#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 4.55 0.09 1.61 0.04 -1.26 -4.96 135.00 135.07 2kqb s PRO 364 Ca 0.00 1.89 0.00 0.00 0.04 0.00 0.00 61.00 62.93 2kqb s PRO 364 Cb 0.00 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.36 2kqb s PRO 364 CO 0.00 0.06 0.00 1.28 0.04 0.00 0.00 177.00 178.38 2kqb n LEU 365 N 1.49 0.80 0.00 -3.56 4.77 -1.26 -5.06 117.00 114.18 2kqb n LEU 365 Ca 0.01 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2kqb n LEU 365 Cb 0.44 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2kqb n LEU 365 CO 0.55 -0.70 0.00 0.61 -1.33 0.00 0.00 177.39 176.52 2kqb n GLY 366 N 3.35 3.13 1.93 -0.72 0.00 -1.26 -4.77 105.19 106.85 2kqb n GLY 366 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 0.53 -0.08 0.00 1.61 7.64 -1.26 -5.18 113.62 116.88 2kqb n SER 367 Ca 0.00 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.30 2kqb n SER 367 Cb 0.00 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 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 1.65 0.99 2.47 0.23 0.00 -1.26 -5.00 105.19 104.27 2kqb n GLY 368 Ca 0.00 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.79 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 2.76 2.20 -2.33 1.61 7.64 -1.26 -5.08 113.62 119.16 2kqb n SER 369 Ca 0.00 -3.08 -0.10 0.00 1.01 0.00 0.00 58.87 56.71 2kqb n SER 369 Cb 0.00 -0.67 -0.02 0.00 -1.01 0.00 0.00 64.21 62.51 2kqb n SER 369 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2kqb n GLU 370 N 1.49 0.49 0.00 1.43 0.00 -1.26 -4.73 120.64 118.06 2kqb n GLU 370 Ca 0.26 -1.85 0.00 0.00 0.00 0.00 0.00 57.16 55.57 2kqb n GLU 370 Cb 0.43 1.81 0.00 0.00 0.00 0.00 0.00 31.44 33.69 2kqb n GLU 370 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2kqb n GLY 371 N -0.39 -0.02 2.69 -1.84 0.00 -1.26 -4.69 105.19 99.68 2kqb n GLY 371 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 4.20 -3.59 1.61 4.13 -1.26 -4.91 115.26 115.44 2kqb n ASN 372 Ca 0.00 -3.57 -0.27 0.00 1.68 0.00 0.00 54.58 52.42 2kqb n ASN 372 Cb 0.00 -0.62 0.05 0.00 -1.54 0.00 0.00 39.78 37.66 2kqb n ASN 372 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2kqb n LYS 373 N 0.29 -1.73 -4.17 3.52 4.01 -1.26 -5.01 118.16 113.81 2kqb n LYS 373 Ca 0.31 0.56 -0.11 0.00 -0.51 0.00 0.00 58.31 58.56 2kqb n LYS 373 Cb 0.40 -4.59 -0.10 0.00 -0.51 0.00 0.00 35.03 30.23 2kqb n LYS 373 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2kqb s VAL 374 N -3.47 0.60 -0.91 -0.18 0.11 -1.26 -5.08 120.40 110.21 2kqb s VAL 374 Ca 0.43 -1.93 -0.21 0.00 -2.93 0.00 0.00 61.98 57.35 2kqb s VAL 374 Cb -0.13 -1.78 0.09 0.00 -1.53 0.00 0.00 36.38 33.04 