#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 2.88 0.36 1.61 0.04 -1.26 -4.93 135.00 133.70 2kqb s PRO 364 Ca 0.00 -0.87 0.01 0.00 0.04 0.00 0.00 61.00 60.18 2kqb s PRO 364 Cb 0.00 -5.22 0.01 0.00 0.04 0.00 0.00 34.50 29.33 2kqb s PRO 364 CO 0.00 -3.21 0.07 1.28 0.04 0.00 0.00 177.00 175.18 2kqb n LEU 365 N 12.57 0.00 0.00 -3.56 4.32 -1.26 -5.04 117.00 124.03 2kqb n LEU 365 Ca 0.41 -2.14 0.00 0.00 -0.02 0.00 0.00 56.01 54.26 2kqb n LEU 365 Cb 0.47 0.18 0.00 0.00 -1.62 0.00 0.00 43.42 42.45 2kqb n LEU 365 CO 0.65 -0.36 0.00 0.61 -1.22 0.00 0.00 177.39 177.07 2kqb n GLY 366 N 0.72 1.01 3.03 -0.72 0.00 -1.26 -5.05 105.19 102.92 2kqb n GLY 366 Ca -0.11 -1.53 -0.14 0.00 0.00 0.00 0.00 46.02 44.24 2kqb n GLY 366 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kqb n SER 367 N 0.52 -7.18 -3.55 1.61 7.64 -1.26 -4.83 113.62 106.57 2kqb n SER 367 Ca 0.00 0.53 -0.40 0.00 1.01 0.00 0.00 58.87 60.00 2kqb n SER 367 Cb 0.00 -3.97 -0.00 0.00 -1.01 0.00 0.00 64.21 59.22 2kqb n SER 367 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kqb n GLY 368 N 0.12 5.13 2.95 0.23 0.00 -1.26 -4.91 105.19 107.46 2kqb n GLY 368 Ca 0.03 -2.06 -0.22 0.00 0.00 0.00 0.00 46.02 43.77 2kqb n GLY 368 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kqb s SER 369 N 0.46 1.26 -0.55 1.61 1.04 -1.26 -5.05 113.70 111.21 2kqb s SER 369 Ca 0.52 -0.20 0.04 0.00 0.48 0.00 0.00 55.95 56.79 2kqb s SER 369 Cb 0.17 -0.57 0.39 0.00 0.10 0.00 0.00 66.02 66.11 2kqb s SER 369 CO -0.08 -0.01 1.25 -0.62 0.98 0.00 0.00 173.24 174.77 2kqb n GLU 370 N 3.86 3.38 -2.65 4.02 1.02 -1.25 -4.74 120.64 124.27 2kqb n GLU 370 Ca -0.24 -4.43 -0.07 0.00 -0.02 0.00 0.00 57.16 52.40 2kqb n GLU 370 Cb 0.52 -2.26 0.04 0.00 -0.02 0.00 0.00 31.44 29.71 2kqb n GLU 370 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kqb n GLY 371 N -0.43 2.73 2.06 0.62 0.00 -1.25 -4.47 105.19 104.46 2kqb n GLY 371 Ca 0.40 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.51 -1.27 -2.84 1.61 4.13 -1.26 -5.01 115.26 110.11 2kqb n ASN 372 Ca 0.15 0.59 -0.12 0.00 1.68 0.00 0.00 54.58 56.88 2kqb n ASN 372 Cb 0.83 1.36 0.02 0.00 -1.54 0.00 0.00 39.78 40.44 2kqb n ASN 372 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 2kqb n LYS 373 N -3.43 1.08 -3.96 3.52 3.00 -1.26 -5.11 118.16 112.00 2kqb n LYS 373 Ca 0.00 -3.20 -0.08 0.00 -0.00 0.00 0.00 58.31 55.02 2kqb n LYS 373 Cb 0.00 -1.34 -0.08 0.00 0.00 0.00 0.00 35.03 33.61 2kqb n LYS 373 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2kqb s VAL 374 N -2.67 0.15 -1.00 3.15 1.01 -1.26 -5.09 120.40 114.69 2kqb s VAL 374 Ca 0.31 -1.45 -0.19 0.00 0.00 0.00 0.00 