#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sc3 s ILE 318 N 0.00 4.92 0.08 0.00 -4.36 -1.26 -5.12 121.20 115.46 1sc3 s ILE 318 Ca 0.00 -0.50 0.03 0.00 -0.26 0.00 0.00 60.65 59.92 1sc3 s ILE 318 Cb 0.00 -3.34 -0.03 0.00 1.25 0.00 0.00 42.46 40.34 1sc3 s ILE 318 CO 0.00 0.21 -0.09 -0.54 0.24 0.00 0.00 174.94 174.77 1sc3 s LYS 319 N -2.19 0.75 0.17 0.37 3.01 -1.26 -5.15 119.74 115.44 1sc3 s LYS 319 Ca 0.29 -1.07 -0.24 0.00 -1.01 0.00 0.00 55.97 53.94 1sc3 s LYS 319 Cb -0.12 -0.41 -0.08 0.00 -1.01 0.00 0.00 37.83 36.21 1sc3 s LYS 319 CO 0.21 0.06 0.75 0.15 0.51 0.00 0.00 175.35 177.03 1sc3 s LYS 320 N -2.60 4.49 0.03 1.68 1.02 -1.26 -5.08 119.74 118.02 1sc3 s LYS 320 Ca 0.02 1.08 0.03 0.00 0.02 0.00 0.00 55.97 57.12 1sc3 s LYS 320 Cb -0.04 -3.20 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 1sc3 s LYS 320 CO -0.01 0.55 -0.10 0.00 -0.92 0.00 0.00 175.35 174.88 1sc3 s ALA 321 N -1.20 0.78 0.26 5.17 0.00 -1.26 -5.13 121.76 120.38 1sc3 s ALA 321 Ca 0.36 -0.64 -0.31 0.00 0.00 0.00 0.00 51.96 51.37 1sc3 s ALA 321 Cb -0.22 -0.09 -0.12 0.00 0.00 0.00 0.00 23.12 22.69 1sc3 s ALA 321 CO 0.25 0.11 1.61 0.72 0.00 0.00 0.00 175.76 178.45 1sc3 n HIS 322 N 2.05 2.76 -0.04 0.00 8.25 -1.26 -4.90 115.22 122.08 1sc3 n HIS 322 Ca -0.18 0.21 -0.04 0.00 -0.26 0.00 0.00 57.72 57.46 1sc3 n HIS 322 Cb 0.56 -2.60 0.19 0.00 1.12 0.00 0.00 29.99 29.26 1sc3 n HIS 322 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1sc3 h ILE 323 N 3.45 1.24 -3.35 1.59 2.10 -2.05 -3.41 117.51 117.08 1sc3 h ILE 323 Ca -0.46 -1.09 -0.54 0.00 1.08 0.00 0.00 64.86 63.85 1sc3 h ILE 323 Cb 1.22 1.10 -0.39 0.00 -1.09 0.00 0.00 36.82 37.67 1sc3 h ILE 323 CO 0.84 0.36 -0.78 -0.70 -1.08 0.00 0.00 178.15 176.79 1sc3 s GLU 324 N -4.76 1.13 0.08 2.19 2.12 -1.26 -5.11 118.70 113.08 1sc3 s GLU 324 Ca -0.08 -0.50 -0.23 0.00 0.36 0.00 0.00 54.97 54.52 1sc3 s GLU 324 Cb 0.14 -2.04 0.06 0.00 0.26 0.00 0.00 34.13 32.56 1sc3 s GLU 324 CO 0.80 -0.52 0.56 0.21 -0.54 0.00 0.00 175.26 175.78 1sc3 s LYS 325 N 1.70 1.14 -1.26 4.30 2.20 -1.26 -4.98 119.74 121.58 1sc3 s LYS 325 Ca -0.00 -0.29 -0.03 0.00 -0.36 0.00 0.00 55.97 55.28 1sc3 s LYS 325 Cb -0.16 0.52 0.00 0.00 -1.51 0.00 0.00 37.83 36.68 1sc3 s LYS 325 CO -0.07 -0.44 0.44 -0.25 -0.36 0.00 0.00 175.35 174.66 1sc3 n ASP 326 N 0.13 -5.18 -4.80 1.43 8.00 -0.10 -4.95 116.55 111.07 1sc3 n ASP 326 Ca -0.18 -0.21 -0.32 0.00 0.71 0.00 0.00 54.79 54.80 1sc3 n ASP 326 Cb 0.62 -4.06 -0.06 0.00 -0.02 0.00 0.00 41.12 37.60 1sc3 n ASP 326 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1sc3 s PHE 327 N -3.03 3.29 -0.10 1.24 0.08 -1.26 -4.74 117.98 113.46 1sc3 s PHE 327 Ca 0.22 0.16 -0.05 0.00 0.12 0.00 0.00 56.93 57.38 1sc3 s PHE 327 Cb -0.10 -1.69 0.05 0.00 -0.57 0.00 0.00 43.02 40.71 1sc3 s PHE 327 CO 0.27 0.55 0.22 -1.50 -0.10 0.00 0.00 175.22 174.65 1sc3 s ILE 328 N -1.33 -0.07 -0.01 0.64 2.07 -1.26 -0.81 121.20 120.42 1sc3 s ILE 328 Ca 0.28 0.17 0.03 0.00 -1.41 0.00 0.00 60.65 59.72 1sc3 s ILE 328 Cb -0.12 -0.35 -0.03 0.00 0.13 0.00 0.00 42.46 42.09 1sc3 s ILE 328 CO 0.20 0.07 -0.07 0.00 -1.91 0.00 0.00 174.94 173.23 1sc3 s ALA 329 N 1.34 2.99 -0.21 1.50 0.00 -0.81 -4.99 121.76 121.58 1sc3 s ALA 329 Ca -0.08 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 50.86 1sc3 s ALA 329 Cb -0.11 -1.13 0.06 0.00 0.00 0.00 0.00 23.12 21.94 1sc3 s ALA 329 CO -0.08 0.60 -0.01 0.12 0.00 0.00 0.00 175.76 176.40 1sc3 s PHE 330 N -0.96 1.64 0.11 0.00 5.36 -1.26 -0.19 117.98 122.68 1sc3 s PHE 330 Ca 0.16 -1.25 0.01 0.00 -0.96 0.00 0.00 56.93 54.89 1sc3 s PHE 330 Cb -0.11 -1.27 -0.04 0.00 -0.34 0.00 0.00 43.02 41.26 1sc3 s PHE 330 CO 0.06 -0.68 0.24 0.00 -1.46 0.00 0.00 175.22 173.39 1sc3 h SER 332 N 2.60 0.00 -5.42 0.00 4.64 -1.91 -0.69 113.55 112.76 1sc3 h SER 332 Ca -0.47 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.65 1sc3 h SER 332 Cb 1.18 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.19 1sc3 h SER 332 CO 0.72 0.10 -0.16 -0.94 -0.87 0.00 0.00 176.83 175.68 1sc3 s SER 333 N -5.96 0.57 0.54 4.97 1.04 -1.26 -3.34 113.70 110.26 1sc3 s SER 333 Ca 0.02 -1.33 -0.14 0.00 0.48 0.00 0.00 55.95 54.98 1sc3 s SER 333 Cb 0.09 0.65 -0.06 0.00 0.10 0.00 0.00 66.02 66.79 1sc3 s SER 333 CO 0.60 -1.27 0.97 0.42 0.98 0.00 0.00 173.24 174.94 1sc3 s THR 334 N -3.27 4.63 0.39 2.02 -4.23 -0.85 -4.14 115.64 110.19 1sc3 s THR 334 Ca 0.28 1.01 -0.25 0.00 -1.18 0.00 0.00 61.69 61.54 1sc3 s THR 334 Cb -0.00 -3.78 -0.11 0.00 1.34 0.00 0.00 72.50 69.95 1sc3 s THR 334 CO 0.17 -0.83 1.07 -2.65 -0.54 0.00 0.00 174.62 171.84 1sc3 n PRO 335 N -1.95 1.49 0.00 3.99 -0.02 -1.26 -2.00 135.00 135.24 1sc3 n PRO 335 Ca 0.06 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1sc3 n PRO 335 Cb 0.54 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1sc3 n PRO 335 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1sc3 n ASP 336 N 0.61 0.00 -4.63 2.55 8.00 -1.26 -5.02 116.55 116.80 1sc3 n ASP 336 Ca 0.09 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.29 1sc3 n ASP 336 Cb 0.38 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.39 1sc3 n ASP 336 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1sc3 s ASN 337 N -2.45 4.69 0.70 -2.24 0.02 -0.85 -5.11 114.94 109.69 1sc3 s ASN 337 Ca 0.00 -0.31 -0.14 0.00 -1.02 0.00 0.00 52.86 51.39 1sc3 s ASN 337 Cb 0.00 -1.00 0.02 0.00 0.02 0.00 0.00 41.25 40.29 1sc3 s ASN 337 CO 0.00 0.16 1.11 0.68 0.02 0.00 0.00 177.10 179.08 1sc3 s VAL 338 N -1.33 3.17 -0.05 1.60 -7.23 -1.26 -4.70 120.40 110.60 1sc3 s VAL 338 Ca 0.24 0.50 0.05 0.00 -1.81 0.00 0.00 61.98 60.96 1sc3 s VAL 338 Cb -0.11 -3.01 -0.00 0.00 0.56 0.00 0.00 36.38 33.82 1sc3 s VAL 338 CO 0.16 -0.38 -0.18 -0.44 -0.31 0.00 0.00 175.10 173.95 1sc3 s SER 339 N -2.74 2.30 0.08 4.85 0.01 -1.26 -4.76 113.70 112.18 