#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwh s THR 422 N 0.00 3.53 0.24 2.61 2.01 -1.26 -4.59 115.64 118.19 2jwh s THR 422 Ca 0.00 0.97 0.00 0.00 0.31 0.00 0.00 61.69 62.97 2jwh s THR 422 Cb 0.00 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.88 2jwh s THR 422 CO 0.00 0.01 0.00 0.29 -0.69 0.00 0.00 174.62 174.23 2jwh n LYS 423 N 5.11 -2.80 0.03 4.92 5.02 -1.26 -4.83 118.16 124.35 2jwh n LYS 423 Ca 0.13 2.04 -0.12 0.00 -2.02 0.00 0.00 58.31 58.34 2jwh n LYS 423 Cb 0.43 -2.26 -0.07 0.00 -0.02 0.00 0.00 35.03 33.11 2jwh n LYS 423 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jwh h ALA 424 N 1.43 0.04 -6.77 7.82 0.00 -1.97 -3.46 119.26 116.35 2jwh h ALA 424 Ca 0.00 -0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.34 2jwh h ALA 424 Cb 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 17.63 2jwh h ALA 424 CO 0.00 -0.45 -0.91 -1.13 0.00 0.00 0.00 179.25 176.76 2jwh n SER 425 N -5.06 -0.32 0.00 0.00 3.41 -1.26 -4.50 113.62 105.89 2jwh n SER 425 Ca -0.06 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.43 2jwh n SER 425 Cb 0.04 -2.45 0.00 0.00 -0.26 0.00 0.00 64.21 61.54 2jwh n SER 425 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2jwh n LYS 426 N -4.45 0.00 -2.36 4.33 4.81 -1.26 -5.06 118.16 114.17 2jwh n LYS 426 Ca -0.25 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 56.76 2jwh n LYS 426 Cb 0.65 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.68 2jwh n LYS 426 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2jwh s SER 427 N -1.55 6.64 0.00 3.14 0.01 -1.26 -4.33 113.70 116.35 2jwh s SER 427 Ca 0.00 1.34 0.00 0.00 1.31 0.00 0.00 55.95 58.60 2jwh s SER 427 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2jwh s SER 427 CO 0.00 -1.08 0.00 0.61 0.41 0.00 0.00 173.24 173.18 2jwh n GLY 428 N 4.31 1.14 1.71 3.44 0.00 -1.26 -4.87 105.19 109.66 2jwh n GLY 428 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2jwh n GLY 428 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jwh n VAL 429 N 0.00 -4.66 0.18 1.61 0.24 -1.26 -4.62 118.33 109.82 2jwh n VAL 429 Ca 0.00 2.15 0.00 0.00 -2.04 0.00 0.00 64.34 64.45 2jwh n VAL 429 Cb 0.00 -2.87 0.00 0.00 -1.47 0.00 0.00 33.84 29.50 2jwh n VAL 429 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2jwh n PRO 430 N -0.26 0.81 -3.28 7.34 -0.02 -1.26 -4.78 135.00 133.56 2jwh n PRO 430 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.07 2jwh n PRO 430 Cb 0.00 -1.09 -0.08 0.00 -0.02 0.00 0.00 33.50 32.30 2jwh n PRO 430 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2jwh s VAL 431 N 0.29 5.05 -0.28 -1.45 1.01 -1.26 -5.01 120.40 118.74 2jwh s VAL 431 Ca 0.00 0.25 -0.24 0.00 0.00 0.00 0.00 61.98 61.99 2jwh s VAL 431 Cb 0.00 -3.94 0.12 0.00 0.00 0.00 0.00 36.38 32.56 2jwh s VAL 431 CO 0.00 -0.20 0.98 0.28 0.00 0.00 0.00 175.10 176.17 2jwh s