61.98 60.65 2kqb s VAL 374 Cb 0.42 -1.52 0.11 0.00 0.00 0.00 0.00 36.38 35.39 2kqb s VAL 374 CO -0.01 -0.69 1.26 -0.54 0.00 0.00 0.00 175.10 175.13 2kqb s LYS 375 N -3.91 3.67 0.55 2.72 3.01 -1.26 -4.85 119.74 119.67 2kqb s LYS 375 Ca 0.09 -1.72 -0.19 0.00 -1.01 0.00 0.00 55.97 53.13 2kqb s LYS 375 Cb 0.06 -5.06 -0.08 0.00 -1.01 0.00 0.00 37.83 31.74 2kqb s LYS 375 CO -0.08 -1.89 0.72 0.54 0.51 0.00 0.00 175.35 175.15 2kqb n ARG 376 N 7.06 0.74 -2.60 1.68 1.74 -1.26 -4.91 116.66 119.11 2kqb n ARG 376 Ca 0.29 0.28 -0.42 0.00 -0.77 0.00 0.00 57.85 57.23 2kqb n ARG 376 Cb 0.49 -1.87 -0.03 0.00 -1.02 0.00 0.00 32.46 30.03 2kqb n ARG 376 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2kqb s THR 377 N -1.58 4.40 0.74 0.55 2.01 -1.24 -4.36 115.64 116.15 2kqb s THR 377 Ca 0.70 1.82 -0.16 0.00 0.31 0.00 0.00 61.69 64.36 2kqb s THR 377 Cb -0.46 -4.16 -0.05 0.00 0.01 0.00 0.00 72.50 67.83 2kqb s THR 377 CO 0.53 0.20 0.41 -0.24 -0.69 0.00 0.00 174.62 174.82 2kqb n SER 378 N 3.44 -1.67 -4.86 3.53 2.88 -1.26 0.46 113.62 116.14 2kqb n SER 378 Ca 0.06 0.55 -0.31 0.00 -1.33 0.00 0.00 58.87 57.84 2kqb n SER 378 Cb 0.49 -1.17 0.01 0.00 -0.75 0.00 0.00 64.21 62.79 2kqb n SER 378 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kqb h MET 380 N -0.20 0.00 0.00 0.00 2.86 -1.92 -1.69 114.93 113.98 2kqb h MET 380 Ca -0.44 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 2kqb h MET 380 Cb 1.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.85 2kqb h MET 380 CO 0.61 0.00 -0.80 1.88 1.06 0.00 0.00 176.91 179.67 2kqb h TYR 381 N 0.00 0.00 0.00 -0.22 0.05 -1.92 -3.48 116.97 111.40 2kqb h TYR 381 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2kqb h TYR 381 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2kqb h TYR 381 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 2kqb n GLY 382 N 1.17 0.80 0.72 3.88 0.00 -0.64 -2.12 105.19 109.01 2kqb n GLY 382 Ca 0.01 0.50 0.08 0.00 0.00 0.00 0.00 46.02 46.61 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 4.42 2.41 -1.28 4.61 0.00 -1.26 -4.04 120.51 125.37 2kqb n ALA 383 Ca 0.00 -0.79 0.08 0.00 0.00 0.00 0.00 53.44 52.73 2kqb n ALA 383 Cb 0.00 -0.57 0.15 0.00 0.00 0.00 0.00 19.45 19.03 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 0.92 2.05 -4.55 0.00 3.02 -0.90 -4.98 115.26 110.83 2kqb n ASN 384 Ca 0.11 -3.24 -0.13 0.00 -0.03 0.00 0.00 54.58 51.29 2kqb n ASN 384 Cb 0.43 -0.44 -0.11 0.00 -0.61 0.00 0.00 39.78 39.04 2kqb n ASN 384 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kqb h TYR 386 N 11.58 0.06 -4.36 0.00 -0.00 -1.98 -3.42 116.97 118.86 2kqb h TYR 386 