1sc3 s SER 339 Ca 0.66 -0.38 -0.05 0.00 1.31 0.00 0.00 55.95 57.50 1sc3 s SER 339 Cb -0.20 -0.64 -0.05 0.00 0.21 0.00 0.00 66.02 65.34 1sc3 s SER 339 CO 0.45 0.17 0.30 0.26 0.41 0.00 0.00 173.24 174.84 1sc3 s TRP 340 N 0.01 3.53 -0.06 2.43 0.52 -1.26 -5.08 118.94 119.02 1sc3 s TRP 340 Ca -0.04 0.51 -0.04 0.00 0.02 0.00 0.00 56.10 56.55 1sc3 s TRP 340 Cb -0.12 -1.96 0.03 0.00 -1.15 0.00 0.00 33.47 30.27 1sc3 s TRP 340 CO 0.02 0.53 0.15 0.50 0.02 0.00 0.00 176.95 178.17 1sc3 s ARG 341 N -2.28 0.13 -0.15 4.98 3.52 -1.26 -2.84 118.95 121.06 1sc3 s ARG 341 Ca 0.35 0.28 -0.08 0.00 -0.13 0.00 0.00 55.73 56.15 1sc3 s ARG 341 Cb -0.13 -0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 1sc3 s ARG 341 CO 0.22 -0.09 0.13 -1.58 -0.81 0.00 0.00 175.30 173.18 1sc3 s HIS 342 N 0.59 3.52 0.53 5.12 5.65 0.72 -4.93 115.29 126.50 1sc3 s HIS 342 Ca -0.04 0.44 0.23 0.00 0.25 0.00 0.00 55.06 55.94 1sc3 s HIS 342 Cb -0.06 -2.03 1.38 0.00 -1.18 0.00 0.00 32.58 30.69 1sc3 s HIS 342 CO -0.03 0.55 2.04 -1.00 -0.65 0.00 0.00 174.74 175.66 1sc3 h PRO 343 N 5.67 0.00 0.00 2.88 0.13 -2.02 0.01 132.00 138.67 1sc3 h PRO 343 Ca -0.49 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 1sc3 h PRO 343 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1sc3 h PRO 343 CO 0.65 0.00 -1.26 0.25 -0.23 0.00 0.00 178.00 177.42 1sc3 n THR 344 N -4.39 0.19 0.65 1.56 -2.24 -1.26 -4.69 114.28 104.10 1sc3 n THR 344 Ca 0.06 -0.15 0.12 0.00 -2.27 0.00 0.00 64.05 61.80 1sc3 n THR 344 Cb 0.45 -0.48 0.12 0.00 -2.10 0.00 0.00 70.33 68.32 1sc3 n THR 344 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1sc3 n MET 345 N -1.99 0.24 0.00 -0.78 2.81 -1.20 -5.08 117.12 111.12 1sc3 n MET 345 Ca -0.05 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1sc3 n MET 345 Cb 0.47 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.37 1sc3 n MET 345 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1sc3 n GLY 346 N 1.38 -1.92 3.71 3.03 0.00 -0.02 -4.87 105.19 106.50 1sc3 n GLY 346 Ca 0.03 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 1sc3 n GLY 346 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sc3 s SER 347 N -4.00 7.16 0.25 1.61 0.01 -1.26 -0.20 113.70 117.28 1sc3 s SER 347 Ca 0.00 1.91 -0.04 0.00 1.31 0.00 0.00 55.95 59.12 1sc3 s SER 347 Cb 0.00 -2.58 0.30 0.00 0.21 0.00 0.00 66.02 63.96 1sc3 s SER 347 CO 0.00 -0.41 1.83 1.62 0.41 0.00 0.00 173.24 176.69 1sc3 h VAL 348 N 4.61 1.24 -0.37 3.43 3.04 -1.86 -1.01 116.25 125.33 1sc3 h VAL 348 Ca -0.41 -0.74 -0.01 0.00 -1.01 0.00 0.00 66.70 64.53 1sc3 h VAL 348 Cb 1.21 0.38 -0.02 0.00 -2.01 0.00 0.00 31.29 30.85 1sc3 h VAL 348 CO 0.79 0.30 0.20 0.15 -1.01 0.00 0.00 177.57 178.00 1sc3 h PHE 349 N 1.03 0.52 0.07 3.17 3.57 -1.93 0.25 116.94 123.62 1sc3 h PHE 349 Ca 0.24 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1sc3 h PHE 349 Cb 0.18 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.75 