#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 -7.56 -1.95 2.61 -1.04 -1.26 -4.89 114.28 100.18 2jwh n THR 422 Ca 0.00 0.14 -0.43 0.00 -2.04 0.00 0.00 64.05 61.72 2jwh n THR 422 Cb 0.00 -5.98 -0.03 0.00 -1.82 0.00 0.00 70.33 62.50 2jwh n THR 422 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2jwh s LYS 423 N -2.64 3.55 0.00 -2.82 2.20 -1.26 -4.62 119.74 114.15 2jwh s LYS 423 Ca 0.07 1.72 0.00 0.00 -0.36 0.00 0.00 55.97 57.39 2jwh s LYS 423 Cb -0.02 -4.16 0.00 0.00 -1.51 0.00 0.00 37.83 32.14 2jwh s LYS 423 CO 0.51 -1.60 0.00 0.00 -0.36 0.00 0.00 175.35 173.90 2jwh n ALA 424 N 9.55 0.00 -0.17 3.13 0.00 -1.26 -4.97 120.51 126.80 2jwh n ALA 424 Ca 0.22 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.56 2jwh n ALA 424 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.90 2jwh n ALA 424 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jwh h SER 425 N 0.00 0.92 -3.28 0.00 0.87 -1.99 -3.41 113.55 106.67 2jwh h SER 425 Ca 0.00 -0.35 -0.60 0.00 -1.23 0.00 0.00 61.79 59.61 2jwh h SER 425 Cb 0.00 -0.25 -0.13 0.00 -0.44 0.00 0.00 62.40 61.58 2jwh h SER 425 CO 0.00 1.06 -0.50 -0.75 -0.53 0.00 0.00 176.83 176.11 2jwh s LYS 426 N -4.84 4.15 -0.16 2.24 2.47 -1.26 -5.07 119.74 117.26 2jwh s LYS 426 Ca -0.12 -0.24 -0.21 0.00 -1.56 0.00 0.00 55.97 53.84 2jwh s LYS 426 Cb 0.12 -3.38 0.05 0.00 -1.46 0.00 0.00 37.83 33.16 2jwh s LYS 426 CO 0.84 0.29 0.55 -1.12 0.16 0.00 0.00 175.35 176.08 2jwh s SER 427 N 0.37 -0.55 0.00 1.43 0.01 -1.26 -4.48 113.70 109.22 2jwh s SER 427 Ca 0.07 0.94 0.00 0.00 1.31 0.00 0.00 55.95 58.27 2jwh s SER 427 Cb -0.11 0.95 0.00 0.00 0.21 0.00 0.00 66.02 67.07 2jwh s SER 427 CO -0.02 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 173.95 2jwh n GLY 428 N 2.30 -0.41 2.33 3.44 0.00 -1.26 -5.12 105.19 106.47 2jwh n GLY 428 Ca -0.15 0.30 -0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.10 -0.83 1.61 0.24 -1.26 -4.73 118.33 110.26 2jwh n VAL 429 Ca 0.00 0.67 -0.14 0.00 -2.04 0.00 0.00 64.34 62.83 2jwh n VAL 429 Cb 0.00 -2.74 -0.11 0.00 -1.47 0.00 0.00 33.84 29.52 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 2.08 1.84 -0.94 7.34 -0.02 -1.26 -4.45 135.00 139.59 2jwh n PRO 430 Ca -0.03 -1.00 -0.16 0.00 -2.02 0.00 0.00 63.50 60.30 2jwh n PRO 430 Cb 0.04 -2.04 0.16 0.00 -0.02 0.00 0.00 33.50 31.64 2jwh n PRO 430 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2jwh n VAL 431 N 2.87 2.67 -0.03 -1.45 0.31 -1.26 -3.62 118.33 117.82 2jwh n VAL 431 Ca 0.39 -1.46 -0.15 0.00 -0.01 0.00 0.00 64.34 63.11 2jwh n VAL 431 Cb 0.61 -0.56 -0.12 0.00 -0.91 0.00 0.00 33.84 32.87 2jwh n VAL 431 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2jwh h THR 432 N 1.05 1.59 -0.08 2.52 2.02 -1.96 -3.42 112.91 114.63 2jwh h THR 432 Ca 0.45 -2.04 -0.23 0.00 0.77 0.00 0.00 66.41 65.35 2jwh h THR 