#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwh n THR 422 N 0.00 -2.53 -4.01 2.61 -1.04 -1.26 -4.98 114.28 103.07 2jwh n THR 422 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 2jwh n THR 422 Cb 0.00 -3.63 -0.07 0.00 -1.82 0.00 0.00 70.33 64.80 2jwh n THR 422 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2jwh s LYS 423 N -6.18 3.43 -0.30 -2.82 -2.85 -1.26 -4.99 119.74 104.78 2jwh s LYS 423 Ca 0.51 -0.23 0.19 0.00 -1.00 0.00 0.00 55.97 55.44 2jwh s LYS 423 Cb -0.23 -3.10 0.47 0.00 -2.06 0.00 0.00 37.83 32.90 2jwh s LYS 423 CO 0.64 0.67 1.17 0.00 0.10 0.00 0.00 175.35 177.92 2jwh n ALA 424 N 2.30 2.73 -0.89 0.59 0.00 -1.26 -5.13 120.51 118.85 2jwh n ALA 424 Ca -0.19 -2.42 0.00 0.00 0.00 0.00 0.00 53.44 50.83 2jwh n ALA 424 Cb 0.54 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.10 2jwh n ALA 424 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jwh n SER 425 N -0.64 -0.04 -3.64 0.00 2.88 -1.26 -4.90 113.62 106.03 2jwh n SER 425 Ca 0.02 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.50 2jwh n SER 425 Cb 0.82 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.21 2jwh n SER 425 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2jwh s LYS 426 N 0.00 0.52 0.39 -1.46 0.00 -1.26 -5.14 119.74 112.80 2jwh s LYS 426 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 55.97 56.76 2jwh s LYS 426 Cb 0.00 0.16 0.00 0.00 0.00 0.00 0.00 37.83 37.99 2jwh s LYS 426 CO 0.00 -0.09 0.00 0.43 0.00 0.00 0.00 175.35 175.69 2jwh n SER 427 N 3.34 -6.66 -4.72 0.03 7.64 -1.26 -4.85 113.62 107.13 2jwh n SER 427 Ca -0.17 0.95 -0.42 0.00 1.01 0.00 0.00 58.87 60.24 2jwh n SER 427 Cb 0.57 -3.34 -0.03 0.00 -1.01 0.00 0.00 64.21 60.41 2jwh n SER 427 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jwh s GLY 428 N -3.13 1.82 -0.29 0.23 0.00 -1.26 -4.99 107.32 99.70 2jwh s GLY 428 Ca 0.00 1.30 -0.15 0.00 0.00 0.00 0.00 44.72 45.87 2jwh s GLY 428 CO 0.00 2.49 0.92 0.54 0.00 0.00 0.00 173.10 177.05 2jwh s VAL 429 N 0.88 -0.19 -0.11 1.40 0.11 -1.26 -5.14 120.40 116.09 2jwh s VAL 429 Ca 0.66 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.42 2jwh s VAL 429 Cb -0.42 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.41 2jwh s VAL 429 CO 0.33 0.00 1.22 -2.16 -3.33 0.00 0.00 175.10 171.16 2jwh s PRO 430 N 1.76 4.30 0.10 1.54 0.04 -1.26 -5.01 135.00 136.47 2jwh s PRO 430 Ca -0.07 1.65 -0.30 0.00 0.04 0.00 0.00 61.00 62.31 2jwh s PRO 430 Cb -0.05 -3.65 -0.06 0.00 0.04 0.00 0.00 34.50 30.78 2jwh s PRO 430 CO -0.16 -0.56 1.11 0.14 0.04 0.00 0.00 177.00 177.57 2jwh s VAL 431 N 2.79 4.12 0.14 -0.36 -7.23 -1.26 -4.71 120.40 113.89 2jwh s VAL 431 Ca 0.55 1.65 0.00 0.00 -1.81 0.00 0.00 61.98 62.36 2jwh s VAL 431 Cb -0.23 -4.05 0.00 0.00 0.56 0.00 0.00 36.38 32.66 2jwh s VAL 431 CO 0.18 0.20 0.00 0.41 -0.31 0.00 0.00 175.10 175.58 2jwh n THR 432 N 3.23 -3.58 0.07 5.32 -1.04 -1.26 -5.08 114.28 111.95 2jwh