#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kqb s PRO 364 N 0.00 1.13 0.36 1.61 0.04 -1.26 -5.09 135.00 131.80 2kqb s PRO 364 Ca 0.00 0.50 0.04 0.00 0.04 0.00 0.00 61.00 61.58 2kqb s PRO 364 Cb 0.00 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.69 2kqb s PRO 364 CO 0.00 -2.25 0.16 -0.51 0.04 0.00 0.00 177.00 174.45 2kqb s LEU 365 N -6.13 1.87 0.00 -3.56 1.43 -1.26 -5.01 118.68 106.02 2kqb s LEU 365 Ca 0.64 -1.65 0.00 0.00 -1.03 0.00 0.00 54.13 52.08 2kqb s LEU 365 Cb -0.16 0.09 0.00 0.00 0.03 0.00 0.00 46.19 46.15 2kqb s LEU 365 CO 0.55 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.80 2kqb n GLY 366 N -0.77 0.75 2.62 -3.19 0.00 -1.26 -5.12 105.19 98.22 2kqb n GLY 366 Ca -0.01 -0.67 -0.24 0.00 0.00 0.00 0.00 46.02 45.09 2kqb n GLY 366 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kqb s SER 367 N -1.36 2.52 0.00 1.61 0.15 -1.26 -5.07 113.70 110.28 2kqb s SER 367 Ca 0.00 -1.40 0.00 0.00 0.70 0.00 0.00 55.95 55.25 2kqb s SER 367 Cb 0.00 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2kqb s SER 367 CO 0.00 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.68 2kqb n GLY 368 N 4.82 0.67 2.34 9.45 0.00 -1.26 -4.99 105.19 116.22 2kqb n GLY 368 Ca 0.02 -1.23 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 2kqb n GLY 368 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kqb n SER 369 N -0.05 -0.09 -2.76 1.61 7.64 -1.26 -4.95 113.62 113.77 2kqb n SER 369 Ca 0.00 -3.20 -0.04 0.00 1.01 0.00 0.00 58.87 56.64 2kqb n SER 369 Cb 0.00 0.10 0.05 0.00 -1.01 0.00 0.00 64.21 63.36 2kqb n SER 369 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kqb n GLU 370 N 0.34 1.46 -2.78 1.43 4.71 -1.26 -4.90 120.64 119.64 2kqb n GLU 370 Ca 0.20 -3.15 -0.01 0.00 -0.01 0.00 0.00 57.16 54.19 2kqb n GLU 370 Cb 0.67 -1.24 0.08 0.00 -1.01 0.00 0.00 31.44 29.94 2kqb n GLU 370 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2kqb n GLY 371 N -0.48 1.88 1.38 0.62 0.00 -1.26 -4.47 105.19 102.86 2kqb n GLY 371 Ca 0.05 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2kqb n GLY 371 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kqb n ASN 372 N -0.94 0.60 -2.67 1.61 3.02 -1.26 -4.96 115.26 110.66 2kqb n ASN 372 Ca -0.02 0.24 -0.11 0.00 -0.03 0.00 0.00 54.58 54.66 2kqb n ASN 372 Cb 0.83 -0.07 0.02 0.00 -0.61 0.00 0.00 39.78 39.96 2kqb n ASN 372 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2kqb n LYS 373 N -3.44 1.39 -4.05 3.52 4.76 -1.26 -5.10 118.16 113.98 2kqb n LYS 373 Ca 0.00 -3.40 -0.07 0.00 -2.87 0.00 0.00 58.31 51.97 2kqb n LYS 373 Cb 0.03 -1.38 -0.09 0.00 -1.84 0.00 0.00 35.03 31.75 2kqb n LYS 373 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2kqb s VAL 374 N -3.35 0.20 -0.81 -0.18 0.11 -1.26 -5.09 120.40 110.01 2kqb s VAL 374 Ca 0.30 -1.70 -0.21 0.00 -2.93 0.00 0.00 61.98 57.44 2kqb s VAL 374 Cb 0.45 -1.51 0.10 0.00 -1.53 0.00 0.00 36.38 33.89 2kqb s VAL 374 CO 0.01 -0.92 1.07 -0.54 -3.33 0.00 0.00 175.10 171.39 2kqb s LYS 375 N -3.91 3.38 0.57 1.54 3.01 -1.26 -4.93 119.74 118.13 2kqb s LYS 375 Ca 0.07 -1.31 -0.19 0.00 -1.01 0.00 0.00 55.97 53.53 2kqb s LYS 375 Cb 0.07 -4.64 -0.05 0.00 -1.01 0.00 0.00 37.83 32.21 2kqb s LYS 375 CO -0.10 -1.82 1.16 1.03 0.51 0.00 0.00 175.35 176.14 2kqb s ARG 376 N 3.43 3.16 0.87 1.68 1.81 -1.26 -5.01 118.95 123.63 2kqb s ARG 376 Ca 0.29 1.70 -0.13 0.00 -1.72 0.00 0.00 55.73 55.86 2kqb s ARG 376 Cb -0.10 -1.97 0.12 0.00 -0.45 0.00 0.00 34.95 32.55 2kqb s ARG 376 CO -0.01 -1.03 1.21 -0.08 -0.68 0.00 0.00 175.30 174.71 2kqb s THR 377 N -1.72 1.99 0.62 0.02 -1.32 -1.26 -4.20 115.64 109.76 2kqb s THR 377 Ca 0.75 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 61.09 2kqb s THR 377 Cb -0.27 -2.95 -0.03 0.00 -1.51 0.00 0.00 72.50 67.75 2kqb s THR 377 CO 0.30 0.00 1.04 -0.94 -2.21 0.00 0.00 174.62 172.81 2kqb s SER 378 N -4.55 5.93 0.70 8.08 1.04 -1.26 0.21 113.70 123.86 2kqb s SER 378 Ca 0.65 1.61 -0.11 0.00 0.48 0.00 0.00 55.95 58.59 2kqb s SER 378 Cb -0.10 -2.50 0.01 0.00 0.10 0.00 0.00 66.02 63.53 2kqb s SER 378 CO 0.51 -1.07 1.06 0.00 0.98 0.00 0.00 173.24 174.73 2kqb h MET 380 N -0.74 0.68 0.03 0.00 -0.00 -1.96 -2.54 114.93 110.39 2kqb h MET 380 Ca -0.44 -0.08 -0.22 0.00 -0.00 0.00 0.00 59.70 58.96 2kqb h MET 380 Cb 1.22 -0.13 -0.01 0.00 -0.00 0.00 0.00 31.60 32.68 2kqb h MET 380 CO 0.58 0.52 -0.97 1.88 -0.00 0.00 0.00 176.91 178.92 2kqb h TYR 381 N 0.68 0.36 0.00 -0.10 0.05 -1.93 -3.48 116.97 112.55 2kqb h TYR 381 Ca 0.17 -0.22 0.00 0.00 0.05 0.00 0.00 58.73 58.74 2kqb h TYR 381 Cb 0.07 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 37.77 2kqb h TYR 381 CO 0.01 1.07 0.00 0.41 -1.05 0.00 0.00 178.16 178.59 2kqb n GLY 382 N 1.05 1.90 0.43 3.88 0.00 -0.96 -3.18 105.19 108.32 2kqb n GLY 382 Ca -0.05 0.11 0.08 0.00 0.00 0.00 0.00 46.02 46.16 2kqb n GLY 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kqb n ALA 383 N 2.16 2.91 -0.78 4.61 0.00 -1.26 -4.09 120.51 124.06 2kqb n ALA 383 Ca 0.00 -0.55 0.08 0.00 0.00 0.00 0.00 53.44 52.96 2kqb n ALA 383 Cb 0.00 -0.53 0.17 0.00 0.00 0.00 0.00 19.45 19.09 2kqb n ALA 383 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kqb n ASN 384 N 0.18 2.95 -4.50 0.00 3.02 -1.19 -5.06 115.26 110.66 2kqb n ASN 384 Ca 0.07 -2.77 -0.46 0.00 -0.03 0.00 0.00 54.58 51.38 2kqb n ASN 384 Cb 0.34 -0.39 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 2kqb n ASN 384 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kqb n TYR 386 N 0.17 0.00 -1.04 0.00 0.18 -1.26 -5.05 117.16 110.17 2kqb n TYR 386 Ca 0.14 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.58 