2kqb s VAL 374 CO 0.83 -0.78 1.21 -0.54 -3.33 0.00 0.00 175.10 172.49 2kqb s LYS 375 N -3.87 3.50 0.65 1.54 1.02 -1.26 -4.83 119.74 116.49 2kqb s LYS 375 Ca 0.15 -1.35 -0.17 0.00 0.02 0.00 0.00 55.97 54.61 2kqb s LYS 375 Cb 0.06 -4.91 -0.01 0.00 -0.52 0.00 0.00 37.83 32.45 2kqb s LYS 375 CO -0.03 -1.93 1.23 1.03 -0.92 0.00 0.00 175.35 174.72 2kqb s ARG 376 N 3.74 2.60 0.51 1.68 1.81 -1.25 -4.97 118.95 123.08 2kqb s ARG 376 Ca 0.35 1.85 -0.20 0.00 -1.72 0.00 0.00 55.73 56.01 2kqb s ARG 376 Cb -0.05 -1.88 -0.07 0.00 -0.45 0.00 0.00 34.95 32.50 2kqb s ARG 376 CO -0.06 -1.50 1.10 -0.08 -0.68 0.00 0.00 175.30 174.09 2kqb s THR 377 N -1.69 3.37 0.94 0.02 -1.32 -1.26 -4.26 115.64 111.45 2kqb s THR 377 Ca 0.77 0.88 -0.11 0.00 -1.21 0.00 0.00 61.69 62.02 2kqb s THR 377 Cb -0.31 -3.36 0.16 0.00 -1.51 0.00 0.00 72.50 67.47 2kqb s THR 377 CO 0.39 -0.17 1.12 -0.55 -2.21 0.00 0.00 174.62 173.20 2kqb s SER 378 N -1.80 2.81 0.79 8.08 0.15 -1.26 0.16 113.70 122.62 2kqb s SER 378 Ca 0.70 2.00 -0.12 0.00 0.70 0.00 0.00 55.95 59.23 2kqb s SER 378 Cb -0.22 -2.50 0.06 0.00 -1.71 0.00 0.00 66.02 61.66 2kqb s SER 378 CO 0.25 -3.14 1.11 0.00 1.20 0.00 0.00 173.24 172.67 2kqb h MET 380 N -1.01 0.82 0.00 0.00 4.05 -1.94 -2.12 114.93 114.73 2kqb h MET 380 Ca -0.47 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 58.80 2kqb h MET 380 Cb 1.28 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 31.88 2kqb h MET 380 CO 0.62 0.54 -0.84 1.88 0.23 0.00 0.00 176.91 179.34 2kqb h TYR 381 N 0.84 0.00 0.00 1.39 0.05 -1.92 -3.48 116.97 113.85 2kqb h TYR 381 Ca 0.28 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.06 2kqb h TYR 381 Cb 0.06 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.80 2kqb h TYR 381 CO -0.00 0.42 0.00 0.41 -1.05 0.00 0.00 178.16 177.94 2kqb n GLY 382 N 1.27 1.26 0.74 3.88 0.00 -0.80 -2.98 105.19 108.56 2kqb n GLY 382 Ca -0.02 0.40 0.11 0.00 0.00 0.00 0.00 46.02 46.51 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 1.90 2.81 -0.59 4.61 0.00 -1.26 -4.03 120.51 123.95 2kqb n ALA 383 Ca 0.00 -0.66 0.04 0.00 0.00 0.00 0.00 53.44 52.82 2kqb n ALA 383 Cb 0.00 -0.74 0.05 0.00 0.00 0.00 0.00 19.45 18.76 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 0.81 1.90 -4.30 0.00 3.02 -1.16 -5.01 115.26 110.52 2kqb n ASN 384 Ca 0.11 -2.36 -0.10 0.00 -0.03 0.00 0.00 54.58 52.21 2kqb n ASN 384 Cb 0.51 -0.18 -0.09 0.00 -0.61 0.00 0.00 39.78 39.41 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 10.43 0.52 -4.27 0.00 -0.00 -1.99 -3.41 116.97 118.25 2kqb h TYR 386 Ca 0.01 0.02 -0.49 0.00 0.00 0.00 0.00 58.73 58.27 2kqb h TYR 386 Cb 1.04 -0.16 