#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 2.08 -2.67 2.61 -1.04 -1.26 -5.05 114.28 108.95 2jwh n THR 422 Ca 0.00 -4.25 -0.43 0.00 -2.04 0.00 0.00 64.05 57.34 2jwh n THR 422 Cb 0.00 -0.67 -0.02 0.00 -1.82 0.00 0.00 70.33 67.81 2jwh n THR 422 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2jwh s LYS 423 N -3.51 4.40 -0.12 -2.82 -0.14 -1.26 -4.95 119.74 111.34 2jwh s LYS 423 Ca 0.43 1.40 -0.29 0.00 -1.36 0.00 0.00 55.97 56.16 2jwh s LYS 423 Cb 0.41 -3.55 -0.06 0.00 -1.68 0.00 0.00 37.83 32.94 2jwh s LYS 423 CO -0.08 -0.36 2.05 0.00 -0.76 0.00 0.00 175.35 176.20 2jwh s ALA 424 N 2.16 3.13 -0.29 5.17 0.00 -1.26 -4.91 121.76 125.75 2jwh s ALA 424 Ca 0.48 0.95 -0.23 0.00 0.00 0.00 0.00 51.96 53.17 2jwh s ALA 424 Cb -0.18 -3.96 0.16 0.00 0.00 0.00 0.00 23.12 19.14 2jwh s ALA 424 CO 0.17 -2.22 1.22 0.45 0.00 0.00 0.00 175.76 175.38 2jwh s SER 425 N 6.29 -0.25 0.11 0.00 0.15 -1.26 -4.56 113.70 114.18 2jwh s SER 425 Ca 0.92 0.45 -0.15 0.00 0.70 0.00 0.00 55.95 57.88 2jwh s SER 425 Cb -0.36 0.61 -0.05 0.00 -1.71 0.00 0.00 66.02 64.51 2jwh s SER 425 CO 0.37 -0.08 1.50 0.07 1.20 0.00 0.00 173.24 176.30 2jwh h LYS 426 N 4.10 0.69 -1.54 5.44 2.10 -2.02 -3.46 116.57 121.87 2jwh h LYS 426 Ca -0.28 -0.28 0.08 0.00 -2.00 0.00 0.00 60.65 58.17 2jwh h LYS 426 Cb 1.18 -0.03 -0.27 0.00 -0.90 0.00 0.00 32.23 32.22 2jwh h LYS 426 CO 0.16 0.87 0.49 -1.12 -2.00 0.00 0.00 179.45 177.85 2jwh s SER 427 N -6.34 -0.41 0.00 7.07 0.01 -1.26 -5.00 113.70 107.77 2jwh s SER 427 Ca -0.13 0.79 0.00 0.00 1.31 0.00 0.00 55.95 57.92 2jwh s SER 427 Cb 0.09 0.83 0.00 0.00 0.21 0.00 0.00 66.02 67.15 2jwh s SER 427 CO 0.81 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.93 2jwh n GLY 428 N 2.25 3.10 1.24 3.44 0.00 -1.26 -4.93 105.19 109.04 2jwh n GLY 428 Ca -0.13 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2jwh n GLY 428 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jwh n VAL 429 N 0.00 -7.05 0.14 1.61 0.31 -1.26 -4.44 118.33 107.64 2jwh n VAL 429 Ca 0.00 1.72 -0.13 0.00 -0.01 0.00 0.00 64.34 65.91 2jwh n VAL 429 Cb 0.00 -3.50 -0.06 0.00 -0.91 0.00 0.00 33.84 29.36 2jwh n VAL 429 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2jwh h PRO 430 N 2.11 -0.38 -0.21 5.55 0.11 -1.92 -1.99 132.00 135.28 2jwh h PRO 430 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2jwh h PRO 430 Cb 0.00 0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.20 2jwh h PRO 430 CO 0.00 -0.25 0.00 1.33 -0.21 0.00 0.00 178.00 178.87 2jwh n VAL 431 N -5.30 0.28 -2.11 3.15 0.24 -1.26 -5.00 118.33 108.32 2jwh n VAL 431 Ca -0.08 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2jwh n VAL 431 Cb 0.22 0.15 0.00 0.00 -1.47 0.00 0.00 33.84 32.73 2jwh n VAL 431 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2jwh n THR 432 N 0.12 0.00 0.00 3.34 -2.24 -0.75 -4.71 114.28 