#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kqc n GLY 406 N 0.00 -0.14 2.31 -0.02 0.00 -1.26 -5.10 105.19 100.98 2kqc n GLY 406 Ca 0.00 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 2kqc n GLY 406 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2kqc n VAL 407 N 0.00 0.23 -4.46 1.61 3.14 -1.26 -5.11 118.33 112.49 2kqc n VAL 407 Ca 0.00 -4.41 -0.21 0.00 -2.96 0.00 0.00 64.34 56.76 2kqc n VAL 407 Cb 0.00 -0.20 -0.05 0.00 -1.06 0.00 0.00 33.84 32.54 2kqc n VAL 407 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kqc n GLN 408 N 0.19 0.99 -2.84 1.45 6.02 -1.26 -5.08 117.38 116.84 2kqc n GLN 408 Ca 0.23 -2.48 -0.27 0.00 -0.01 0.00 0.00 57.00 54.47 2kqc n GLN 408 Cb 0.67 0.90 -0.03 0.00 1.02 0.00 0.00 30.24 32.80 2kqc n GLN 408 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2kqc n ILE 409 N -0.78 2.82 -3.00 5.09 5.41 -1.26 -4.92 119.36 122.72 2kqc n ILE 409 Ca -0.11 -5.40 -0.44 0.00 1.00 0.00 0.00 62.75 57.81 2kqc n ILE 409 Cb 0.43 -1.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 2kqc n ILE 409 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2kqc n VAL 410 N -0.28 4.83 -0.36 1.39 0.31 -1.26 -4.41 118.33 118.56 2kqc n VAL 410 Ca 0.32 -5.39 0.00 0.00 -0.01 0.00 0.00 64.34 59.26 2kqc n VAL 410 Cb 0.46 -2.32 0.00 0.00 -0.91 0.00 0.00 33.84 31.07 2kqc n VAL 410 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kqc n GLY 411 N 2.28 0.52 0.27 2.92 0.00 -1.26 -4.97 105.19 104.95 2kqc n GLY 411 Ca 0.29 -0.09 0.17 0.00 0.00 0.00 0.00 46.02 46.39 2kqc n GLY 411 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2kqc h GLN 412 N 0.00 0.00 -4.56 1.61 -0.00 -1.92 -3.47 115.11 106.77 2kqc h GLN 412 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2kqc h GLN 412 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.66 2kqc h GLN 412 CO 0.00 0.00 -0.14 -3.47 -0.00 0.00 0.00 178.83 175.22 2kqc n ASP 413 N -2.70 -5.94 -2.56 0.06 2.03 -1.26 -5.02 116.55 101.16 2kqc n ASP 413 Ca -0.02 0.13 -0.02 0.00 0.52 0.00 0.00 54.79 55.39 2kqc n ASP 413 Cb 0.12 -3.92 0.11 0.00 -0.72 0.00 0.00 41.12 36.71 2kqc n ASP 413 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2kqc n GLU 414 N -1.03 1.21 -3.18 -0.67 2.13 -1.26 -5.03 120.64 112.81 2kqc n GLU 414 Ca 0.03 -1.13 -0.30 0.00 0.66 0.00 0.00 57.16 56.42 2kqc n GLU 414 Cb 0.42 0.35 -0.05 0.00 0.27 0.00 0.00 31.44 32.42 2kqc n GLU 414 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2kqc n THR 415 N -1.32 3.19 0.05 6.31 -2.24 -1.26 -4.82 114.28 114.19 2kqc n THR 415 Ca -0.15 -5.47 -0.01 0.00 -2.27 0.00 0.00 64.05 56.15 2kqc n THR 415 Cb 0.84 -1.86 -0.07 0.00 -2.10 0.00 0.00 70.33 67.13 2kqc n THR 415 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2kqc h ASP 416 N 3.99 0.00 -0.03 3.42 3.32 -2.00 -3.41 116.42 121.70 2kqc h ASP 416 Ca 0.20 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.10 2kqc h ASP 416 Cb 0.59 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 39.94 2kqc h ASP 416 CO 0.92 0.66 -0.47 0.47 -1.72 