.06 118.16 116.31 3g76 n LYS 334 Ca 0.10 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 3g76 n LYS 334 Cb 0.38 -0.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.91 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 1.67 -1.94 0.29 0.72 0.00 -0.22 -4.39 105.19 101.33 3g76 n GLY 335 Ca 0.00 -1.44 0.03 0.00 0.00 0.00 0.00 46.02 44.61 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 0.68 -0.48 1.61 1.08 -1.93 -2.84 115.11 113.22 3g76 h GLN 336 Ca 0.00 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3g76 h GLN 336 Cb 0.00 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.24 3g76 h GLN 336 CO 0.00 0.45 0.28 0.93 -0.95 0.00 0.00 178.83 179.54 3g76 h GLU 337 N 0.70 0.55 0.36 1.46 5.08 -1.99 0.14 114.58 120.88 3g76 h GLU 337 Ca 0.39 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.70 3g76 h GLU 337 Cb 0.40 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3g76 h GLU 337 CO -0.27 0.36 -0.34 -0.92 -1.00 0.00 0.00 179.01 176.84 3g76 h TYR 338 N 0.57 -0.95 -0.77 4.33 3.20 -1.71 0.15 116.97 121.80 3g76 h TYR 338 Ca 0.20 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.18 3g76 h TYR 338 Cb 0.03 0.37 -0.12 0.00 1.54 0.00 0.00 36.73 38.54 3g76 h TYR 338 CO -0.07 -0.46 -0.44 0.82 -1.64 0.00 0.00 178.16 176.37 3g76 h ILE 339 N -0.70 0.05 -0.54 1.81 2.04 -1.51 -1.30 117.51 117.37 3g76 h ILE 339 Ca -0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.88 3g76 h ILE 339 Cb 0.60 0.05 -0.06 0.00 -0.74 0.00 0.00 36.82 36.68 3g76 h ILE 339 CO -0.03 0.00 0.23 0.78 0.00 0.00 0.00 178.15 179.13 3g76 h ASN 340 N -0.12 0.28 -0.62 1.72 2.35 -0.34 0.21 115.58 119.06 3g76 h ASN 340 Ca 0.23 0.05 0.06 0.00 -0.55 0.00 0.00 56.30 56.09 3g76 h ASN 340 Cb 0.55 0.01 -0.05 0.00 0.05 0.00 0.00 38.32 38.87 3g76 h ASN 340 CO -0.82 0.19 0.33 0.78 -1.65 0.00 0.00 177.43 176.26 3g76 h ASN 341 N 0.44 0.48 -0.19 5.81 4.21 0.05 -1.11 115.58 125.26 3g76 h ASN 341 Ca 0.25 0.03 -0.00 0.00 1.21 0.00 0.00 56.30 57.80 3g76 h ASN 341 Cb 0.24 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.37 3g76 h ASN 341 CO -0.22 0.31 0.11 0.40 -1.29 0.00 0.00 177.43 176.74 3g76 h ILE 342 N 0.61 1.09 0.00 2.81 5.03 -0.13 -2.71 117.51 124.22 3g76 h ILE 342 Ca 0.28 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.78 3g76 h ILE 342 Cb 0.20 0.90 0.00 0.00 -3.03 0.00 0.00 36.82 34.89 3g76 h ILE 342 CO -0.19 0.09 0.00 1.57 -0.68 0.00 0.00 178.15 178.94 3g76 n HIS 343 N -4.91 0.00 -0.08 1.37 -0.00 0.62 -1.54 115.22 110.68 3g76 n HIS 343 Ca -0.04 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.06 3g76 n HIS 343 Cb 0.06 -0.41 0.08 0.00 -0.12 0.00 0.00 29.99 29.60 3g76 n HIS 343 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 3g76 h LEU 344 N 0.00 0.78 -9.24 0.27 4.07 -0.90 -3.38 115.31 106.92 3g76 h LEU 344 Ca 0.00 -0.30 -0.57 0.00 0.08 0.00 0.00 57.88 57.10 3g76 h LEU 344 Cb 0.22 -0.22 -0.05 0.00 1.08 0.00 0.00 40.66 41.69 3g76 h LEU 344 CO 0.00 1.01 0.43 -0.89 -1.08 0.00 0.00 178.44 177.90 3g76 s THR 345 N -4.54 4.86 -0.68 0.22 2.01 -0.59 -4.70 115.64 