THR 432 N 2.30 0.00 -0.17 3.92 -1.32 -1.26 -5.06 115.64 114.05 2jwh s THR 432 Ca 0.17 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.86 2jwh s THR 432 Cb -0.16 -1.00 0.44 0.00 -1.51 0.00 0.00 72.50 70.27 2jwh s THR 432 CO 0.13 0.00 1.17 0.00 -2.21 0.00 0.00 174.62 173.71 2jwh n GLN 433 N 2.46 1.04 -0.91 7.08 10.64 -1.26 -4.95 117.38 131.49 2jwh n GLN 433 Ca -0.13 -2.62 -0.12 0.00 -1.83 0.00 0.00 57.00 52.29 2jwh n GLN 433 Cb 0.56 -0.75 -0.14 0.00 -0.86 0.00 0.00 30.24 29.05 2jwh n GLN 433 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 2jwh n THR 434 N -0.33 2.74 0.00 -0.39 -2.24 -1.26 -2.22 114.28 110.59 2jwh n THR 434 Ca 0.02 -1.40 0.00 0.00 -2.27 0.00 0.00 64.05 60.40 2jwh n THR 434 Cb 0.91 -1.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.16 2jwh n THR 434 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2jwh n GLN 435 N 2.65 0.00 -0.07 -0.78 7.27 -1.26 -4.85 117.38 120.34 2jwh n GLN 435 Ca 0.40 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.34 2jwh n GLN 435 Cb 0.77 -0.17 -0.12 0.00 2.41 0.00 0.00 30.24 33.12 2jwh n GLN 435 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 2jwh h THR 436 N 0.00 1.73 -3.40 1.69 1.35 -1.98 -3.43 112.91 108.87 2jwh h THR 436 Ca 0.00 -2.29 -0.55 0.00 -0.55 0.00 0.00 66.41 63.02 2jwh h THR 436 Cb 0.30 3.26 -0.04 0.00 -1.73 0.00 0.00 68.15 69.93 2jwh h THR 436 CO 0.00 0.58 0.18 0.00 -0.25 0.00 0.00 175.52 176.03 2jwh s ALA 437 N -2.24 3.31 -0.15 6.62 0.00 -0.94 -4.90 121.76 123.46 2jwh s ALA 437 Ca -0.18 0.28 0.06 0.00 0.00 0.00 0.00 51.96 52.11 2jwh s ALA 437 Cb -0.03 -3.06 0.18 0.00 0.00 0.00 0.00 23.12 20.21 2jwh s ALA 437 CO 0.66 -0.07 0.96 0.41 0.00 0.00 0.00 175.76 177.72 2jwh n GLY 438 N 2.81 0.35 0.96 0.00 0.00 -1.26 -4.06 105.19 103.99 2jwh n GLY 438 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.68 -1.66 0.72 4.61 0.00 -1.26 -4.53 120.51 117.70 2jwh n ALA 439 Ca -0.08 0.28 -0.02 0.00 0.00 0.00 0.00 53.44 53.62 2jwh n ALA 439 Cb 0.67 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 19.09 2jwh n ALA 439 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2jwh n ASP 440 N -1.26 2.80 -0.10 0.00 5.68 -1.26 -3.64 116.55 118.77 2jwh n ASP 440 Ca 0.00 -2.19 -0.17 0.00 -0.50 0.00 0.00 54.79 51.93 2jwh n ASP 440 Cb 0.07 -0.54 -0.07 0.00 -1.14 0.00 0.00 41.12 39.45 2jwh n ASP 440 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 2jwh n THR 441 N 0.24 1.50 -2.13 2.12 -1.04 -1.26 -4.38 114.28 109.32 2jwh n THR 441 Ca 0.07 -0.02 -0.40 0.00 -2.04 0.00 0.00 64.05 61.66 2jwh n THR 441 Cb 0.60 -2.16 0.03 0.00 -1.82 0.00 0.00 70.33 66.98 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 -4.44 4.29 0.30 12.58 -1.04 -1.24 -4.78 114.28 119.94 2jwh n THR 442 Ca -0.28 -4.78 -0.16 0.00 -2.04 0.00 0.00 64.05 56.79 2jwh n THR 442 Cb 0.59 -1.33 -0.08 0.00 -1.82 0.00 0.00 