2kqb n TYR 386 Cb 0.28 -0.14 0.12 0.00 -0.38 0.00 0.00 39.34 39.22 2kqb n TYR 386 CO 0.00 0.00 0.00 2.89 -2.08 0.00 0.00 176.86 177.67 2kqb n ARG 387 N -2.57 0.06 -3.20 -3.48 1.85 -1.26 -4.97 116.66 103.09 2kqb n ARG 387 Ca -0.06 0.09 -0.25 0.00 -1.00 0.00 0.00 57.85 56.62 2kqb n ARG 387 Cb 0.57 -2.24 -0.06 0.00 -1.05 0.00 0.00 32.46 29.68 2kqb n ARG 387 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 2kqb n LYS 388 N -2.70 2.25 -4.41 2.89 2.85 -1.26 -5.08 118.16 112.70 2kqb n LYS 388 Ca 0.12 -4.33 -0.32 0.00 -1.05 0.00 0.00 58.31 52.73 2kqb n LYS 388 Cb 0.51 -2.01 -0.10 0.00 -0.65 0.00 0.00 35.03 32.78 2kqb n LYS 388 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2kqb s ASN 389 N -2.58 4.78 0.00 -5.58 -0.87 -1.26 -5.07 114.94 104.37 2kqb s ASN 389 Ca 0.42 -0.10 0.00 0.00 -1.57 0.00 0.00 52.86 51.61 2kqb s ASN 389 Cb 0.22 -1.16 0.00 0.00 -0.02 0.00 0.00 41.25 40.29 2kqb s ASN 389 CO -0.08 0.29 0.35 -0.81 -2.57 0.00 0.00 177.10 174.28 2kqb n PRO 390 N 1.54 0.00 -0.51 -0.60 -0.04 -1.26 -3.57 135.00 130.55 2kqb n PRO 390 Ca -0.15 0.42 0.44 0.00 -0.04 0.00 0.00 63.50 64.17 2kqb n PRO 390 Cb 0.53 -1.11 0.72 0.00 -0.04 0.00 0.00 33.50 33.59 2kqb n PRO 390 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2kqb h VAL 391 N 0.00 0.06 -0.51 0.52 2.07 -1.97 0.97 116.25 117.39 2kqb h VAL 391 Ca 0.00 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2kqb h VAL 391 Cb 0.00 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 2kqb h VAL 391 CO 0.00 0.00 0.02 -0.74 0.02 0.00 0.00 177.57 176.87 2kqb h HIS 392 N 0.00 0.91 -0.34 1.57 6.17 -1.96 -1.80 115.15 119.70 2kqb h HIS 392 Ca 0.76 -0.13 0.07 0.00 0.71 0.00 0.00 60.37 61.79 2kqb h HIS 392 Cb 3.31 -0.25 -0.02 0.00 2.52 0.00 0.00 27.41 32.97 2kqb h HIS 392 CO 0.00 0.82 0.24 0.74 0.71 0.00 0.00 177.93 180.44 2kqb h PHE 393 N 0.80 0.13 0.00 5.26 0.04 0.95 -0.15 116.94 123.96 2kqb h PHE 393 Ca 0.16 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.78 2kqb h PHE 393 Cb 0.46 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.54 2kqb h PHE 393 CO 0.03 0.07 -0.70 1.96 -0.60 0.00 0.00 178.31 179.07 2kqb h GLN 394 N 0.12 0.00 0.19 1.51 7.50 -1.37 -3.33 115.11 119.73 2kqb h GLN 394 Ca 0.16 0.00 -0.32 0.00 0.50 0.00 0.00 58.65 58.99 2kqb h GLN 394 Cb 0.47 0.00 0.02 0.00 0.05 0.00 0.00 27.48 28.01 2kqb h GLN 394 CO -0.02 0.70 -1.49 0.45 -1.50 0.00 0.00 178.83 176.97 2kqb h HIS 395 N 0.00 0.72 -4.14 2.96 3.86 -0.74 -3.36 115.15 114.45 2kqb h HIS 395 Ca -0.01 -0.52 -0.57 0.00 -1.16 0.00 0.00 60.37 58.11 2kqb h HIS 395 Cb 1.53 -0.03 -0.25 0.00 1.06 0.00 0.00 27.41 29.72 2kqb h HIS 395 CO 0.00 1.48 -0.84 -0.06 0.86 0.00 0.00 177.93 179.38 2kqb s PHE 396 N -2.61 1.76 0.54 2.45 0.40 -0.24 -4.48 117.98 115.80 2kqb s PHE 396 Ca -0.09 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 55.89 2kqb s PHE 396 Cb 0.06 -1.04 0.03 0.00 0.51 0.00 0.00 43.02 42.58 2kqb s PHE 396 CO 0.90 0.10 0.75 0.45 0.70 0.00 0.00 175.22 178.12 2kqb s SER 397 N -1.24 5.29 0.05 1.36 0.15 0.56 -4.46 113.70 115.40 2kqb s SER 397 Ca 0.07 -0.09 -0.01 0.00 0.70 0.00 0.00 55.95 56.61 2kqb s SER 397 Cb -0.09 -0.80 -0.04 0.00 -1.71 0.00 0.00 66.02 63.39 2kqb s SER 397 CO 0.02 -1.12 -0.02 -1.00 1.20 0.00 0.00 173.24 172.32 2kqb s HIS 398 N -2.72 0.47 0.36 3.44 3.76 -1.26 -0.36 115.29 118.99 2kqb s HIS 398 Ca 0.57 -0.98 -0.28 0.00 -0.15 0.00 0.00 55.06 54.22 2kqb s HIS 398 Cb -0.10 -0.35 -0.11 0.00 1.11 0.00 0.00 32.58 33.13 2kqb s HIS 398 CO 0.38 -0.36 1.46 -1.25 -0.85 0.00 0.00 174.74 174.11 2kqb s PRO 399 N -3.61 4.15 0.00 8.40 0.04 -1.26 -2.16 135.00 140.56 2kqb s PRO 399 Ca 0.04 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.59 2kqb s PRO 399 Cb 0.06 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.61 2kqb s PRO 399 CO -0.09 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 176.88 2kqb n GLY 400 N 0.60 0.54 3.53 0.56 0.00 -1.26 -5.06 105.19 104.10 2kqb n GLY 400 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2kqb n GLY 400 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kqb s ASP 401 N -2.88 4.31 0.56 1.61 1.01 -0.92 -5.00 116.67 115.35 2kqb s ASP 401 Ca 0.00 -0.16 0.30 0.00 0.71 0.00 0.00 52.55 53.40 2kqb s ASP 401 Cb 0.00 -0.96 1.46 0.00 1.01 0.00 0.00 42.92 44.43 2kqb s ASP 401 CO 0.00 0.33 1.89 0.28 0.21 0.00 0.00 175.17 177.88 2kqb h SER 402 N 5.04 0.00 -0.01 0.27 0.02 -1.97 -0.38 113.55 116.52 2kqb h SER 402 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2kqb h SER 402 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2kqb h SER 402 CO 0.51 0.00 -0.02 0.47 -1.14 0.00 0.00 176.83 176.66 2kqb n ASP 403 N -4.07 1.82 -4.61 3.07 8.00 -1.26 -4.97 116.55 114.53 2kqb n ASP 403 Ca 0.14 -1.59 -0.58 0.00 0.71 0.00 0.00 54.79 53.47 2kqb n ASP 403 Cb 0.84 0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.88 2kqb n ASP 403 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kqb n TYR 404 N 0.40 1.35 0.10 1.24 9.36 -0.15 -4.33 117.16 125.13 2kqb n TYR 404 Ca 0.17 0.86 0.04 0.00 3.32 0.00 0.00 57.90 62.29 2kqb n TYR 404 Cb 0.41 -2.25 -0.01 0.00 -0.63 0.00 0.00 39.34 36.86 2kqb n TYR 404 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2kqb h GLY 405 N 4.55 0.00 0.00 2.98 0.00 -1.81 -3.48 103.07 105.31 2kqb h GLY 405 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2kqb h GLY 405 CO 0.80 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.95 2kqb n GLY 406 N 1.27 0.30 2.55 4.60 0.00 -1.26 -4.88 105.19 107.78 2kqb n GLY 406 Ca -0.03 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 2kqb n GLY 