110.05 2jwh n THR 432 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2jwh n THR 432 Cb 0.20 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 2jwh n THR 432 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2jwh n GLN 433 N 12.14 0.00 0.00 -0.78 7.27 -1.26 -4.79 117.38 129.96 2jwh n GLN 433 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2jwh n GLN 433 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2jwh n GLN 433 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 2jwh n THR 434 N 0.00 0.00 -3.64 1.69 -1.04 -1.26 -4.59 114.28 105.44 2jwh n THR 434 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.97 2jwh n THR 434 Cb 0.00 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.44 2jwh n THR 434 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2jwh s GLN 435 N 0.00 0.45 0.00 -2.82 0.74 -1.26 -4.87 119.66 111.89 2jwh s GLN 435 Ca 0.00 0.71 0.00 0.00 0.05 0.00 0.00 55.36 56.12 2jwh s GLN 435 Cb 0.00 0.12 0.00 0.00 1.10 0.00 0.00 33.01 34.23 2jwh s GLN 435 CO 0.00 -0.08 0.58 -2.37 -0.55 0.00 0.00 175.29 172.86 2jwh n THR 436 N 3.47 0.00 -0.03 -0.34 5.66 -1.26 -4.84 114.28 116.93 2jwh n THR 436 Ca -0.17 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.69 2jwh n THR 436 Cb 0.57 0.29 -0.10 0.00 -1.55 0.00 0.00 70.33 69.54 2jwh n THR 436 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jwh h ALA 437 N 0.00 0.04 0.12 1.79 0.00 -1.98 -3.32 119.26 115.91 2jwh h ALA 437 Ca -0.33 -0.35 -0.34 0.00 0.00 0.00 0.00 54.91 53.90 2jwh h ALA 437 Cb 1.02 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2jwh h ALA 437 CO -0.17 -0.09 -1.81 0.78 0.00 0.00 0.00 179.25 177.97 2jwh h GLY 438 N -0.49 0.30 0.00 0.00 0.00 -2.03 -3.50 103.07 97.35 2jwh h GLY 438 Ca -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2jwh h GLY 438 CO 0.02 0.68 0.00 0.00 0.00 0.00 0.00 176.54 177.23 2jwh n ALA 439 N -2.84 0.00 -2.33 3.60 0.00 -1.25 -3.58 120.51 114.11 2jwh n ALA 439 Ca -0.25 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.04 2jwh n ALA 439 Cb 1.06 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.54 2jwh n ALA 439 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jwh n ASP 440 N -0.11 3.68 -2.18 0.00 2.03 -1.26 -4.88 116.55 113.84 2jwh n ASP 440 Ca 0.00 -3.12 -0.18 0.00 0.52 0.00 0.00 54.79 52.02 2jwh n ASP 440 Cb 0.00 -0.39 -0.13 0.00 -0.72 0.00 0.00 41.12 39.88 2jwh n ASP 440 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2jwh n THR 441 N -0.66 3.11 -2.38 5.18 -1.04 -1.23 -4.71 114.28 112.55 2jwh n THR 441 Ca 0.30 -2.06 -0.02 0.00 -2.04 0.00 0.00 64.05 60.23 2jwh n THR 441 Cb 0.90 -1.84 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 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 1.87 -8.79 -0.47 12.58 -1.04 -1.26 -4.81 114.28 112.35 2jwh n THR 442 Ca 0.45 1.07 -0.02 0.00 -2.04 0.00 0.00 64.05 