1sc3 h PHE 349 CO 0.02 0.42 -0.03 0.82 -2.23 0.00 0.00 178.31 177.30 1sc3 h ILE 350 N 0.47 1.02 -0.69 1.41 1.08 -1.85 0.92 117.51 119.87 1sc3 h ILE 350 Ca 0.13 -0.31 0.05 0.00 -0.39 0.00 0.00 64.86 64.33 1sc3 h ILE 350 Cb 0.08 1.22 -0.05 0.00 -3.07 0.00 0.00 36.82 35.00 1sc3 h ILE 350 CO -0.02 0.08 0.41 1.23 -0.69 0.00 0.00 178.15 179.16 1sc3 h GLY 351 N -0.24 1.00 1.25 5.37 0.00 -1.13 -1.00 103.07 108.32 1sc3 h GLY 351 Ca -0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 1sc3 h GLY 351 CO 0.02 0.22 -0.12 -0.09 0.00 0.00 0.00 176.54 176.56 1sc3 h ARG 352 N 0.77 0.88 -0.30 4.80 9.65 -0.82 -2.29 114.38 127.08 1sc3 h ARG 352 Ca 0.29 -0.31 -0.02 0.00 -1.10 0.00 0.00 59.98 58.84 1sc3 h ARG 352 Cb 0.11 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 1sc3 h ARG 352 CO -0.15 0.96 0.12 1.25 2.80 0.00 0.00 179.97 184.95 1sc3 h LEU 353 N 0.79 0.41 -0.22 3.80 5.85 -0.35 -2.19 115.31 123.40 1sc3 h LEU 353 Ca 0.13 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1sc3 h LEU 353 Cb 0.64 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1sc3 h LEU 353 CO 0.04 0.47 0.11 0.40 -0.34 0.00 0.00 178.44 179.13 1sc3 h ILE 354 N 0.33 1.00 -0.47 4.05 2.04 -1.12 0.26 117.51 123.59 1sc3 h ILE 354 Ca 0.10 -0.08 0.05 0.00 1.00 0.00 0.00 64.86 65.92 1sc3 h ILE 354 Cb 0.19 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 1sc3 h ILE 354 CO -0.01 0.04 0.21 -0.33 0.00 0.00 0.00 178.15 178.07 1sc3 h GLU 355 N 0.24 0.41 -0.23 2.37 5.08 -1.34 0.11 114.58 121.22 1sc3 h GLU 355 Ca 0.09 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.28 1sc3 h GLU 355 Cb 0.02 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1sc3 h GLU 355 CO -0.06 0.27 -0.47 0.45 -1.00 0.00 0.00 179.01 178.20 1sc3 h HIS 356 N 0.42 0.73 -0.55 4.33 3.86 -1.21 -1.99 115.15 120.74 1sc3 h HIS 356 Ca 0.21 -0.24 -0.10 0.00 -1.16 0.00 0.00 60.37 59.09 1sc3 h HIS 356 Cb 0.16 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 1sc3 h HIS 356 CO -0.12 0.96 -0.04 0.52 0.86 0.00 0.00 177.93 180.11 1sc3 h MET 357 N 0.48 1.01 -0.75 2.45 2.86 -0.55 0.99 114.93 121.42 1sc3 h MET 357 Ca 0.03 -0.34 -0.03 0.00 -2.06 0.00 0.00 59.70 57.30 1sc3 h MET 357 Cb 1.00 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.55 1sc3 h MET 357 CO 0.09 1.02 0.35 1.96 1.06 0.00 0.00 176.91 181.40 1sc3 h GLN 358 N 0.89 1.08 0.25 1.72 4.20 -0.68 -2.12 115.11 120.45 1sc3 h GLN 358 Ca 0.15 -0.16 -0.34 0.00 0.06 0.00 0.00 58.65 58.36 1sc3 h GLN 358 Cb 0.60 -0.19 0.04 0.00 0.30 0.00 0.00 27.48 28.22 1sc3 h GLN 358 CO 0.04 0.85 -1.50 1.49 -0.67 0.00 0.00 178.83 179.04 1sc3 h GLU 359 N 1.05 0.54 -0.01 1.46 4.57 -1.25 -3.41 114.58 117.54 1sc3 h GLU 359 Ca 0.26 -0.92 0.00 0.00 -1.18 0.00 0.00 59.36 57.52 1sc3 h GLU 359 Cb 0.13 0.34 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1sc3 h GLU 359 CO -0.03 1.44 -0.10 0.66 -1.18 0.00 0.00 179.01 179.80 1sc3 n