#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 1.76 -2.03 2.61 -1.04 -1.26 -4.90 114.28 109.42 2jwh n THR 422 Ca 0.00 -0.68 -0.42 0.00 -2.04 0.00 0.00 64.05 60.91 2jwh n THR 422 Cb 0.00 -1.62 -0.03 0.00 -1.82 0.00 0.00 70.33 66.86 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 -2.56 4.26 -0.35 -2.82 -0.14 -1.26 -4.90 119.74 111.96 2jwh s LYS 423 Ca -0.20 2.25 -0.03 0.00 -1.36 0.00 0.00 55.97 56.64 2jwh s LYS 423 Cb 0.07 -3.19 0.10 0.00 -1.68 0.00 0.00 37.83 33.13 2jwh s LYS 423 CO 0.78 -0.53 2.50 0.00 -0.76 0.00 0.00 175.35 177.34 2jwh n ALA 424 N 3.84 5.82 -2.52 5.17 0.00 -1.26 -4.92 120.51 126.64 2jwh n ALA 424 Ca 0.12 -2.28 -0.43 0.00 0.00 0.00 0.00 53.44 50.85 2jwh n ALA 424 Cb 0.40 -1.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.03 2jwh n ALA 424 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2jwh s SER 425 N 0.45 6.83 -0.04 0.00 0.01 -1.26 -4.92 113.70 114.77 2jwh s SER 425 Ca 0.46 1.22 -0.23 0.00 1.31 0.00 0.00 55.95 58.71 2jwh s SER 425 Cb 0.31 -2.54 -0.24 0.00 0.21 0.00 0.00 66.02 63.76 2jwh s SER 425 CO -0.11 -0.94 1.04 0.50 0.41 0.00 0.00 173.24 174.14 2jwh h LYS 426 N 8.57 0.23 -1.99 12.44 3.64 -2.03 -3.34 116.57 134.08 2jwh h LYS 426 Ca -0.24 -0.25 -0.26 0.00 -1.27 0.00 0.00 60.65 58.64 2jwh h LYS 426 Cb 1.08 0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 32.88 2jwh h LYS 426 CO 1.02 0.97 -0.17 0.43 -2.27 0.00 0.00 179.45 179.44 2jwh n SER 427 N -4.43 5.57 -0.34 4.20 7.64 -1.26 -4.86 113.62 120.13 2jwh n SER 427 Ca -0.10 -2.66 0.00 0.00 1.01 0.00 0.00 58.87 57.12 2jwh n SER 427 Cb 0.55 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 2jwh n SER 427 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jwh n GLY 428 N 2.01 -3.53 3.70 0.23 0.00 -1.25 -4.91 105.19 101.43 2jwh n GLY 428 Ca 0.42 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 2jwh n GLY 428 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jwh s VAL 429 N -1.60 4.83 0.00 1.61 -7.23 -1.26 -4.91 120.40 111.84 2jwh s VAL 429 Ca 0.00 2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 62.13 2jwh s VAL 429 Cb 0.00 -4.30 -0.20 0.00 0.56 0.00 0.00 36.38 32.44 2jwh s VAL 429 CO 0.00 0.07 2.86 -2.65 -0.31 0.00 0.00 175.10 175.07 2jwh n PRO 430 N 4.55 1.51 -0.46 4.82 -0.02 -1.26 -4.66 135.00 139.49 2jwh n PRO 430 Ca 0.07 -0.74 -0.00 0.00 -2.02 0.00 0.00 63.50 60.81 2jwh n PRO 430 Cb 0.50 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 2jwh n PRO 430 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2jwh n VAL 431 N 2.58 1.92 -1.03 -1.45 3.14 -1.26 -4.62 118.33 117.61 2jwh n VAL 431 Ca 0.32 -0.46 -0.20 0.00 -2.96 0.00 0.00 64.34 61.05 2jwh n VAL 431 Cb 0.70 -1.46 -0.11 0.00 -1.06 0.00 0.00 33.84 31.90 2jwh n VAL 431 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2jwh n THR 432 N 