63.51 2jwh n THR 442 Cb 0.78 -6.14 -0.03 0.00 -1.82 0.00 0.00 70.33 63.12 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 0.20 3.83 -2.04 2.41 0.00 -1.26 -4.88 120.51 118.77 2jwh n ALA 443 Ca 0.03 -0.30 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 2jwh n ALA 443 Cb 0.11 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 2jwh n ALA 443 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2jwh s GLU 444 N 0.65 4.20 0.26 0.00 2.56 -1.26 -4.88 118.70 120.23 2jwh s GLU 444 Ca 0.11 2.15 0.12 0.00 0.00 0.00 0.00 54.97 57.35 2jwh s GLU 444 Cb 0.05 -3.89 0.28 0.00 2.00 0.00 0.00 34.13 32.57 2jwh s GLU 444 CO 0.00 -0.80 1.55 0.87 -0.56 0.00 0.00 175.26 176.32 2jwh h LYS 445 N 9.17 0.00 -0.03 4.30 1.79 -1.99 -2.92 116.57 126.90 2jwh h LYS 445 Ca -0.39 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 57.97 2jwh h LYS 445 Cb 1.18 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.81 2jwh h LYS 445 CO 0.95 0.64 -0.52 0.00 -1.08 0.00 0.00 179.45 179.44 2jwh s LYS 447 N -3.87 2.68 0.00 0.00 2.20 -1.10 -0.63 119.74 119.02 2jwh s LYS 447 Ca -0.03 1.63 0.00 0.00 -0.36 0.00 0.00 55.97 57.21 2jwh s LYS 447 Cb 0.13 -4.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.00 2jwh s LYS 447 CO 0.76 -2.62 0.00 0.41 -0.36 0.00 0.00 175.35 173.54 2jwh n GLY 448 N 5.83 2.24 3.77 5.54 0.00 -1.26 -4.91 105.19 116.41 2jwh n GLY 448 Ca 0.32 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2jwh n GLY 448 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jwh s LYS 449 N 0.00 4.00 0.84 1.61 -0.14 0.20 -4.97 119.74 121.28 2jwh s LYS 449 Ca 0.00 2.16 -0.14 0.00 -1.36 0.00 0.00 55.97 56.63 2jwh s LYS 449 Cb 0.00 -2.78 0.21 0.00 -1.68 0.00 0.00 37.83 33.58 2jwh s LYS 449 CO 0.00 -0.47 0.78 0.41 -0.76 0.00 0.00 175.35 175.31 2jwh n GLY 450 N 0.67 -2.56 0.20 -3.33 0.00 -1.26 -4.11 105.19 94.80 2jwh n GLY 450 Ca 0.03 -1.50 -0.08 0.00 0.00 0.00 0.00 46.02 44.48 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 0.63 -0.23 1.61 4.81 -1.92 0.42 114.58 119.90 2jwh h GLU 451 Ca -0.29 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 58.74 2jwh h GLU 451 Cb 0.87 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.12 2jwh h GLU 451 CO 0.19 0.44 -0.44 0.87 -0.73 0.00 0.00 179.01 179.35 2jwh h LYS 452 N 0.63 0.70 -0.10 1.92 1.57 -2.04 -3.13 116.57 116.12 2jwh h LYS 452 Ca 0.17 -0.45 -0.06 0.00 -1.87 0.00 0.00 60.65 58.44 2jwh h LYS 452 Cb -0.03 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2jwh h LYS 452 CO -0.03 1.07 -0.20 -0.44 -0.57 0.00 0.00 179.45 179.28 2jwh h ASP 453 N 0.42 0.15 -0.72 0.86 5.19 -1.83 -3.38 116.42 117.12 2jwh h ASP 453 Ca 0.01 -0.04 -0.32 0.00 -0.62 0.00 0.00 57.03 56.07 2jwh h ASP 453 Cb 1.04 -0.04 -0.05 0.00 0.18 0.00 0.00 39.33 40.46 2jwh h ASP 453 CO 0.10 0.37 0.81 0.00 -3.12 0.00 0.00 179.24 177.40 2jwh s LYS 455 N 