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 58.73 58.23 2kqb h TYR 386 Cb 1.00 -0.02 0.09 0.00 0.00 0.00 0.00 36.73 37.80 2kqb h TYR 386 CO 1.04 0.02 0.38 -0.98 -0.00 0.00 0.00 178.16 178.62 2kqb s ARG 387 N -5.06 2.73 -0.35 0.10 1.70 -1.26 -5.06 118.95 111.75 2kqb s ARG 387 Ca -0.05 0.69 0.04 0.00 -0.47 0.00 0.00 55.73 55.94 2kqb s ARG 387 Cb 0.20 -1.99 0.17 0.00 -0.57 0.00 0.00 34.95 32.76 2kqb s ARG 387 CO 0.74 -1.18 0.48 -1.59 -1.08 0.00 0.00 175.30 172.67 2kqb s LYS 388 N -5.18 0.62 0.17 3.89 -2.85 -1.26 -5.15 119.74 109.97 2kqb s LYS 388 Ca 0.59 -0.28 0.10 0.00 -1.00 0.00 0.00 55.97 55.37 2kqb s LYS 388 Cb -0.13 -0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.32 2kqb s LYS 388 CO 0.54 -1.14 -0.16 -0.80 0.10 0.00 0.00 175.35 173.89 2kqb s ASN 389 N 2.00 3.90 0.00 0.03 -0.87 -1.26 -5.08 114.94 113.66 2kqb s ASN 389 Ca 0.14 -0.66 0.00 0.00 -1.57 0.00 0.00 52.86 50.77 2kqb s ASN 389 Cb -0.11 -0.53 0.00 0.00 -0.02 0.00 0.00 41.25 40.60 2kqb s ASN 389 CO -0.14 0.13 0.60 -0.81 -2.57 0.00 0.00 177.10 174.30 2kqb n PRO 390 N 0.32 0.00 -0.31 -0.60 -0.04 -1.26 -2.48 135.00 130.63 2kqb n PRO 390 Ca -0.13 0.35 0.35 0.00 -0.04 0.00 0.00 63.50 64.03 2kqb n PRO 390 Cb 0.55 -1.20 0.74 0.00 -0.04 0.00 0.00 33.50 33.54 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 0.33 -0.38 0.52 2.07 -2.01 0.57 116.25 117.35 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 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 2kqb h VAL 391 CO 0.00 0.00 -0.11 -0.74 0.02 0.00 0.00 177.57 176.74 2kqb h HIS 392 N 0.00 0.71 0.00 1.57 6.17 -1.96 -2.10 115.15 119.54 2kqb h HIS 392 Ca 0.56 -0.12 -0.01 0.00 0.71 0.00 0.00 60.37 61.51 2kqb h HIS 392 Cb 2.35 -0.19 -0.00 0.00 2.52 0.00 0.00 27.41 32.09 2kqb h HIS 392 CO 0.00 0.74 -0.04 0.74 0.71 0.00 0.00 177.93 180.07 2kqb h PHE 393 N 0.60 0.00 0.00 5.26 0.04 0.48 -1.29 116.94 122.03 2kqb h PHE 393 Ca 0.11 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.73 2kqb h PHE 393 Cb 0.54 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.67 2kqb h PHE 393 CO 0.02 0.04 -0.78 1.96 -0.60 0.00 0.00 178.31 178.96 2kqb h GLN 394 N 0.00 0.00 0.10 1.51 7.50 -1.39 -3.37 115.11 119.46 2kqb h GLN 394 Ca -0.00 0.00 -0.36 0.00 0.50 0.00 0.00 58.65 58.79 2kqb h GLN 394 Cb 0.13 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.63 2kqb h GLN 394 CO 0.01 0.64 -2.01 0.72 -1.50 0.00 0.00 178.83 176.68 2kqb n HIS 395 N -3.23 1.11 -4.85 2.96 8.25 -0.76 -3.80 115.22 114.90 2kqb n HIS 395 Ca -0.00 0.25 -0.33 0.00 -0.26 0.00 0.00 57.72 57.38 2kqb n HIS 395 Cb 0.82 -1.15 -0.14 0.00 1.12 0.00 0.00 29.99 30.64 2kqb n HIS 395 