1.42 3.20 -2.14 1.55 -1.04 -1.26 -3.44 114.28 112.57 2jwh n THR 432 Ca 0.00 -1.73 -0.01 0.00 -2.04 0.00 0.00 64.05 60.27 2jwh n THR 432 Cb 0.50 -2.16 -0.01 0.00 -1.82 0.00 0.00 70.33 66.84 2jwh n THR 432 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jwh n GLN 433 N 2.92 0.00 -2.93 -2.82 6.02 -1.26 -4.55 117.38 114.75 2jwh n GLN 433 Ca 0.51 -1.06 -0.40 0.00 -0.01 0.00 0.00 57.00 56.04 2jwh n GLN 433 Cb 0.64 0.03 -0.05 0.00 1.02 0.00 0.00 30.24 31.88 2jwh n GLN 433 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2jwh s THR 434 N 0.00 4.60 0.04 5.09 2.01 -1.22 -5.03 115.64 121.13 2jwh s THR 434 Ca 0.10 1.73 -0.30 0.00 0.31 0.00 0.00 61.69 63.52 2jwh s THR 434 Cb 0.11 -4.16 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 2jwh s THR 434 CO -0.05 0.40 1.11 -1.58 -0.69 0.00 0.00 174.62 173.80 2jwh s GLN 435 N -0.32 4.49 0.00 4.92 0.74 -1.26 -4.19 119.66 124.04 2jwh s GLN 435 Ca 0.39 1.62 0.00 0.00 0.05 0.00 0.00 55.36 57.43 2jwh s GLN 435 Cb -0.22 -3.39 0.00 0.00 1.10 0.00 0.00 33.01 30.50 2jwh s GLN 435 CO 0.25 -0.16 0.00 2.41 -0.55 0.00 0.00 175.29 177.24 2jwh n THR 436 N 3.88 0.00 -2.22 -0.34 -1.04 -1.26 -4.83 114.28 108.47 2jwh n THR 436 Ca 0.08 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.68 2jwh n THR 436 Cb 0.48 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.97 2jwh n THR 436 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jwh s ALA 437 N 0.00 2.65 -0.68 2.41 0.00 -1.26 -2.85 121.76 122.03 2jwh s ALA 437 Ca 0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 51.96 51.46 2jwh s ALA 437 Cb 0.00 -4.14 0.00 0.00 0.00 0.00 0.00 23.12 18.99 2jwh s ALA 437 CO 0.00 -3.12 0.58 0.41 0.00 0.00 0.00 175.76 173.63 2jwh n GLY 438 N 5.40 0.06 1.67 0.00 0.00 -1.26 -4.45 105.19 106.61 2jwh n GLY 438 Ca 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.13 3.70 0.13 4.61 0.00 -1.13 -4.04 120.51 120.64 2jwh n ALA 439 Ca -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.14 2jwh n ALA 439 Cb 0.57 -1.35 0.17 0.00 0.00 0.00 0.00 19.45 18.84 2jwh n ALA 439 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2jwh h ASP 440 N 1.89 0.04 -0.53 0.00 3.32 -1.89 -2.76 116.42 116.49 2jwh h ASP 440 Ca 0.02 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 2jwh h ASP 440 Cb 0.84 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.35 2jwh h ASP 440 CO 0.04 0.64 0.15 0.00 -1.72 0.00 0.00 179.24 178.35 2jwh h THR 441 N 0.03 1.23 -3.07 0.35 1.03 -1.80 -3.42 112.91 107.25 2jwh h THR 441 Ca -0.01 -0.82 -0.55 0.00 -0.01 0.00 0.00 66.41 65.02 2jwh h THR 441 Cb 1.09 0.63 -0.02 0.00 -1.07 0.00 0.00 68.15 68.77 2jwh h THR 441 CO 0.08 0.31 0.72 -0.89 -0.01 0.00 0.00 175.52 175.73 2jwh s THR 442 N -5.25 4.29 -1.24 0.00 2.01 -1.04 -4.95 115.64 109.46 2jwh s THR 442 Ca -0.10 1.61 -0.13 0.00 0.31 0.00 0.00 