0.12 0.00 0.00 0.00 0.00 36.73 37.73 2kqb h TYR 386 CO 1.40 0.11 0.33 -0.98 -0.00 0.00 0.00 178.16 179.02 2kqb s ARG 387 N -5.40 2.09 -0.46 0.10 1.70 -1.26 -5.05 118.95 110.67 2kqb s ARG 387 Ca -0.08 0.73 0.06 0.00 -0.47 0.00 0.00 55.73 55.98 2kqb s ARG 387 Cb 0.23 -1.91 0.18 0.00 -0.57 0.00 0.00 34.95 32.88 2kqb s ARG 387 CO 0.79 -1.64 0.61 -1.59 -1.08 0.00 0.00 175.30 172.38 2kqb s LYS 388 N -5.10 0.93 0.22 3.89 -2.85 -1.26 -5.15 119.74 110.43 2kqb s LYS 388 Ca 0.61 -0.97 0.10 0.00 -1.00 0.00 0.00 55.97 54.71 2kqb s LYS 388 Cb -0.15 -0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.30 2kqb s LYS 388 CO 0.55 -1.28 -0.13 -0.80 0.10 0.00 0.00 175.35 173.79 2kqb s ASN 389 N 1.09 4.01 0.00 0.03 -0.87 -1.26 -5.09 114.94 112.85 2kqb s ASN 389 Ca 0.25 -0.75 0.00 0.00 -1.57 0.00 0.00 52.86 50.79 2kqb s ASN 389 Cb -0.03 -0.56 0.00 0.00 -0.02 0.00 0.00 41.25 40.64 2kqb s ASN 389 CO -0.07 0.07 0.47 -0.81 -2.57 0.00 0.00 177.10 174.19 2kqb n PRO 390 N -0.26 0.00 -0.45 -0.60 -0.04 -1.26 -2.72 135.00 129.67 2kqb n PRO 390 Ca -0.09 0.36 0.40 0.00 -0.04 0.00 0.00 63.50 64.13 2kqb n PRO 390 Cb 0.57 -1.13 0.75 0.00 -0.04 0.00 0.00 33.50 33.65 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 0.26 -0.43 0.52 2.07 -2.00 0.76 116.25 117.43 2kqb h VAL 391 Ca 0.00 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 2kqb h VAL 391 Cb 0.00 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2kqb h VAL 391 CO 0.00 0.01 -0.04 -0.74 0.02 0.00 0.00 177.57 176.82 2kqb h HIS 392 N 0.03 0.76 -0.14 1.57 6.17 -1.97 -1.93 115.15 119.65 2kqb h HIS 392 Ca 0.71 -0.11 0.04 0.00 0.71 0.00 0.00 60.37 61.72 2kqb h HIS 392 Cb 2.72 -0.21 -0.01 0.00 2.52 0.00 0.00 27.41 32.44 2kqb h HIS 392 CO -0.00 0.74 0.12 0.74 0.71 0.00 0.00 177.93 180.23 2kqb h PHE 393 N 0.67 0.00 0.00 5.26 0.04 0.76 -0.46 116.94 123.21 2kqb h PHE 393 Ca 0.13 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.76 2kqb h PHE 393 Cb 0.46 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 2kqb h PHE 393 CO 0.02 0.00 -0.65 1.96 -0.60 0.00 0.00 178.31 179.04 2kqb h GLN 394 N 0.00 0.00 0.17 1.51 7.50 -1.37 -3.32 115.11 119.59 2kqb h GLN 394 Ca 0.07 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 58.90 2kqb h GLN 394 Cb 0.30 0.00 0.01 0.00 0.05 0.00 0.00 27.48 27.84 2kqb h GLN 394 CO -0.00 0.65 -1.48 0.45 -1.50 0.00 0.00 178.83 176.95 2kqb h HIS 395 N 0.00 0.64 -4.07 2.96 3.86 -1.02 -3.41 115.15 114.11 2kqb h HIS 395 Ca -0.01 -0.47 -0.45 0.00 -1.16 0.00 0.00 60.37 58.28 2kqb h HIS 395 Cb 1.42 -0.03 -0.26 0.00 1.06 0.00 0.00 27.41 29.61 2kqb h HIS 395 CO 0.00 1.45 -0.80 -0.06 0.86 0.00 