TYR 360 N -3.71 0.00 0.17 0.92 4.01 0.33 -4.53 117.16 114.35 1sc3 n TYR 360 Ca -0.17 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.63 1sc3 n TYR 360 Cb 1.11 0.00 0.54 0.00 -0.31 0.00 0.00 39.34 40.68 1sc3 n TYR 360 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1sc3 h ALA 361 N 1.65 1.84 0.00 -0.72 0.00 -1.53 0.88 119.26 121.38 1sc3 h ALA 361 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1sc3 h ALA 361 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1sc3 h ALA 361 CO 0.00 0.13 -0.36 0.00 0.00 0.00 0.00 179.25 179.03 1sc3 n SER 363 N -3.88 4.20 -4.32 0.00 3.41 -0.95 -4.91 113.62 107.17 1sc3 n SER 363 Ca -0.01 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.31 1sc3 n SER 363 Cb 0.42 0.83 -0.14 0.00 -0.26 0.00 0.00 64.21 65.06 1sc3 n SER 363 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sc3 s ASP 365 N -1.42 4.66 0.27 0.00 -4.77 -1.26 -4.56 116.67 109.59 1sc3 s ASP 365 Ca 0.11 1.33 -0.03 0.00 -3.30 0.00 0.00 52.55 50.66 1sc3 s ASP 365 Cb -0.10 -2.09 0.38 0.00 -1.09 0.00 0.00 42.92 40.02 1sc3 s ASP 365 CO 0.03 -1.87 1.92 -0.37 0.70 0.00 0.00 175.17 175.59 1sc3 h VAL 366 N -1.02 1.18 -0.92 2.11 -1.51 -1.56 -1.18 116.25 113.34 1sc3 h VAL 366 Ca -0.46 -0.42 -0.00 0.00 -1.23 0.00 0.00 66.70 64.59 1sc3 h VAL 366 Cb 1.26 -0.14 -0.04 0.00 -2.13 0.00 0.00 31.29 30.23 1sc3 h VAL 366 CO 0.59 0.22 0.57 -0.33 -1.23 0.00 0.00 177.57 177.40 1sc3 h GLU 367 N 1.21 1.24 -0.41 5.19 5.08 -1.93 -0.92 114.58 124.05 1sc3 h GLU 367 Ca 0.37 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1sc3 h GLU 367 Cb -0.02 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 28.95 1sc3 h GLU 367 CO -0.11 0.85 -0.07 0.93 -1.00 0.00 0.00 179.01 179.61 1sc3 h GLU 368 N 1.27 0.77 -0.51 2.33 5.08 -1.67 -2.22 114.58 119.64 1sc3 h GLU 368 Ca 0.33 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1sc3 h GLU 368 Cb -0.08 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1sc3 h GLU 368 CO -0.07 0.89 0.24 0.82 -1.00 0.00 0.00 179.01 179.90 1sc3 h ILE 369 N 0.59 1.19 -0.71 3.13 2.04 -0.93 -1.81 117.51 121.01 1sc3 h ILE 369 Ca 0.11 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 1sc3 h ILE 369 Cb 0.59 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1sc3 h ILE 369 CO 0.04 0.22 0.34 -0.26 0.00 0.00 0.00 178.15 178.48 1sc3 h PHE 370 N 0.67 1.01 -0.58 1.37 0.04 -1.13 -0.73 116.94 117.59 1sc3 h PHE 370 Ca 0.17 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 1sc3 h PHE 370 Cb 0.12 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.93 1sc3 h PHE 370 CO -0.01 0.74 0.33 -0.09 -0.60 0.00 0.00 178.31 178.68 1sc3 h ARG 371 N 1.01 0.81 -0.91 1.51 2.43 -1.11 -1.40 114.38 116.71 1sc3 h ARG 371 Ca 0.25 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1sc3 h ARG 371 Cb 0.10 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 1sc3 h ARG 371 CO -0.03 0.60 0.53 0.87 -1.51 0.00 0.00 179.97 