0.00 0.00 179.24 179.10 2kqc n ASP 417 N -3.03 -0.59 -4.83 6.45 8.00 -1.26 -5.12 116.55 116.16 2kqc n ASP 417 Ca -0.07 -2.05 -0.36 0.00 0.71 0.00 0.00 54.79 53.02 2kqc n ASP 417 Cb 0.86 0.23 -0.07 0.00 -0.02 0.00 0.00 41.12 42.12 2kqc n ASP 417 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2kqc s ARG 418 N -0.23 3.69 0.00 -1.24 1.81 -1.26 -4.99 118.95 116.74 2kqc s ARG 418 Ca 0.10 -0.15 0.00 0.00 -1.72 0.00 0.00 55.73 53.96 2kqc s ARG 418 Cb 0.18 -3.27 0.00 0.00 -0.45 0.00 0.00 34.95 31.42 2kqc s ARG 418 CO -0.06 0.62 0.00 -0.35 -0.68 0.00 0.00 175.30 174.83 2kqc n PRO 419 N 2.49 0.00 -3.15 3.54 -0.04 -1.26 -4.77 135.00 131.81 2kqc n PRO 419 Ca -0.19 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.33 2kqc n PRO 419 Cb 0.54 -0.12 -0.00 0.00 -0.04 0.00 0.00 33.50 33.88 2kqc n PRO 419 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2kqc s GLU 420 N 0.00 0.20 0.25 0.54 4.04 -1.26 -4.57 118.70 117.90 2kqc s GLU 420 Ca 0.00 0.24 -0.29 0.00 0.04 0.00 0.00 54.97 54.96 2kqc s GLU 420 Cb 0.00 0.12 -0.15 0.00 0.02 0.00 0.00 34.13 34.12 2kqc s GLU 420 CO 0.00 -0.34 1.03 0.00 -1.84 0.00 0.00 175.26 174.11 2kqc h PRO 422 N 2.33 0.88 -0.81 0.00 0.13 -2.00 -3.05 132.00 129.48 2kqc h PRO 422 Ca -0.40 -0.39 0.15 0.00 -0.87 0.00 0.00 66.00 64.49 2kqc h PRO 422 Cb 1.35 -0.02 -0.10 0.00 0.13 0.00 0.00 31.00 32.36 2kqc h PRO 422 CO 0.63 1.04 0.37 1.88 -0.23 0.00 0.00 178.00 181.69 2kqc h TYR 423 N 0.70 0.65 0.00 1.56 0.05 -1.91 -3.46 116.97 114.55 2kqc h TYR 423 Ca 0.09 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.90 2kqc h TYR 423 Cb 0.79 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.36 2kqc h TYR 423 CO 0.06 0.12 0.00 0.41 -1.05 0.00 0.00 178.16 177.69 2kqc n GLY 424 N -1.33 2.21 0.23 3.88 0.00 -1.15 -2.84 105.19 106.18 2kqc n GLY 424 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2kqc n GLY 424 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kqc h PRO 425 N 0.00 0.30 -1.47 1.61 0.13 -1.89 -3.08 132.00 127.60 2kqc h PRO 425 Ca 0.00 -0.09 -0.35 0.00 -0.87 0.00 0.00 66.00 64.69 2kqc h PRO 425 Cb 0.00 -0.03 -0.15 0.00 0.13 0.00 0.00 31.00 30.95 2kqc h PRO 425 CO 0.00 0.51 0.45 0.43 -0.23 0.00 0.00 178.00 179.16 2kqc n SER 426 N -4.18 6.46 -4.45 1.44 7.64 -1.13 -4.87 113.62 114.53 2kqc n SER 426 Ca -0.01 -3.11 -0.43 0.00 1.01 0.00 0.00 58.87 56.33 2kqc n SER 426 Cb 0.35 -1.04 -0.08 0.00 -1.01 0.00 0.00 64.21 62.43 2kqc n SER 426 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kqc n TYR 428 N 5.65 0.92 -2.57 0.00 0.18 -1.26 -5.02 117.16 115.06 2kqc n TYR 428 Ca -0.08 -0.84 -0.22 0.00 1.88 0.00 0.00 57.90 58.63 2kqc n TYR 428 Cb 0.46 -0.29 0.04 0.00 -0.38 0.00 0.00 39.34 39.17 2kqc n TYR 428 CO 0.00 0.00 0.00 -0.98 -2.08 0.00 0.00 176.86 173.80 2kqc s ARG 429 N -2.67 2.50 -0.38 -3.48 1.70 -1.26 -5.09 118.95 110.28 2kqc s ARG 429 Ca 0.41 -0.66 0.03 0.00 -0.47 0.00 0.00 55.73 55.03 2kqc s ARG 429 Cb 0.32 -2.43 0.16 0.00 -0.57 0.00 0.00 34.95 32.43 2kqc s ARG 429 CO 0.10 -0.79 0.35 -1.59 -1.08 0.00 0.00 175.30 172.28 2kqc s LYS 430 N -4.85 0.67 0.27 3.89 -2.85 -1.26 -5.09 119.74 110.52 2kqc s LYS 430 Ca 0.57 -1.09 0.11 0.00 -1.00 0.00 0.00 55.97 54.56 2kqc s LYS 430 Cb -0.10 -0.88 -0.05 0.00 -2.06 0.00 0.00 37.83 34.74 2kqc s LYS 430 CO 0.40 -1.22 -0.13 -0.80 0.10 0.00 0.00 175.35 173.69 2kqc s ASN 431 N 1.19 3.93 0.15 0.03 -0.87 -1.26 -5.04 114.94 113.07 2kqc s ASN 431 Ca 0.19 -0.89 -0.07 0.00 -1.57 0.00 0.00 52.86 50.52 2kqc s ASN 431 Cb -0.15 -0.49 -0.01 0.00 -0.02 0.00 0.00 41.25 40.58 2kqc s ASN 431 CO -0.03 0.03 1.42 1.55 -2.57 0.00 0.00 177.10 177.50 2kqc h PRO 432 N 2.14 0.66 0.00 -0.60 0.13 -2.02 -3.17 132.00 129.14 2kqc h PRO 432 Ca -0.42 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.25 2kqc h PRO 432 Cb 1.26 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2kqc h PRO 432 CO 0.60 1.09 -0.56 0.00 -0.23 0.00 0.00 178.00 178.90 2kqc n GLN 433 N -3.94 0.12 0.19 0.86 -0.00 -1.26 -4.01 117.38 109.34 2kqc n GLN 433 Ca -0.05 0.03 0.08 0.00 -0.00 0.00 0.00 57.00 57.06 2kqc n GLN 433 Cb 0.66 -1.57 0.16 0.00 -0.00 0.00 0.00 30.24 29.49 2kqc n GLN 433 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 2kqc h HIS 434 N 0.00 0.00 0.00 2.61 2.76 -1.94 -1.40 115.15 117.18 2kqc h HIS 434 Ca 0.00 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.15 2kqc h HIS 434 Cb 0.60 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.56 2kqc h HIS 434 CO 0.00 0.25 -0.51 0.87 -1.30 0.00 0.00 177.93 177.24 2kqc h LYS 435 N 0.00 0.00 0.02 5.26 6.56 -1.69 -3.05 116.57 123.66 2kqc h LYS 435 Ca -0.00 0.00 -0.33 0.00 -1.06 0.00 0.00 60.65 59.26 2kqc h LYS 435 Cb 1.13 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.74 2kqc h LYS 435 CO 0.03 0.05 -1.96 1.51 -2.06 0.00 0.00 179.45 177.02 2kqc n ILE 436 N -2.93 1.57 0.10 1.86 0.00 -1.19 -4.36 119.36 114.41 2kqc n ILE 436 Ca 0.02 -0.78 0.01 0.00 0.00 0.00 0.00 62.75 62.00 2kqc n ILE 436 Cb 0.57 -1.00 -0.02 0.00 0.00 0.00 0.00 39.64 39.19 2kqc n ILE 436 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2kqc h GLU 437 N 0.01 0.00 -3.86 9.51 4.39 -1.37 -3.44 114.58 119.82 2kqc h GLU 437 Ca -0.39 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.15 2kqc h GLU 437 Cb 2.07 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 30.51 2kqc h GLU 437 CO 0.06 0.44 -0.65 0.71 -1.16 0.00 0.00 179.01 178.40 2kqc s TYR 438 N -2.95 0.20 0.48 4.33 2.02 -1.15 -4.16 117.35 116.11 2kqc s TYR 438 Ca 0.01 -0.41 0.06 0.00 -0.37 0.00 0.00 57.07 56.37 2kqc s TYR 438 Cb 0.08 -0.15 0.00 0.00 -0.40 0.00 0.00 41.96 41.49 2kqc s TYR 438 CO 0.77 -0.20 0.34 -0.98 -1.57 0.00 0.00 175.55 173.91 2kqc s ARG 439 N -1.36 2.32 0.18 -0.62 1.70 -1.26 -4.53 118.95 115.37 2kqc s ARG 439 Ca -0.15 -1.86 0.00 0.00 -0.47 0.00 0.00 55.73 53.25 2kqc s ARG 439 Cb -0.09 -2.13 0.00 0.00 -0.57 0.00 0.00 34.95 32.16 2kqc s ARG 439 CO -0.00 -0.38 0.00 0.72 -1.08 0.00 0.00 175.30 174.55 2kqc n HIS 440 N -1.57 -1.29 -0.20 5.89 8.25 -1.26 -0.91 115.22 124.13 2kqc n