n THR 432 Ca 0.06 1.13 0.00 0.00 -2.04 0.00 0.00 64.05 63.20 2jwh n THR 432 Cb 0.47 -2.25 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 2jwh n THR 432 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 2jwh n GLN 433 N 0.06 0.00 -3.63 -2.82 -0.06 -1.26 -5.11 117.38 104.56 2jwh n GLN 433 Ca 0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 57.00 54.97 2jwh n GLN 433 Cb 0.00 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.13 2jwh n GLN 433 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 2jwh s THR 434 N -2.00 -0.60 0.27 1.69 -4.23 -1.26 -5.02 115.64 104.49 2jwh s THR 434 Ca 0.00 0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.62 2jwh s THR 434 Cb 0.00 -1.00 -0.02 0.00 1.34 0.00 0.00 72.50 72.82 2jwh s THR 434 CO 0.00 0.00 1.62 0.06 -0.54 0.00 0.00 174.62 175.76 2jwh h GLN 435 N 7.55 0.00 -1.61 3.99 -0.00 -2.06 -3.45 115.11 119.54 2jwh h GLN 435 Ca -0.22 0.00 0.08 0.00 -0.00 0.00 0.00 58.65 58.51 2jwh h GLN 435 Cb 1.15 0.00 -0.26 0.00 -0.00 0.00 0.00 27.48 28.37 2jwh h GLN 435 CO 0.12 0.61 0.38 -0.08 -0.00 0.00 0.00 178.83 179.86 2jwh s THR 436 N -3.63 0.00 -0.27 1.86 -1.32 -1.26 -5.18 115.64 105.84 2jwh s THR 436 Ca -0.01 0.00 -0.25 0.00 -1.21 0.00 0.00 61.69 60.22 2jwh s THR 436 Cb 0.13 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 70.22 2jwh s THR 436 CO 0.76 0.00 0.91 0.00 -2.21 0.00 0.00 174.62 174.08 2jwh s ALA 437 N 0.88 -1.89 0.00 11.08 0.00 -1.26 -5.03 121.76 125.53 2jwh s ALA 437 Ca -0.04 1.93 0.00 0.00 0.00 0.00 0.00 51.96 53.85 2jwh s ALA 437 Cb -0.04 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.76 2jwh s ALA 437 CO -0.11 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.78 2jwh n GLY 438 N 2.37 1.25 3.50 0.00 0.00 -1.26 -4.98 105.19 106.07 2jwh n GLY 438 Ca -0.13 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 2jwh n GLY 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jwh n ALA 439 N 0.00 -2.04 -3.46 4.61 0.00 -1.26 -5.00 120.51 113.36 2jwh n ALA 439 Ca 0.00 -0.09 -0.16 0.00 0.00 0.00 0.00 53.44 53.19 2jwh n ALA 439 Cb 0.00 -2.39 -0.07 0.00 0.00 0.00 0.00 19.45 16.99 2jwh n ALA 439 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jwh s ASP 440 N -4.33 -0.56 -0.52 0.00 -1.08 -1.26 -4.97 116.67 103.96 2jwh s ASP 440 Ca 0.02 0.69 -0.02 0.00 -0.52 0.00 0.00 52.55 52.72 2jwh s ASP 440 Cb -0.00 0.64 -0.02 0.00 -1.46 0.00 0.00 42.92 42.07 2jwh s ASP 440 CO 0.75 -0.49 0.45 0.41 0.52 0.00 0.00 175.17 176.81 2jwh n THR 441 N 1.36 -4.39 -1.46 1.71 -1.04 -1.26 -4.91 114.28 104.29 2jwh n THR 441 Ca -0.18 -0.54 -0.37 0.00 -2.04 0.00 0.00 64.05 60.91 2jwh n THR 441 Cb 0.57 -4.43 -0.03 0.00 -1.82 0.00 0.00 70.33 64.61 2jwh n THR 441 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2jwh n THR 442 N -2.36 4.45 0.00 12.58 -1.04 -1.26 -4.78 114.28 121.87 2jwh n THR 442 Ca -0.06 -2.95 0.00 0.00 -2.04 0.00 0.00 64.05 59.00 2jwh n THR 442 Cb 0.56 -2.42 0.00 0.00 -1.82 0.00 0.00 70.33 66.65 2jwh n THR 442 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jwh n ALA 443 N 2.98 0.00 0.85 2.41 0.00 -1.26 -4.20 120.51 121.30 2jwh n ALA 443 Ca 0.72 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2jwh n ALA 443 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 2jwh n ALA 443 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2jwh n GLU 444 N 0.00 0.85 0.08 0.00 2.13 -1.26 -0.33 120.64 122.11 2jwh n GLU 444 Ca 0.00 0.00 -0.18 0.00 0.66 0.00 0.00 57.16 57.64 2jwh n GLU 444 Cb 0.00 -1.25 -0.14 0.00 0.27 0.00 0.00 31.44 30.31 2jwh n GLU 444 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2jwh h LYS 445 N 0.22 0.29 0.00 5.31 1.79 -1.94 -3.38 116.57 118.87 2jwh h LYS 445 Ca 0.00 -0.50 -0.26 0.00 -2.18 0.00 0.00 60.65 57.71 2jwh h LYS 445 Cb 0.63 0.19 -0.05 0.00 -1.58 0.00 0.00 32.23 31.42 2jwh h LYS 445 CO 0.00 1.19 -1.98 0.00 -1.08 0.00 0.00 179.45 177.57 2jwh s LYS 447 N -2.35 4.22 -0.17 0.00 2.47 0.55 -3.10 119.74 121.36 2jwh s LYS 447 Ca -0.17 2.33 -0.01 0.00 -1.56 0.00 0.00 55.97 56.56 2jwh s LYS 447 Cb 0.05 -3.31 0.00 0.00 -1.46 0.00 0.00 37.83 33.12 2jwh s LYS 447 CO 0.47 -0.64 0.15 0.41 0.16 0.00 0.00 175.35 175.90 2jwh n GLY 448 N 3.82 0.74 0.14 5.54 0.00 -1.26 -4.58 105.19 109.58 2jwh n GLY 448 Ca 0.14 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 2jwh n GLY 448 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jwh n LYS 449 N -1.09 0.60 0.00 1.61 5.02 -1.18 -5.11 118.16 118.00 2jwh n LYS 449 Ca -0.00 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 2jwh n LYS 449 Cb 0.51 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 2jwh n LYS 449 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jwh n GLY 450 N 1.38 2.36 0.38 0.72 0.00 -1.26 -4.53 105.19 104.24 2jwh n GLY 450 Ca -0.52 -1.80 -0.00 0.00 0.00 0.00 0.00 46.02 43.70 2jwh n GLY 450 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2jwh h GLU 451 N 0.00 1.26 -1.51 1.61 4.81 -1.96 0.65 114.58 119.44 2jwh h GLU 451 Ca 0.00 -0.08 -0.21 0.00 -0.13 0.00 0.00 59.36 58.94 2jwh h GLU 451 Cb 0.00 -0.28 -0.10 0.00 0.63 0.00 0.00 28.75 29.00 2jwh h GLU 451 CO 0.00 0.83 0.27 1.63 -0.73 0.00 0.00 179.01 181.01 2jwh n LYS 452 N -4.42 1.52 0.00 1.92 4.76 -1.26 -3.68 118.16 116.99 2jwh n LYS 452 Ca 0.13 -1.06 0.00 0.00 -2.87 0.00 0.00 58.31 54.51 2jwh n LYS 452 Cb 0.07 -1.41 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 2jwh n LYS 452 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2jwh n ASP 453 N 0.53 0.00 -4.64 4.39 2.03 -0.80 -5.08 116.55 112.98 2jwh n ASP 453 Ca 0.20 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 55.09 2jwh n ASP 453 Cb 0.63 0.25 -0.03 0.00 -0.72 0.00 0.00 41.12 41.26 2jwh n ASP 453 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jwh s LYS 455 N 5.01 3.32 0.12 0.00 1.02 -1.26 -4.84 119.74 123.12 2jwh s LYS 455 Ca 0.86 -0.23 -0.21 