70.33 67.69 2jwh n THR 442 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jwh h ALA 443 N 3.33 -0.74 -0.72 2.41 0.00 -1.76 -2.90 119.26 118.87 2jwh h ALA 443 Ca 0.56 -0.18 -0.27 0.00 0.00 0.00 0.00 54.91 55.02 2jwh h ALA 443 Cb 0.12 0.29 -0.16 0.00 0.00 0.00 0.00 17.79 18.03 2jwh h ALA 443 CO 1.36 -0.86 0.34 -0.85 0.00 0.00 0.00 179.25 179.23 2jwh n GLU 444 N -5.37 3.08 -2.69 0.00 0.00 -1.26 -4.88 120.64 109.51 2jwh n GLU 444 Ca -0.12 -2.70 -0.17 0.00 0.00 0.00 0.00 57.16 54.18 2jwh n GLU 444 Cb 0.32 -2.09 -0.00 0.00 0.00 0.00 0.00 31.44 29.67 2jwh n GLU 444 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2jwh n LYS 445 N -0.32 -2.72 -0.91 3.44 5.02 -1.10 -1.28 118.16 120.29 2jwh n LYS 445 Ca 0.41 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 57.35 2jwh n LYS 445 Cb 1.35 -5.32 0.00 0.00 -0.02 0.00 0.00 35.03 31.04 2jwh n LYS 445 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jwh s LYS 447 N -1.20 4.42 0.00 0.00 2.20 -0.40 -3.82 119.74 120.94 2jwh s LYS 447 Ca 0.00 1.67 0.00 0.00 -0.36 0.00 0.00 55.97 57.28 2jwh s LYS 447 Cb 0.00 -3.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.87 2jwh s LYS 447 CO 0.00 -0.29 0.00 0.41 -0.36 0.00 0.00 175.35 175.11 2jwh n GLY 448 N 3.21 3.58 3.77 5.54 0.00 -1.26 -4.94 105.19 115.09 2jwh n GLY 448 Ca 0.09 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 45.00 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 4.32 1.25 1.61 1.02 -1.25 -4.99 119.74 121.71 2jwh s LYS 449 Ca 0.00 1.76 -0.21 0.00 0.02 0.00 0.00 55.97 57.54 2jwh s LYS 449 Cb 0.00 -2.86 0.31 0.00 -0.52 0.00 0.00 37.83 34.76 2jwh s LYS 449 CO 0.00 -0.06 1.10 0.20 -0.92 0.00 0.00 175.35 175.67 2jwh s GLY 450 N -1.12 1.58 0.15 -3.33 0.00 -1.26 -4.07 107.32 99.27 2jwh s GLY 450 Ca 0.52 -1.05 -0.14 0.00 0.00 0.00 0.00 44.72 44.05 2jwh s GLY 450 CO 0.37 -0.11 1.67 -2.09 0.00 0.00 0.00 173.10 172.94 2jwh h GLU 451 N -2.76 0.73 -0.60 2.90 4.81 -1.95 0.41 114.58 118.12 2jwh h GLU 451 Ca -0.43 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 58.56 2jwh h GLU 451 Cb 1.29 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 2jwh h GLU 451 CO 0.29 0.70 0.03 0.87 -0.73 0.00 0.00 179.01 180.16 2jwh h LYS 452 N 0.63 1.05 -0.34 1.92 1.57 -2.04 -3.02 116.57 116.33 2jwh h LYS 452 Ca 0.15 -0.32 -0.15 0.00 -1.87 0.00 0.00 60.65 58.47 2jwh h LYS 452 Cb 0.27 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 2jwh h LYS 452 CO -0.01 1.01 -0.36 -0.44 -0.57 0.00 0.00 179.45 179.08 2jwh h ASP 453 N 0.95 0.91 -2.17 0.86 3.32 -1.85 -3.43 116.42 115.00 2jwh h ASP 453 Ca 0.17 -0.48 -0.57 0.00 0.02 0.00 0.00 57.03 56.18 2jwh h ASP 453 Cb 0.52 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.82 2jwh h ASP 453 CO 0.03 1.20 1.38 0.00 -1.72 0.00 0.00 179.24 180.12 2jwh s LYS 455 N 5.56 4.02 0.04 0.00 1.02 -1.26 -4.92 119.74 124.19 