HIS 440 Ca -0.00 0.23 0.30 0.00 -0.26 0.00 0.00 57.72 57.99 2kqc n HIS 440 Cb 0.64 0.34 0.71 0.00 1.12 0.00 0.00 29.99 32.79 2kqc n HIS 440 CO 0.00 0.00 0.00 -2.95 0.64 0.00 0.00 176.34 174.03 2kqc h ASN 441 N 0.00 0.00 -6.86 0.41 7.08 -1.93 -3.45 115.58 110.83 2kqc h ASN 441 Ca 0.00 0.00 -0.58 0.00 -3.08 0.00 0.00 56.30 52.64 2kqc h ASN 441 Cb 0.07 0.00 -0.35 0.00 -2.08 0.00 0.00 38.32 35.96 2kqc h ASN 441 CO 0.00 0.00 -0.84 0.35 -2.08 0.00 0.00 177.43 174.86 2kqc n THR 442 N -3.93 -0.04 -2.58 6.14 -2.24 -1.26 -4.87 114.28 105.50 2kqc n THR 442 Ca 0.20 -0.02 -0.39 0.00 -2.27 0.00 0.00 64.05 61.58 2kqc n THR 442 Cb 1.11 -0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 2kqc n THR 442 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2kqc s LEU 443 N -6.74 4.40 0.06 3.22 0.20 -1.26 -5.00 118.68 113.57 2kqc s LEU 443 Ca 0.73 2.09 -0.30 0.00 0.69 0.00 0.00 54.13 57.34 2kqc s LEU 443 Cb -0.43 -3.86 -0.05 0.00 -0.43 0.00 0.00 46.19 41.42 2kqc s LEU 443 CO 0.94 -0.20 1.15 -2.16 -0.29 0.00 0.00 176.35 175.80 2kqc s PRO 444 N -1.83 4.47 -0.35 0.98 0.04 -1.26 -4.95 135.00 132.09 2kqc s PRO 444 Ca 0.49 1.71 0.15 0.00 0.04 0.00 0.00 61.00 63.39 2kqc s PRO 444 Cb -0.26 -3.36 0.42 0.00 0.04 0.00 0.00 34.50 31.34 2kqc s PRO 444 CO 0.33 -0.19 1.00 0.28 0.04 0.00 0.00 177.00 178.46 2kqc n VAL 445 N 3.76 0.54 0.00 -0.36 0.31 -1.26 -4.93 118.33 116.39 2kqc n VAL 445 Ca 0.08 -2.92 0.00 0.00 -0.01 0.00 0.00 64.34 61.48 2kqc n VAL 445 Cb 0.47 0.62 0.00 0.00 -0.91 0.00 0.00 33.84 34.02 2kqc n VAL 445 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2kqc n ARG 446 N -0.08 0.00 -3.08 5.55 1.85 -1.26 -5.07 116.66 114.56 2kqc n ARG 446 Ca 0.09 0.00 -0.45 0.00 -1.00 0.00 0.00 57.85 56.49 2kqc n ARG 446 Cb 0.79 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 32.18 2kqc n ARG 446 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 2kqc s ASN 447 N -1.31 6.65 -0.05 2.89 3.84 -1.26 -4.75 114.94 120.95 2kqc s ASN 447 Ca 0.00 -2.24 0.07 0.00 0.21 0.00 0.00 52.86 50.89 2kqc s ASN 447 Cb 0.00 -2.32 0.11 0.00 -0.55 0.00 0.00 41.25 38.48 2kqc s ASN 447 CO 0.00 -0.89 0.98 0.52 -2.79 0.00 0.00 177.10 174.93 2kqc n VAL 448 N 4.93 0.84 -2.58 -5.21 0.31 -1.26 -4.85 118.33 110.52 2kqc n VAL 448 Ca 0.18 -0.98 -0.02 0.00 -0.01 0.00 0.00 64.34 63.51 2kqc n VAL 448 Cb 0.48 0.30 0.02 0.00 -0.91 0.00 0.00 33.84 33.73 2kqc n VAL 448 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2kqc n LEU 449 N -0.60 -0.61 -3.98 7.52 7.94 -1.26 -5.01 117.00 121.00 2kqc n LEU 449 Ca 0.06 -1.62 -0.32 0.00 -1.11 0.00 0.00 56.01 53.02 2kqc n LEU 449 Cb 0.58 0.80 -0.01 0.00 0.53 0.00 0.00 43.42 45.32 2kqc n LEU 449 CO 0.00 1.16 -0.23 0.47 -1.11 0.00 0.00 177.39 177.69 2kqc n ASP 450 N -0.39 -2.05 0.00 1.96 8.00 -1.26 -5.29 116.55 117.51 2kqc n ASP 450 Ca -0.11 -1.12 0.00 0.00 0.71 0.00 0.00 54.79 54.26 2kqc n ASP 450 Cb 0.61 -2.56 0.00 0.00 -0.02 0.00 0.00 41.12 39.14 2kqc n ASP 450 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19