112.22 3g76 s THR 345 Ca -0.09 1.81 -0.13 0.00 0.31 0.00 0.00 61.69 63.58 3g76 s THR 345 Cb 0.13 -4.21 0.02 0.00 0.01 0.00 0.00 72.50 68.45 3g76 s THR 345 CO 0.84 0.05 0.63 1.41 -0.69 0.00 0.00 174.62 176.86 3g76 n HIS 346 N 4.89 -2.43 -0.13 4.92 8.25 -1.26 -4.96 115.22 124.49 3g76 n HIS 346 Ca 0.06 1.00 0.06 0.00 -0.26 0.00 0.00 57.72 58.57 3g76 n HIS 346 Cb 0.49 -2.69 0.11 0.00 1.12 0.00 0.00 29.99 29.02 3g76 n HIS 346 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3g76 n SER 347 N -1.64 -0.05 -3.44 0.41 3.41 -1.26 -4.81 113.62 106.25 3g76 n SER 347 Ca -0.19 0.66 -0.19 0.00 -0.26 0.00 0.00 58.87 58.88 3g76 n SER 347 Cb 0.66 -0.24 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 3g76 n SER 347 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3g76 n LEU 348 N -4.38 -0.52 -0.39 1.04 4.77 -1.26 -4.63 117.00 111.63 3g76 n LEU 348 Ca 0.09 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 3g76 n LEU 348 Cb 0.29 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 3g76 n LEU 348 CO -0.03 0.20 0.16 -1.84 -1.33 0.00 0.00 177.39 174.56 3g76 n GLU 349 N -2.87 0.54 0.00 3.23 0.28 -1.26 -3.76 120.64 116.80 3g76 n GLU 349 Ca -0.11 0.00 0.02 0.00 -0.16 0.00 0.00 57.16 56.91 3g76 n GLU 349 Cb 0.35 -1.21 0.11 0.00 1.43 0.00 0.00 31.44 32.12 3g76 n GLU 349 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3g76 n GLU 350 N 0.07 0.03 -0.04 3.44 1.02 -1.26 -1.78 120.64 122.12 3g76 n GLU 350 Ca 0.00 0.33 -0.14 0.00 -0.02 0.00 0.00 57.16 57.33 3g76 n GLU 350 Cb 0.11 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 29.94 3g76 n GLU 350 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3g76 h LEU 352 N -0.15 -0.02 0.00 0.00 3.38 -1.69 -3.16 115.31 113.67 3g76 h LEU 352 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g76 h LEU 352 Cb 0.83 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3g76 h LEU 352 CO 0.05 -0.01 0.00 0.52 0.09 0.00 0.00 178.44 179.09 3g76 n VAL 353 N -2.32 0.00 -0.22 1.22 0.31 -1.09 -0.35 118.33 115.89 3g76 n VAL 353 Ca -0.00 0.72 0.04 0.00 -0.01 0.00 0.00 64.34 65.09 3g76 n VAL 353 Cb 0.01 -1.23 0.09 0.00 -0.91 0.00 0.00 33.84 31.80 3g76 n VAL 353 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3g76 n ARG 354 N -0.43 -0.05 0.00 5.55 3.00 0.12 -0.78 116.66 124.06 3g76 n ARG 354 Ca 0.00 0.95 0.11 0.00 -0.01 0.00 0.00 57.85 58.90 3g76 n ARG 354 Cb 0.00 -1.43 -0.04 0.00 0.00 0.00 0.00 32.46 31.00 3g76 n ARG 354 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 3g76 n THR 355 N -4.98 0.01 -0.81 0.55 -2.24 -1.16 -4.17 114.28 101.48 3g76 n THR 355 Ca 0.10 -0.04 -0.11 0.00 -2.27 0.00 0.00 64.05 61.73 3g76 n THR 355 Cb 0.32 0.75 0.22 0.00 -2.10 0.00 0.00 70.33 69.52 3g76 n THR 355 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3g76 n THR 356 N -1.57 2.72 -0.03 4.28 -2.24 0.53 -5.08 114.28 112.89 3g76 n THR 356 Ca 0.04 -1.49 0.00 0.00 -2.27 0.00 0.00 64.05 60.33 3g76 n THR 356 Cb 0.35 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 3g76 n THR 356 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91