61.69 63.37 2jwh s THR 442 Cb 0.15 -4.03 0.16 0.00 0.01 0.00 0.00 72.50 68.79 2jwh s THR 442 CO 0.81 -0.02 1.55 0.00 -0.69 0.00 0.00 174.62 176.27 2jwh n ALA 443 N 5.37 4.11 -1.89 7.40 0.00 -1.26 -4.97 120.51 129.26 2jwh n ALA 443 Ca 0.11 -4.21 -0.42 0.00 0.00 0.00 0.00 53.44 48.92 2jwh n ALA 443 Cb 0.46 -3.11 -0.03 0.00 0.00 0.00 0.00 19.45 16.77 2jwh n ALA 443 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2jwh s GLU 444 N 1.69 4.17 0.00 0.00 -1.05 -1.26 -4.62 118.70 117.63 2jwh s GLU 444 Ca 0.44 2.34 0.00 0.00 -0.15 0.00 0.00 54.97 57.60 2jwh s GLU 444 Cb 0.00 -3.98 0.00 0.00 -0.44 0.00 0.00 34.13 29.71 2jwh s GLU 444 CO 0.01 -0.86 0.00 1.17 0.95 0.00 0.00 175.26 176.53 2jwh n LYS 445 N 7.01 0.00 0.07 -4.83 4.81 -1.26 -4.81 118.16 119.15 2jwh n LYS 445 Ca 0.18 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.56 2jwh n LYS 445 Cb 0.42 -0.34 0.11 0.00 0.02 0.00 0.00 35.03 35.25 2jwh n LYS 445 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jwh n LYS 447 N -3.90 1.83 0.00 0.00 3.00 -1.25 -1.74 118.16 116.10 2jwh n LYS 447 Ca -0.02 0.66 0.00 0.00 -0.00 0.00 0.00 58.31 58.95 2jwh n LYS 447 Cb 0.61 -2.40 0.00 0.00 0.00 0.00 0.00 35.03 33.24 2jwh n LYS 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2jwh n GLY 448 N 3.31 3.34 3.75 3.14 0.00 -1.26 -5.05 105.19 112.42 2jwh n GLY 448 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.71 4.48 1.05 1.61 1.02 -0.71 -5.04 119.74 121.44 2jwh s LYS 449 Ca 0.00 1.98 -0.17 0.00 0.02 0.00 0.00 55.97 57.80 2jwh s LYS 449 Cb 0.00 -3.17 0.22 0.00 -0.52 0.00 0.00 37.83 34.36 2jwh s LYS 449 CO 0.00 -0.07 1.21 0.20 -0.92 0.00 0.00 175.35 175.77 2jwh s GLY 450 N -0.25 1.67 0.15 -3.33 0.00 -1.26 -4.12 107.32 100.18 2jwh s GLY 450 Ca 0.50 -1.00 -0.13 0.00 0.00 0.00 0.00 44.72 44.09 2jwh s GLY 450 CO 0.42 -0.22 1.68 -2.09 0.00 0.00 0.00 173.10 172.89 2jwh h GLU 451 N -1.99 0.78 -1.66 2.90 4.22 -1.94 0.41 114.58 117.30 2jwh h GLU 451 Ca -0.45 -0.16 -0.08 0.00 0.08 0.00 0.00 59.36 58.74 2jwh h GLU 451 Cb 1.27 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.37 2jwh h GLU 451 CO 0.40 0.72 0.10 1.63 -2.18 0.00 0.00 179.01 179.68 2jwh n LYS 452 N -4.50 1.19 0.00 1.92 4.01 -1.26 -3.09 118.16 116.43 2jwh n LYS 452 Ca 0.02 -0.39 0.00 0.00 -0.51 0.00 0.00 58.31 57.42 2jwh n LYS 452 Cb 0.19 -1.15 0.00 0.00 -0.51 0.00 0.00 35.03 33.55 2jwh n LYS 452 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2jwh n ASP 453 N 0.98 0.00 -4.51 4.39 -0.08 -0.92 -5.07 116.55 111.34 2jwh n ASP 453 Ca 0.08 0.00 -0.46 0.00 -1.51 0.00 0.00 54.79 52.90 2jwh n ASP 453 Cb 0.55 0.05 -0.06 0.00 2.34 0.00 0.00 41.12 44.01 2jwh n ASP 453 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jwh s LYS 455 N 6.61 4.32 0.05 0.00 3.01 -1.26 -4.95 119.74 127.53 2jwh s LYS 455 Ca 1.06 1.94 -0.21 0.00 -1.01 0.00 0.00 55.97 57.76 2jwh s LYS 455 Cb -0.61 -3.47 -0.13 0.00 -1.01 0.00 0.00 37.83 32.61 2jwh s LYS 455 CO 0.42 -0.49 1.44 0.77 0.51 0.00 0.00 175.35 177.99 2jwh h SER 456 N 7.43 0.32 -0.52 2.83 0.02 -1.91 0.46 113.55 122.17 2jwh h SER 456 Ca -0.39 -0.37 -0.02 0.00 -0.84 0.00 0.00 61.79 60.16 2jwh h SER 456 Cb 1.19 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 2jwh h SER 456 CO 0.88 0.62 0.26 1.55 -1.14 0.00 0.00 176.83 179.00 2jwh h PRO 457 N 0.01 0.78 0.22 3.45 0.13 -2.02 -3.06 132.00 131.51 2jwh h PRO 457 Ca 0.04 -0.10 -0.33 0.00 -0.87 0.00 0.00 66.00 64.74 2jwh h PRO 457 Cb 0.48 -0.15 0.04 0.00 0.13 0.00 0.00 31.00 31.50 2jwh h PRO 457 CO 0.02 0.61 -1.42 -0.44 -0.23 0.00 0.00 178.00 176.54 2jwh h ASP 458 N 0.78 0.85 0.00 1.44 3.32 -1.95 -3.49 116.42 117.38 2jwh h ASP 458 Ca 0.19 -0.88 0.00 0.00 0.02 0.00 0.00 57.03 56.36 2jwh h ASP 458 Cb 0.09 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.37 2jwh h ASP 458 CO -0.02 1.68 0.00 0.00 -1.72 0.00 0.00 179.24 179.18 2jwh s LYS 460 N 2.41 0.65 -0.15 0.00 -2.85 -0.75 -4.58 119.74 114.47 2jwh s LYS 460 Ca 0.00 0.20 -0.11 0.00 -1.00 0.00 0.00 55.97 55.06 2jwh s LYS 460 Cb 0.00 0.31 -0.05 0.00 -2.06 0.00 0.00 37.83 36.03 2jwh s LYS 460 CO 0.00 -0.19 0.22 -0.46 0.10 0.00 0.00 175.35 175.02 2jwh s TRP 461 N -1.00 3.50 -0.04 1.78 -0.11 -1.26 0.51 118.94 122.33 2jwh s TRP 461 Ca -0.03 0.54 -0.01 0.00 1.22 0.00 0.00 56.10 57.82 2jwh s TRP 461 Cb -0.01 -2.19 0.03 0.00 -1.50 0.00 0.00 33.47 29.80 2jwh s TRP 461 CO 0.02 0.40 0.05 -2.00 -4.62 0.00 0.00 176.95 170.80 2jwh s GLU 462 N -0.04 -0.05 2.53 5.86 2.56 -0.69 -4.95 118.70 123.92 2jwh s GLU 462 Ca 0.14 0.32 0.00 0.00 0.00 0.00 0.00 54.97 55.43 2jwh s GLU 462 Cb -0.12 -0.45 0.00 0.00 2.00 0.00 0.00 34.13 35.55 2jwh s GLU 462 CO 0.03 -0.29 0.00 0.41 -0.56 0.00 0.00 175.26 174.85 2jwh n GLY 463 N 5.00 0.64 2.20 -1.50 0.00 -1.26 -1.13 105.19 109.14 2jwh n GLY 463 Ca -0.10 0.53 -0.01 0.00 0.00 0.00 0.00 46.02 46.45 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 0.00 1.46 2.94 -0.02 0.00 -1.26 -5.10 105.19 103.21 2jwh n GLY 464 Ca 0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 46.02 45.27 2jwh n GLY 464 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jwh s THR 465 N -1.40 0.04 -0.49 2.61 -4.23 -0.28 -4.99 115.64 106.91 2jwh s THR 465 Ca 0.20 -0.37 -0.28 0.00 -1.18 0.00 0.00 61.69 60.07 2jwh s THR 465 Cb 0.32 -0.14 0.03 0.00 1.34 0.00 0.00 72.50 74.05 2jwh s THR 465 CO -0.09 -0.20 1.08 0.00 -0.54 0.00 0.00 174.62 174.87 2jwh s LYS 467 N 4.29 4.44 0.00 0.00 -0.14 0.18 -3.77 119.74 124.74 2jwh s LYS 467 Ca 0.44 1.00 0.30 0.00 -1.36 0.00 0.00 55.97 56.35 2jwh s LYS 467 Cb -0.08 -3.27 1.53 0.00 -1.68 0.00 0.00 37.83 34.33 2jwh s LYS 467 CO 0.29 0.55 2.01 -0.40 -0.76 0.00 0.00 175.35 177.05