0.00 0.02 0.00 0.00 55.97 56.41 2jwh s LYS 455 Cb -0.35 -3.07 -0.04 0.00 -0.52 0.00 0.00 37.83 33.85 2jwh s LYS 455 CO 0.36 0.74 1.70 0.77 -0.92 0.00 0.00 175.35 178.00 2jwh h SER 456 N 4.83 -0.24 0.01 2.83 0.02 -1.94 0.77 113.55 119.83 2jwh h SER 456 Ca -0.53 0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 60.44 2jwh h SER 456 Cb 1.21 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.88 2jwh h SER 456 CO 0.59 -0.09 -0.09 1.55 -1.14 0.00 0.00 176.83 177.64 2jwh h PRO 457 N -0.05 0.20 0.11 3.45 0.13 -1.97 -3.07 132.00 130.79 2jwh h PRO 457 Ca 0.08 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 2jwh h PRO 457 Cb 0.18 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.28 2jwh h PRO 457 CO -0.19 0.30 -0.05 0.22 -0.23 0.00 0.00 178.00 178.05 2jwh h ASP 458 N 0.19 -0.12 -4.74 1.44 3.58 -1.67 -3.47 116.42 111.63 2jwh h ASP 458 Ca 0.04 -0.43 -0.08 0.00 0.42 0.00 0.00 57.03 56.99 2jwh h ASP 458 Cb 0.28 0.03 -0.20 0.00 1.72 0.00 0.00 39.33 41.16 2jwh h ASP 458 CO 0.01 0.41 0.03 0.00 -2.88 0.00 0.00 179.24 176.82 2jwh s LYS 460 N -0.85 4.33 -0.52 0.00 -0.14 0.12 -3.69 119.74 118.98 2jwh s LYS 460 Ca -0.09 1.29 -0.23 0.00 -1.36 0.00 0.00 55.97 55.57 2jwh s LYS 460 Cb -0.02 -3.59 0.04 0.00 -1.68 0.00 0.00 37.83 32.58 2jwh s LYS 460 CO 0.06 -0.44 0.88 -0.46 -0.76 0.00 0.00 175.35 174.63 2jwh s TRP 461 N 2.50 2.86 -0.11 3.18 -0.11 -1.26 -0.88 118.94 125.13 2jwh s TRP 461 Ca 0.44 -0.03 -0.05 0.00 1.22 0.00 0.00 56.10 57.68 2jwh s TRP 461 Cb -0.17 -3.94 0.05 0.00 -1.50 0.00 0.00 33.47 27.91 2jwh s TRP 461 CO 0.12 -1.24 0.25 -2.00 -4.62 0.00 0.00 176.95 169.46 2jwh s GLU 462 N 3.67 0.21 -1.34 5.86 -6.30 0.27 -4.83 118.70 116.24 2jwh s GLU 462 Ca 0.29 0.53 -0.02 0.00 -2.50 0.00 0.00 54.97 53.27 2jwh s GLU 462 Cb -0.13 -0.11 0.00 0.00 0.00 0.00 0.00 34.13 33.89 2jwh s GLU 462 CO 0.19 -0.16 0.23 0.41 0.02 0.00 0.00 175.26 175.95 2jwh n GLY 463 N 4.19 -0.30 2.41 -1.50 0.00 -1.26 -1.44 105.19 107.29 2jwh n GLY 463 Ca -0.25 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 2jwh n GLY 463 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jwh n GLY 464 N -1.18 0.86 2.98 -0.02 0.00 -1.26 -4.98 105.19 101.58 2jwh n GLY 464 Ca -0.15 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 2jwh n GLY 464 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jwh s THR 465 N -2.69 0.78 -0.28 2.61 2.01 -0.52 -5.03 115.64 112.52 2jwh s THR 465 Ca 0.00 -0.33 -0.21 0.00 0.31 0.00 0.00 61.69 61.46 2jwh s THR 465 Cb 0.00 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.78 2jwh s THR 465 CO 0.00 0.26 0.67 0.00 -0.69 0.00 0.00 174.62 174.86 2jwh s LYS 467 N 2.64 0.86 0.00 0.00 -2.85 -0.06 -3.07 119.74 117.26 2jwh s LYS 467 Ca 0.28 0.60 0.00 0.00 -1.00 0.00 0.00 55.97 55.85 2jwh s LYS 467 Cb -0.15 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 2jwh s LYS 467 CO 0.10 -0.19 0.00 -3.47 0.10 0.00 0.00 175.35 171.89