406 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kqb s VAL 407 N 0.00 0.13 -0.43 1.61 1.01 -1.26 -4.79 120.40 116.66 2kqb s VAL 407 Ca 0.00 -1.06 0.07 0.00 0.00 0.00 0.00 61.98 60.98 2kqb s VAL 407 Cb 0.00 -1.12 0.18 0.00 0.00 0.00 0.00 36.38 35.44 2kqb s VAL 407 CO 0.00 -0.78 0.61 0.00 0.00 0.00 0.00 175.10 174.93 2kqb s GLN 408 N 1.80 0.86 -1.29 2.72 -2.07 -1.26 -5.06 119.66 115.37 2kqb s GLN 408 Ca 0.11 -0.63 -0.11 0.00 -1.82 0.00 0.00 55.36 52.92 2kqb s GLN 408 Cb -0.18 -0.12 0.15 0.00 -1.09 0.00 0.00 33.01 31.78 2kqb s GLN 408 CO -0.27 -1.23 1.85 -0.89 -1.32 0.00 0.00 175.29 173.42 2kqb n ILE 409 N 3.96 4.24 -3.27 3.63 5.41 -1.26 -4.76 119.36 127.31 2kqb n ILE 409 Ca 0.14 -4.31 -0.26 0.00 1.00 0.00 0.00 62.75 59.32 2kqb n ILE 409 Cb 0.55 -2.39 -0.07 0.00 -0.71 0.00 0.00 39.64 37.01 2kqb n ILE 409 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2kqb n VAL 410 N 3.73 1.52 -0.40 1.39 0.31 -1.26 -4.80 118.33 118.81 2kqb n VAL 410 Ca 0.41 -4.93 0.00 0.00 -0.01 0.00 0.00 64.34 59.81 2kqb n VAL 410 Cb 0.38 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 2kqb n VAL 410 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kqb n GLY 411 N 0.77 0.54 0.37 2.92 0.00 -1.26 -4.98 105.19 103.55 2kqb n GLY 411 Ca 0.27 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2kqb n GLY 411 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2kqb h GLN 412 N 0.00 -0.35 -0.22 1.61 4.20 -1.87 -2.99 115.11 115.49 2kqb h GLN 412 Ca 0.00 0.02 -0.16 0.00 0.06 0.00 0.00 58.65 58.58 2kqb h GLN 412 Cb 0.21 0.08 -0.12 0.00 0.30 0.00 0.00 27.48 27.95 2kqb h GLN 412 CO 0.00 -0.24 -0.56 -0.40 -0.67 0.00 0.00 178.83 176.97 2kqb n ASP 413 N -5.42 2.63 -3.09 1.46 5.75 -1.26 -4.80 116.55 111.81 2kqb n ASP 413 Ca -0.02 -3.86 -0.26 0.00 -0.01 0.00 0.00 54.79 50.65 2kqb n ASP 413 Cb 0.35 -0.49 -0.05 0.00 -1.03 0.00 0.00 41.12 39.90 2kqb n ASP 413 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2kqb n GLU 414 N -1.01 2.63 -3.04 0.11 1.02 -1.13 -4.94 120.64 114.28 2kqb n GLU 414 Ca 0.26 -4.53 -0.34 0.00 -0.02 0.00 0.00 57.16 52.54 2kqb n GLU 414 Cb 0.78 -2.11 -0.03 0.00 -0.02 0.00 0.00 31.44 30.06 2kqb n GLU 414 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2kqb n THR 415 N 0.15 4.14 -3.65 2.62 -2.24 -1.26 -4.89 114.28 109.14 2kqb n THR 415 Ca 0.29 -5.67 -0.37 0.00 -2.27 0.00 0.00 64.05 56.03 2kqb n THR 415 Cb 0.44 -1.83 -0.08 0.00 -2.10 0.00 0.00 70.33 66.76 2kqb n THR 415 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2kqb s ASP 416 N -2.28 5.64 0.00 3.42 1.11 -1.26 -5.24 116.67 118.05 2kqb s ASP 416 Ca 0.39 -3.13 0.03 0.00 0.18 0.00 0.00 52.55 50.02 2kqb s ASP 416 Cb 0.16 -1.91 0.03 0.00 1.07 0.00 0.00 42.92 42.27 2kqb s ASP 416 CO -0.03 -0.33 0.61 -0.67 1.18 0.00 0.00 175.17 175.94