0.00 177.93 179.38 2kqb s PHE 396 N -2.62 1.23 0.47 2.45 0.40 -0.74 -4.42 117.98 114.76 2kqb s PHE 396 Ca -0.09 -0.33 0.03 0.00 -0.60 0.00 0.00 56.93 55.94 2kqb s PHE 396 Cb 0.06 -0.74 0.01 0.00 0.51 0.00 0.00 43.02 42.86 2kqb s PHE 396 CO 0.89 0.02 0.67 -1.12 0.70 0.00 0.00 175.22 176.38 2kqb s SER 397 N -0.97 5.58 0.05 1.36 0.01 0.41 -4.51 113.70 115.63 2kqb s SER 397 Ca 0.02 -0.03 -0.02 0.00 1.31 0.00 0.00 55.95 57.23 2kqb s SER 397 Cb -0.07 -1.05 -0.03 0.00 0.21 0.00 0.00 66.02 65.07 2kqb s SER 397 CO 0.01 -0.86 -0.01 -1.00 0.41 0.00 0.00 173.24 171.79 2kqb s HIS 398 N -2.55 0.42 0.33 2.43 3.76 -1.26 -0.55 115.29 117.87 2kqb s HIS 398 Ca 0.53 -0.89 -0.29 0.00 -0.15 0.00 0.00 55.06 54.25 2kqb s HIS 398 Cb -0.10 -0.31 -0.11 0.00 1.11 0.00 0.00 32.58 33.16 2kqb s HIS 398 CO 0.36 -0.35 1.54 -1.25 -0.85 0.00 0.00 174.74 174.19 2kqb s PRO 399 N -3.35 4.12 0.00 8.40 0.04 -1.26 -2.20 135.00 140.75 2kqb s PRO 399 Ca 0.02 2.57 0.00 0.00 0.04 0.00 0.00 61.00 63.63 2kqb s PRO 399 Cb 0.04 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.58 2kqb s PRO 399 CO -0.08 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.79 2kqb n GLY 400 N 1.41 0.52 3.55 0.56 0.00 -1.26 -5.07 105.19 104.90 2kqb n GLY 400 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.95 4.51 0.58 1.61 1.11 -0.94 -5.00 116.67 115.61 2kqb s ASP 401 Ca 0.00 -0.07 0.30 0.00 0.18 0.00 0.00 52.55 52.96 2kqb s ASP 401 Cb 0.00 -1.15 1.41 0.00 1.07 0.00 0.00 42.92 44.25 2kqb s ASP 401 CO 0.00 0.34 1.80 -1.28 1.18 0.00 0.00 175.17 177.22 2kqb h SER 402 N 5.39 0.00 -0.21 0.27 0.87 -1.93 -0.30 113.55 117.63 2kqb h SER 402 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2kqb h SER 402 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2kqb h SER 402 CO 0.52 0.00 0.00 0.47 -0.53 0.00 0.00 176.83 177.29 2kqb n ASP 403 N -3.73 2.79 -4.54 6.23 8.00 -1.26 -5.00 116.55 119.05 2kqb n ASP 403 Ca 0.13 -1.89 -0.43 0.00 0.71 0.00 0.00 54.79 53.30 2kqb n ASP 403 Cb 0.87 -0.13 -0.00 0.00 -0.02 0.00 0.00 41.12 41.84 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 1.09 0.62 -2.67 1.24 9.36 -0.13 -3.92 117.16 122.76 2kqb n TYR 404 Ca 0.17 0.67 -0.05 0.00 3.32 0.00 0.00 57.90 62.01 2kqb n TYR 404 Cb 0.53 -2.15 0.06 0.00 -0.63 0.00 0.00 39.34 37.15 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 1.43 0.44 2.69 2.98 0.00 -1.26 -4.99 105.19 106.48 2kqb n GLY 405 Ca 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.61 -1.41 3.51 -0.02 0.00 -1.26 -4.28 105.19 101.12 2kqb n GLY 406 Ca -0.14 1.07 -0.43 0.00 0.00 0.00 0.00 46.02 46.52 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 