6.83 4.20 0.10 0.00 1.02 -1.26 -4.76 119.74 125.88 2jwh s LYS 455 Ca 0.68 0.90 -0.21 0.00 0.02 0.00 0.00 55.97 57.37 2jwh s LYS 455 Cb -0.06 -2.59 -0.10 0.00 -0.52 0.00 0.00 37.83 34.57 2jwh s LYS 455 CO -0.00 0.22 1.73 0.77 -0.92 0.00 0.00 175.35 177.15 2jwh h SER 456 N 2.71 0.16 0.30 2.83 0.02 -1.93 0.69 113.55 118.34 2jwh h SER 456 Ca -0.48 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.39 2jwh h SER 456 Cb 1.18 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 2jwh h SER 456 CO 0.65 0.16 -0.17 -0.65 -1.14 0.00 0.00 176.83 175.67 2jwh h PRO 457 N 0.16 0.00 0.21 3.45 0.11 -2.01 -3.05 132.00 130.87 2jwh h PRO 457 Ca 0.05 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.84 2jwh h PRO 457 Cb 0.02 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.16 2jwh h PRO 457 CO -0.01 0.17 -1.49 0.22 -0.21 0.00 0.00 178.00 176.68 2jwh h ASP 458 N 0.00 0.68 0.00 -2.05 3.58 -1.81 -3.50 116.42 113.33 2jwh h ASP 458 Ca -0.00 -0.92 0.00 0.00 0.42 0.00 0.00 57.03 56.52 2jwh h ASP 458 Cb 0.36 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.19 2jwh h ASP 458 CO 0.02 1.69 0.00 0.00 -2.88 0.00 0.00 179.24 178.08 2jwh s LYS 460 N 1.85 0.21 -0.28 0.00 -0.14 -1.22 -4.20 119.74 115.95 2jwh s LYS 460 Ca 0.00 0.61 -0.21 0.00 -1.36 0.00 0.00 55.97 55.01 2jwh s LYS 460 Cb 0.00 -0.09 -0.01 0.00 -1.68 0.00 0.00 37.83 36.05 2jwh s LYS 460 CO 0.00 -0.19 0.69 -0.46 -0.76 0.00 0.00 175.35 174.63 2jwh s TRP 461 N 1.55 3.24 0.00 3.18 -0.11 -1.26 -0.80 118.94 124.74 2jwh s TRP 461 Ca -0.07 0.77 0.00 0.00 1.22 0.00 0.00 56.10 58.02 2jwh s TRP 461 Cb -0.11 -3.00 0.00 0.00 -1.50 0.00 0.00 33.47 28.86 2jwh s TRP 461 CO -0.09 -0.44 0.19 -1.91 -4.62 0.00 0.00 176.95 170.08 2jwh n GLU 462 N 5.92 0.00 -1.72 5.86 2.13 -1.05 -4.94 120.64 126.84 2jwh n GLU 462 Ca 0.01 0.39 -0.01 0.00 0.66 0.00 0.00 57.16 58.21 2jwh n GLU 462 Cb 0.49 -1.00 0.01 0.00 0.27 0.00 0.00 31.44 31.20 2jwh n GLU 462 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jwh n GLY 463 N 1.45 -0.74 0.00 8.31 0.00 -1.26 -4.96 105.19 107.99 2jwh n GLY 463 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.18 1.34 3.01 -0.02 0.00 -1.26 -5.12 105.19 102.95 2jwh n GLY 464 Ca -0.05 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 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 0.00 0.76 0.36 2.61 2.01 -1.26 -4.94 115.64 115.19 2jwh s THR 465 Ca 0.00 -0.37 -0.26 0.00 0.31 0.00 0.00 61.69 61.38 2jwh s THR 465 Cb 0.00 -0.67 -0.09 0.00 0.01 0.00 0.00 72.50 71.75 2jwh s THR 465 CO 0.00 0.23 1.06 0.00 -0.69 0.00 0.00 174.62 175.22 2jwh s LYS 467 N -2.18 0.09 0.00 0.00 -2.85 0.02 -3.62 119.74 111.21 2jwh s LYS 467 Ca 0.54 0.18 0.21 0.00 -1.00 0.00 0.00 55.97 55.90 2jwh s LYS 467 Cb -0.25 0.05 0.17 0.00 -2.06 0.00 0.00 37.83 35.74 2jwh s LYS 467 CO 0.31 -0.02 1.17 -3.47 0.10 0.00 0.00 175.35 173.44