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2kqb s PHE 396 N -2.56 2.75 0.53 4.41 0.40 -0.56 -3.72 117.98 119.23 2kqb s PHE 396 Ca -0.21 -0.39 -0.02 0.00 -0.60 0.00 0.00 56.93 55.71 2kqb s PHE 396 Cb 0.07 -1.73 0.01 0.00 0.51 0.00 0.00 43.02 41.88 2kqb s PHE 396 CO 0.76 -0.00 0.78 0.45 0.70 0.00 0.00 175.22 177.91 2kqb s SER 397 N -0.23 5.62 0.06 1.36 0.15 0.17 -4.56 113.70 116.28 2kqb s SER 397 Ca 0.01 0.40 -0.03 0.00 0.70 0.00 0.00 55.95 57.03 2kqb s SER 397 Cb -0.13 -1.48 -0.03 0.00 -1.71 0.00 0.00 66.02 62.67 2kqb s SER 397 CO 0.03 -0.94 0.04 -1.00 1.20 0.00 0.00 173.24 172.57 2kqb s HIS 398 N -2.77 0.40 0.39 3.44 3.76 -1.26 -0.94 115.29 118.30 2kqb s HIS 398 Ca 0.52 -0.90 -0.28 0.00 -0.15 0.00 0.00 55.06 54.26 2kqb s HIS 398 Cb -0.10 -0.28 -0.11 0.00 1.11 0.00 0.00 32.58 33.20 2kqb s HIS 398 CO 0.41 -0.42 1.48 -1.25 -0.85 0.00 0.00 174.74 174.11 2kqb s PRO 399 N -3.80 4.05 0.00 8.40 0.04 -1.26 -2.22 135.00 140.21 2kqb s PRO 399 Ca 0.05 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.66 2kqb s PRO 399 Cb 0.06 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.68 2kqb s PRO 399 CO -0.10 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.77 2kqb n GLY 400 N 0.46 0.63 3.74 0.56 0.00 -1.26 -5.07 105.19 104.26 2kqb n GLY 400 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.98 5.39 0.60 1.61 1.01 -0.94 -4.99 116.67 116.37 2kqb s ASP 401 Ca 0.00 0.02 0.30 0.00 0.71 0.00 0.00 52.55 53.58 2kqb s ASP 401 Cb 0.00 -1.45 1.66 0.00 1.01 0.00 0.00 42.92 44.14 2kqb s ASP 401 CO 0.00 0.24 2.05 0.28 0.21 0.00 0.00 175.17 177.95 2kqb h SER 402 N 3.90 0.00 -0.45 0.27 0.02 -1.97 -2.06 113.55 113.26 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 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2kqb h SER 402 CO 0.61 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.77 2kqb n ASP 403 N -3.62 3.40 -4.67 3.07 8.00 -1.26 -5.02 116.55 116.45 2kqb n ASP 403 Ca 0.02 -2.13 -0.44 0.00 0.71 0.00 0.00 54.79 52.96 2kqb n ASP 403 Cb 0.39 -0.35 -0.01 0.00 -0.02 0.00 0.00 41.12 41.13 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 0.74 2.06 -2.70 1.24 9.36 -0.78 -4.17 117.16 122.91 2kqb n TYR 404 Ca 0.17 0.55 -0.02 0.00 3.32 0.00 0.00 57.90 61.91 2kqb n TYR 404 Cb 0.55 -2.40 0.11 0.00 -0.63 0.00 0.00 39.34 36.98 2kqb n TYR 404 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2kqb n GLY 405 N 1.26 1.96 0.08 2.98 0.00 -1.26 -4.99 105.19 105.22 2kqb n GLY 405 Ca 0.08 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 2kqb n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kqb n GLY 406 N -1.31 -0.81 3.96 -0.02 0.00 -1.26 -4.60 105.19 101.15 