180.43 1sc3 h LYS 372 N 0.79 1.25 -0.41 0.20 1.57 -0.63 -0.84 116.57 118.50 1sc3 h LYS 372 Ca 0.21 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1sc3 h LYS 372 Cb 0.02 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.06 1sc3 h LYS 372 CO -0.04 0.89 0.26 0.28 -0.57 0.00 0.00 179.45 180.28 1sc3 h VAL 373 N 1.26 1.11 -0.57 0.50 2.07 -0.87 -1.81 116.25 117.94 1sc3 h VAL 373 Ca 0.32 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.66 1sc3 h VAL 373 Cb -0.02 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1sc3 h VAL 373 CO -0.06 0.11 0.32 0.03 0.02 0.00 0.00 177.57 177.99 1sc3 h ARG 374 N 0.54 0.60 -0.84 1.57 3.08 -0.78 -2.62 114.38 115.93 1sc3 h ARG 374 Ca 0.15 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1sc3 h ARG 374 Cb -0.05 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 29.83 1sc3 h ARG 374 CO -0.03 0.40 0.52 0.35 -1.07 0.00 0.00 179.97 180.14 1sc3 h PHE 375 N 0.62 1.09 0.00 3.04 3.04 -0.84 -1.96 116.94 121.93 1sc3 h PHE 375 Ca 0.25 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.20 1sc3 h PHE 375 Cb 0.10 -0.36 -0.00 0.00 2.56 0.00 0.00 35.95 38.25 1sc3 h PHE 375 CO -0.08 0.71 -0.01 0.66 -2.02 0.00 0.00 178.31 177.58 1sc3 h SER 376 N 1.16 0.00 0.05 0.41 4.64 -0.95 -1.14 113.55 117.71 1sc3 h SER 376 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1sc3 h SER 376 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1sc3 h SER 376 CO -0.06 0.01 -0.22 0.49 -0.87 0.00 0.00 176.83 176.17 1sc3 n PHE 377 N -3.16 0.00 -0.19 4.77 3.72 -0.74 -4.66 117.46 117.19 1sc3 n PHE 377 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1sc3 n PHE 377 Cb 0.12 -0.03 0.10 0.00 -0.94 0.00 0.00 39.48 38.72 1sc3 n PHE 377 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1sc3 h GLU 378 N 2.59 0.18 -6.08 -1.08 4.81 -1.12 -3.37 114.58 110.50 1sc3 h GLU 378 Ca 0.00 -0.01 -0.60 0.00 -0.13 0.00 0.00 59.36 58.62 1sc3 h GLU 378 Cb 0.69 -0.04 -0.10 0.00 0.63 0.00 0.00 28.75 29.93 1sc3 h GLU 378 CO 0.00 0.12 0.56 -0.65 -0.73 0.00 0.00 179.01 178.31 1sc3 s GLN 379 N -6.13 3.65 0.20 1.92 -1.52 -1.26 -5.02 119.66 111.49 1sc3 s GLN 379 Ca -0.13 0.30 -0.30 0.00 -1.95 0.00 0.00 55.36 53.27 1sc3 s GLN 379 Cb 0.18 -3.88 -0.08 0.00 -0.22 0.00 0.00 33.01 29.01 1sc3 s GLN 379 CO 0.74 -1.09 0.95 -2.14 -0.25 0.00 0.00 175.29 173.49 1sc3 s PRO 380 N 3.58 4.81 0.00 2.91 0.02 -1.26 -5.06 135.00 140.00 1sc3 s PRO 380 Ca 0.36 1.48 0.00 0.00 0.02 0.00 0.00 61.00 62.86 1sc3 s PRO 380 Cb -0.11 -3.31 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1sc3 s PRO 380 CO 0.23 0.42 0.00 -0.40 -0.33 0.00 0.00 177.00 176.92 1sc3 n ASP 381 N 1.90 0.36 0.18 2.53 5.68 -1.26 -5.01 116.55 120.93 1sc3 n ASP 381 Ca -0.01 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.31 1sc3 n ASP 381 Cb 0.48 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 40.84 1sc3 n ASP 381 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1sc3 