0.91 4.62 -0.58 1.61 1.01 -1.26 -4.63 120.40 122.07 2kqb s VAL 407 Ca 0.25 -2.19 0.00 0.00 0.00 0.00 0.00 61.98 60.04 2kqb s VAL 407 Cb 0.10 -5.02 0.15 0.00 0.00 0.00 0.00 36.38 31.62 2kqb s VAL 407 CO -0.09 -1.78 0.37 -1.10 0.00 0.00 0.00 175.10 172.49 2kqb s GLN 408 N 2.82 2.32 -0.67 2.72 -0.21 -1.26 -4.98 119.66 120.40 2kqb s GLN 408 Ca 0.46 -2.60 0.05 0.00 0.02 0.00 0.00 55.36 53.30 2kqb s GLN 408 Cb -0.00 -3.55 0.25 0.00 1.00 0.00 0.00 33.01 30.71 2kqb s GLN 408 CO 0.02 -1.15 0.78 -0.89 -2.12 0.00 0.00 175.29 171.93 2kqb n ILE 409 N 3.28 2.51 -3.44 1.08 5.41 -1.26 -4.76 119.36 122.18 2kqb n ILE 409 Ca 0.07 -5.25 -0.43 0.00 1.00 0.00 0.00 62.75 58.14 2kqb n ILE 409 Cb 0.35 -2.10 -0.03 0.00 -0.71 0.00 0.00 39.64 37.15 2kqb n ILE 409 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2kqb s VAL 410 N -2.45 5.30 -0.30 1.39 1.01 -1.26 -4.60 120.40 119.48 2kqb s VAL 410 Ca 0.39 -3.18 -0.02 0.00 0.00 0.00 0.00 61.98 59.17 2kqb s VAL 410 Cb 0.13 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 2kqb s VAL 410 CO -0.01 -1.08 0.26 0.61 0.00 0.00 0.00 175.10 174.88 2kqb n GLY 411 N 3.09 0.30 0.37 4.51 0.00 -1.26 -4.91 105.19 107.29 2kqb n GLY 411 Ca 0.19 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.30 1.11 -0.72 1.61 1.08 -1.94 -2.46 115.11 113.49 2kqb h GLN 412 Ca -0.17 -0.07 -0.50 0.00 -1.45 0.00 0.00 58.65 56.46 2kqb h GLN 412 Cb 1.09 -0.25 -0.33 0.00 -0.05 0.00 0.00 27.48 27.94 2kqb h GLN 412 CO 0.13 0.74 -0.26 -0.25 -0.95 0.00 0.00 178.83 178.23 2kqb n ASP 413 N -4.51 5.08 -3.15 1.46 8.00 -1.26 -4.76 116.55 117.41 2kqb n ASP 413 Ca 0.16 -3.77 -0.19 0.00 0.71 0.00 0.00 54.79 51.69 2kqb n ASP 413 Cb 0.20 -0.56 -0.03 0.00 -0.02 0.00 0.00 41.12 40.72 2kqb n ASP 413 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2kqb n GLU 414 N -0.85 1.26 -3.11 -1.24 2.13 -0.93 -4.98 120.64 112.93 2kqb n GLU 414 Ca 0.46 -3.57 -0.31 0.00 0.66 0.00 0.00 57.16 54.40 2kqb n GLU 414 Cb 0.90 -1.77 -0.04 0.00 0.27 0.00 0.00 31.44 30.79 2kqb n GLU 414 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2kqb n THR 415 N 0.21 3.55 -2.54 6.31 -2.24 -1.26 -4.81 114.28 113.49 2kqb n THR 415 Ca 0.26 -5.55 -0.14 0.00 -2.27 0.00 0.00 64.05 56.34 2kqb n THR 415 Cb 0.63 -1.81 0.03 0.00 -2.10 0.00 0.00 70.33 67.08 2kqb n THR 415 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2kqb n ASP 416 N 0.46 2.93 0.00 3.42 9.92 -1.26 -5.24 116.55 126.77 2kqb n ASP 416 Ca 0.32 -2.99 0.00 0.00 -0.53 0.00 0.00 54.79 51.58 2kqb n ASP 416 Cb 0.37 -0.47 0.00 0.00 -0.64 0.00 0.00 41.12 40.39 2kqb n ASP 416 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80