2kqb n GLY 406 Ca -0.12 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 2kqb n GLY 406 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2kqb n VAL 407 N -4.53 -1.62 -3.27 1.61 0.31 -1.26 -4.90 118.33 104.67 2kqb n VAL 407 Ca -0.14 -0.37 -0.23 0.00 -0.01 0.00 0.00 64.34 63.58 2kqb n VAL 407 Cb 0.41 -1.38 -0.08 0.00 -0.91 0.00 0.00 33.84 31.89 2kqb n VAL 407 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kqb n GLN 408 N -3.56 0.31 -2.75 5.55 10.64 -1.26 -5.01 117.38 121.30 2kqb n GLN 408 Ca -0.07 -3.00 -0.40 0.00 -1.83 0.00 0.00 57.00 51.70 2kqb n GLN 408 Cb 0.35 -1.58 0.01 0.00 -0.86 0.00 0.00 30.24 28.16 2kqb n GLN 408 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 2kqb n ILE 409 N 2.65 5.71 -3.58 -0.39 5.41 -1.26 -4.84 119.36 123.06 2kqb n ILE 409 Ca 0.27 -5.94 -0.33 0.00 1.00 0.00 0.00 62.75 57.75 2kqb n ILE 409 Cb 0.50 -1.66 -0.07 0.00 -0.71 0.00 0.00 39.64 37.70 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 0.23 2.83 -1.34 1.39 0.31 -1.26 -4.72 118.33 115.77 2kqb n VAL 410 Ca 0.41 -5.18 0.00 0.00 -0.01 0.00 0.00 64.34 59.57 2kqb n VAL 410 Cb 0.29 -2.25 0.00 0.00 -0.91 0.00 0.00 33.84 30.97 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 1.80 0.80 0.31 2.92 0.00 -1.26 -4.99 105.19 104.77 2kqb n GLY 411 Ca 0.24 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.39 -0.11 1.61 4.20 -1.88 -3.38 115.11 115.16 2kqb h GLN 412 Ca 0.00 0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.55 2kqb h GLN 412 Cb 0.83 0.09 -0.27 0.00 0.30 0.00 0.00 27.48 28.42 2kqb h GLN 412 CO 0.00 -0.26 -0.70 -0.25 -0.67 0.00 0.00 178.83 176.95 2kqb n ASP 413 N -4.47 0.08 -3.96 1.46 8.00 -1.26 -5.00 116.55 111.40 2kqb n ASP 413 Ca -0.04 -2.06 -0.31 0.00 0.71 0.00 0.00 54.79 53.09 2kqb n ASP 413 Cb 0.25 0.03 0.02 0.00 -0.02 0.00 0.00 41.12 41.40 2kqb n ASP 413 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2kqb n GLU 414 N -0.40 -5.08 -3.19 -1.24 1.02 -1.26 -4.90 120.64 105.59 2kqb n GLU 414 Ca -0.08 0.56 -0.30 0.00 -0.02 0.00 0.00 57.16 57.32 2kqb n GLU 414 Cb 0.89 -5.40 -0.05 0.00 -0.02 0.00 0.00 31.44 26.86 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 -4.62 3.25 -3.80 2.62 -2.24 -1.26 -4.97 114.28 103.26 2kqb n THR 415 Ca 0.03 -5.48 -0.33 0.00 -2.27 0.00 0.00 64.05 56.00 2kqb n THR 415 Cb 0.53 -1.89 -0.11 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 -2.55 4.99 0.00 3.42 1.11 -1.26 -5.12 116.67 117.26 2kqb s ASP 416 Ca 0.41 -3.14 0.00 0.00 0.18 0.00 0.00 52.55 50.00 2kqb s ASP 416 Cb 0.17 -1.77 0.00 0.00 1.07 0.00 0.00 42.92 42.39 2kqb s ASP 416 CO -0.03 -0.27 0.00 -0.67 1.18 0.00 0.00 175.17 175.38