h GLY 382 N 0.00 0.03 -7.29 6.12 0.00 -2.06 -3.32 103.07 96.55 1sc3 h GLY 382 Ca 0.00 -0.02 -0.65 0.00 0.00 0.00 0.00 47.33 46.65 1sc3 h GLY 382 CO 0.00 0.02 -0.49 0.50 0.00 0.00 0.00 176.54 176.58 1sc3 s ARG 383 N -4.33 2.44 0.05 4.80 0.52 -1.26 -5.09 118.95 116.07 1sc3 s ARG 383 Ca -0.03 -2.97 -0.07 0.00 -0.52 0.00 0.00 55.73 52.14 1sc3 s ARG 383 Cb 0.15 -3.52 -0.05 0.00 0.52 0.00 0.00 34.95 32.05 1sc3 s ARG 383 CO 0.72 -1.21 0.31 0.00 0.02 0.00 0.00 175.30 175.14 1sc3 s ALA 384 N -0.84 3.83 0.03 2.13 0.00 -1.25 -4.99 121.76 120.66 1sc3 s ALA 384 Ca 0.21 -0.55 -0.28 0.00 0.00 0.00 0.00 51.96 51.34 1sc3 s ALA 384 Cb -0.15 -2.10 0.07 0.00 0.00 0.00 0.00 23.12 20.94 1sc3 s ALA 384 CO -0.08 0.65 0.66 1.14 0.00 0.00 0.00 175.76 178.12 1sc3 s GLN 385 N -1.97 1.13 -0.31 0.00 -2.07 -1.26 -4.88 119.66 110.31 1sc3 s GLN 385 Ca 0.31 -0.02 0.00 0.00 -1.82 0.00 0.00 55.36 53.84 1sc3 s GLN 385 Cb -0.13 0.53 0.10 0.00 -1.09 0.00 0.00 33.01 32.41 1sc3 s GLN 385 CO 0.18 -0.41 0.07 1.41 -1.32 0.00 0.00 175.29 175.23 1sc3 s MET 386 N -2.16 0.94 0.48 9.60 1.75 -1.26 -4.86 119.30 123.79 1sc3 s MET 386 Ca -0.06 -1.23 -0.23 0.00 -1.25 0.00 0.00 55.69 52.92 1sc3 s MET 386 Cb -0.00 -2.31 -0.08 0.00 2.84 0.00 0.00 34.83 35.28 1sc3 s MET 386 CO 0.01 -0.94 1.12 -2.30 -0.65 0.00 0.00 175.02 172.26 1sc3 n PRO 387 N 4.71 1.46 -4.51 4.11 -0.02 -1.21 -2.01 135.00 137.53 1sc3 n PRO 387 Ca -0.02 0.53 -0.24 0.00 -2.02 0.00 0.00 63.50 61.76 1sc3 n PRO 387 Cb 0.42 -2.24 -0.16 0.00 -0.02 0.00 0.00 33.50 31.50 1sc3 n PRO 387 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1sc3 s THR 388 N -1.31 1.02 0.01 3.45 2.01 -0.27 -4.85 115.64 115.70 1sc3 s THR 388 Ca 0.66 -0.42 -0.24 0.00 0.31 0.00 0.00 61.69 62.00 1sc3 s THR 388 Cb -0.49 -0.94 -0.05 0.00 0.01 0.00 0.00 72.50 71.03 1sc3 s THR 388 CO 0.54 0.33 0.74 -0.89 -0.69 0.00 0.00 174.62 174.65 1sc3 s THR 389 N 0.65 4.83 0.05 -0.82 2.01 -1.26 -0.52 115.64 120.58 1sc3 s THR 389 Ca -0.13 1.56 0.06 0.00 0.31 0.00 0.00 61.69 63.49 1sc3 s THR 389 Cb -0.15 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.25 1sc3 s THR 389 CO 0.03 0.33 -0.16 -1.61 -0.69 0.00 0.00 174.62 172.53 1sc3 s GLU 390 N 0.18 1.00 -1.16 4.92 0.41 0.73 -4.92 118.70 119.86 1sc3 s GLU 390 Ca 0.38 -0.85 -0.27 0.00 -0.41 0.00 0.00 54.97 53.81 1sc3 s GLU 390 Cb -0.20 -1.05 0.02 0.00 -1.78 0.00 0.00 34.13 31.12 1sc3 s GLU 390 CO 0.21 0.26 0.72 -2.13 -0.49 0.00 0.00 175.26 173.83 1sc3 n ARG 391 N 1.72 -0.69 -3.13 1.61 0.63 -1.26 -1.93 116.66 113.62 1sc3 n ARG 391 Ca -0.19 0.28 -0.40 0.00 -0.92 0.00 0.00 57.85 56.62 1sc3 n ARG 391 Cb 0.54 -3.16 -0.06 0.00 0.45 0.00 0.00 32.46 30.23 1sc3 n ARG 391 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1sc3 s VAL 392 N -3.46 5.00 -0.11 5.15 1.01 -1.26 -4.42 120.40 122.31 1sc3 s VAL 392 Ca 0.46 1.12 0.14 0.00 0.00 0.00 0.00 61.98 63.70 1sc3 s VAL 