2jwh s LYS 455 Ca 0.95 1.63 -0.25 0.00 0.02 0.00 0.00 55.97 58.32 2jwh s LYS 455 Cb -0.36 -3.90 -0.17 0.00 -0.52 0.00 0.00 37.83 32.87 2jwh s LYS 455 CO 0.37 -1.00 1.51 1.03 -0.92 0.00 0.00 175.35 176.34 2jwh h SER 456 N 9.41 -0.03 0.07 2.83 0.87 -1.92 0.49 113.55 125.27 2jwh h SER 456 Ca -0.30 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.02 2jwh h SER 456 Cb 1.13 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 63.09 2jwh h SER 456 CO 0.99 0.20 -0.07 1.55 -0.53 0.00 0.00 176.83 178.97 2jwh h PRO 457 N -0.27 0.00 0.17 2.24 0.13 -2.02 -3.05 132.00 129.20 2jwh h PRO 457 Ca -0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.79 2jwh h PRO 457 Cb 0.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.39 2jwh h PRO 457 CO 0.01 0.07 -1.66 -0.44 -0.23 0.00 0.00 178.00 175.75 2jwh h ASP 458 N 0.00 0.57 -4.31 1.44 5.19 -1.92 -3.48 116.42 113.92 2jwh h ASP 458 Ca -0.00 -0.92 -0.25 0.00 -0.62 0.00 0.00 57.03 55.23 2jwh h ASP 458 Cb 0.13 -0.19 -0.25 0.00 0.18 0.00 0.00 39.33 39.20 2jwh h ASP 458 CO 0.01 1.75 -0.73 0.00 -3.12 0.00 0.00 179.24 177.15 2jwh s LYS 460 N -0.74 4.31 -0.22 0.00 3.01 0.11 -4.11 119.74 122.10 2jwh s LYS 460 Ca -0.05 1.12 -0.06 0.00 -1.01 0.00 0.00 55.97 55.97 2jwh s LYS 460 Cb -0.05 -2.43 -0.03 0.00 -1.01 0.00 0.00 37.83 34.31 2jwh s LYS 460 CO -0.00 0.10 0.03 -0.46 0.51 0.00 0.00 175.35 175.53 2jwh s TRP 461 N -1.96 3.07 0.00 3.18 -0.11 -1.26 -0.33 118.94 121.53 2jwh s TRP 461 Ca 0.57 -0.43 0.00 0.00 1.22 0.00 0.00 56.10 57.46 2jwh s TRP 461 Cb -0.12 -2.14 0.00 0.00 -1.50 0.00 0.00 33.47 29.70 2jwh s TRP 461 CO 0.17 -0.27 0.00 -1.91 -4.62 0.00 0.00 176.95 170.32 2jwh n GLU 462 N 4.48 2.49 -0.02 5.86 2.13 0.20 -4.95 120.64 130.83 2jwh n GLU 462 Ca -0.17 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.49 2jwh n GLU 462 Cb 0.52 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 32.14 2jwh n GLU 462 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2jwh h GLY 463 N 0.00 0.63 -5.02 8.31 0.00 -2.03 -3.41 103.07 101.56 2jwh h GLY 463 Ca 0.00 -0.93 -0.19 0.00 0.00 0.00 0.00 47.33 46.22 2jwh h GLY 463 CO 0.00 0.82 -0.33 0.61 0.00 0.00 0.00 176.54 177.64 2jwh n GLY 464 N 0.78 1.86 3.13 4.60 0.00 -1.26 -5.11 105.19 109.19 2jwh n GLY 464 Ca -0.08 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.04 -0.07 0.09 2.61 2.01 -1.26 -5.01 115.64 113.96 2jwh s THR 465 Ca 0.13 0.14 -0.26 0.00 0.31 0.00 0.00 61.69 62.01 2jwh s THR 465 Cb 0.43 -0.47 -0.06 0.00 0.01 0.00 0.00 72.50 72.41 2jwh s THR 465 CO -0.11 0.06 0.81 0.00 -0.69 0.00 0.00 174.62 174.68 2jwh s LYS 467 N -0.29 0.76 0.00 0.00 -2.85 0.55 -2.15 119.74 115.76 2jwh s LYS 467 Ca 0.40 1.11 0.00 0.00 -1.00 0.00 0.00 55.97 56.47 2jwh s LYS 467 Cb -0.22 0.27 0.00 0.00 -2.06 0.00 0.00 37.83 35.82 2jwh s LYS 467 CO 0.25 -0.13 0.47 -3.47 0.10 0.00 0.00 175.35 172.58