392 Cb -0.22 -3.92 0.27 0.00 0.00 0.00 0.00 36.38 32.51 1sc3 s VAL 392 CO 0.92 0.06 1.14 0.35 0.00 0.00 0.00 175.10 177.57 1sc3 n THR 393 N 5.04 1.36 -1.84 3.92 -2.24 0.01 -4.97 114.28 115.55 1sc3 n THR 393 Ca -0.01 -1.87 -0.42 0.00 -2.27 0.00 0.00 64.05 59.48 1sc3 n THR 393 Cb 0.49 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 1sc3 n THR 393 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1sc3 s LEU 394 N -2.04 4.38 0.02 3.22 1.43 -1.15 -0.92 118.68 123.62 1sc3 s LEU 394 Ca 0.27 2.53 0.22 0.00 -1.03 0.00 0.00 54.13 56.12 1sc3 s LEU 394 Cb 0.25 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.84 1sc3 s LEU 394 CO -0.02 -0.95 0.92 0.35 0.23 0.00 0.00 176.35 176.88 1sc3 n THR 395 N 5.05 0.07 -4.38 5.49 -2.24 -1.26 -4.94 114.28 112.07 1sc3 n THR 395 Ca 0.17 -0.19 -0.19 0.00 -2.27 0.00 0.00 64.05 61.58 1sc3 n THR 395 Cb 0.41 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 68.98 1sc3 n THR 395 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1sc3 s ARG 396 N -3.17 1.53 0.03 -0.78 0.52 -1.26 -5.13 118.95 110.70 1sc3 s ARG 396 Ca 0.04 -1.84 -0.30 0.00 -0.52 0.00 0.00 55.73 53.10 1sc3 s ARG 396 Cb 0.15 -0.52 -0.04 0.00 0.52 0.00 0.00 34.95 35.05 1sc3 s ARG 396 CO 0.84 -0.26 1.09 0.00 0.02 0.00 0.00 175.30 176.98 1sc3 s PHE 398 N 1.01 3.30 -0.12 0.00 5.36 -1.26 -5.01 117.98 121.26 1sc3 s PHE 398 Ca 0.55 -1.35 -0.14 0.00 -0.96 0.00 0.00 56.93 55.03 1sc3 s PHE 398 Cb -0.25 -3.81 -0.05 0.00 -0.34 0.00 0.00 43.02 38.57 1sc3 s PHE 398 CO 0.29 -1.02 0.32 0.71 -1.46 0.00 0.00 175.22 174.06 1sc3 s TYR 399 N 1.48 3.54 -0.23 10.12 1.51 -1.26 -1.23 117.35 131.28 1sc3 s TYR 399 Ca 0.05 0.71 0.22 0.00 -1.01 0.00 0.00 57.07 57.04 1sc3 s TYR 399 Cb -0.28 -2.31 0.44 0.00 -0.11 0.00 0.00 41.96 39.69 1sc3 s TYR 399 CO 0.02 0.37 1.63 -0.07 -1.11 0.00 0.00 175.55 176.38 1sc3 h LEU 400 N 6.08 0.00 -3.87 -1.29 -0.00 -1.84 -3.48 115.31 110.91 1sc3 h LEU 400 Ca -0.45 0.00 -0.58 0.00 -0.00 0.00 0.00 57.88 56.85 1sc3 h LEU 400 Cb 1.18 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 1sc3 h LEU 400 CO 0.71 0.18 -1.01 0.49 -0.00 0.00 0.00 178.44 178.80 1sc3 n PHE 401 N -3.17 -1.48 -1.71 1.13 3.72 -1.26 -4.83 117.46 109.86 1sc3 n PHE 401 Ca 0.03 0.16 -0.42 0.00 -0.05 0.00 0.00 57.45 57.16 1sc3 n PHE 401 Cb 0.56 -2.83 -0.03 0.00 -0.94 0.00 0.00 39.48 36.23 1sc3 n PHE 401 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1sc3 n PRO 402 N -4.80 2.81 0.00 -1.08 -0.04 -1.26 -0.88 135.00 129.75 1sc3 n PRO 402 Ca -0.13 1.02 0.00 0.00 -0.04 0.00 0.00 63.50 64.35 1sc3 n PRO 402 Cb 0.57 -2.89 0.00 0.00 -0.04 0.00 0.00 33.50 31.14 1sc3 n PRO 402 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1sc3 n GLY 403 N 4.12 2.43 0.30 0.55 0.00 -1.26 -4.97 105.19 106.35 1sc3 n GLY 403 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.23 1sc3 n GLY 403 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74