432 Cb 2.39 2.90 -0.17 0.00 -1.74 0.00 0.00 68.15 71.53 2jwh h THR 432 CO 0.82 0.55 -0.42 1.67 0.37 0.00 0.00 175.52 178.51 2jwh n GLN 433 N -4.51 1.19 -3.24 6.66 7.27 -1.26 -5.06 117.38 118.42 2jwh n GLN 433 Ca -0.10 -1.93 -0.04 0.00 0.07 0.00 0.00 57.00 55.00 2jwh n GLN 433 Cb 0.52 -0.16 -0.04 0.00 2.41 0.00 0.00 30.24 32.97 2jwh n GLN 433 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2jwh s THR 434 N -0.04 -0.78 0.11 1.69 2.01 -1.24 -5.16 115.64 112.24 2jwh s THR 434 Ca 0.22 -0.17 0.06 0.00 0.31 0.00 0.00 61.69 62.11 2jwh s THR 434 Cb 0.40 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.89 2jwh s THR 434 CO -0.08 -0.17 -0.15 -1.10 -0.69 0.00 0.00 174.62 172.43 2jwh s GLN 435 N 2.66 1.01 0.06 4.92 1.11 -1.26 -4.35 119.66 123.81 2jwh s GLN 435 Ca 0.10 -1.18 -0.25 0.00 0.01 0.00 0.00 55.36 54.04 2jwh s GLN 435 Cb -0.12 -0.99 -0.12 0.00 -1.01 0.00 0.00 33.01 30.77 2jwh s GLN 435 CO -0.28 0.21 1.40 1.15 0.01 0.00 0.00 175.29 177.77 2jwh h THR 436 N 3.76 0.00 0.00 -0.19 2.02 -1.91 -3.42 112.91 113.16 2jwh h THR 436 Ca -0.41 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.65 2jwh h THR 436 Cb 1.19 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.49 2jwh h THR 436 CO 0.47 0.00 -0.25 0.00 0.37 0.00 0.00 175.52 176.11 2jwh n ALA 437 N -2.67 2.90 0.00 6.16 0.00 -1.26 -4.97 120.51 120.67 2jwh n ALA 437 Ca -0.08 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.74 2jwh n ALA 437 Cb 0.33 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.40 2jwh n ALA 437 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jwh n GLY 438 N -0.16 1.94 3.64 0.00 0.00 -1.26 -5.11 105.19 104.23 2jwh n GLY 438 Ca -0.23 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 2jwh n GLY 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jwh s ALA 439 N 0.00 -1.89 -0.12 4.61 0.00 -1.26 -5.03 121.76 118.08 2jwh s ALA 439 Ca 0.00 2.38 -0.13 0.00 0.00 0.00 0.00 51.96 54.20 2jwh s ALA 439 Cb 0.00 -1.42 -0.26 0.00 0.00 0.00 0.00 23.12 21.44 2jwh s ALA 439 CO 0.00 -0.37 0.47 0.22 0.00 0.00 0.00 175.76 176.08 2jwh h ASP 440 N 6.74 0.37 -3.19 0.00 3.58 -1.90 -3.35 116.42 118.67 2jwh h ASP 440 Ca -0.30 -0.85 -0.59 0.00 0.42 0.00 0.00 57.03 55.71 2jwh h ASP 440 Cb 1.22 -0.12 -0.07 0.00 1.72 0.00 0.00 39.33 42.08 2jwh h ASP 440 CO 0.15 1.69 0.63 0.42 -2.88 0.00 0.00 179.24 179.25 2jwh s THR 441 N -2.50 4.76 -0.15 2.25 -4.23 -1.26 -4.90 115.64 109.62 2jwh s THR 441 Ca -0.21 1.79 -0.29 0.00 -1.18 0.00 0.00 61.69 61.80 2jwh s THR 441 Cb 0.05 -4.21 -0.03 0.00 1.34 0.00 0.00 72.50 69.65 2jwh s THR 441 CO 0.75 -0.12 1.57 -0.89 -0.54 0.00 0.00 174.62 175.39 2jwh s THR 442 N 2.98 3.76 0.00 3.99 2.01 -1.26 -4.88 115.64 122.24 2jwh s THR 442 Ca 0.39 0.89 -0.05 0.00 0.31 0.00 0.00 61.69 63.23 2jwh s THR 442 Cb -0.15 -3.66 -0.23 0.00 0.01 0.00 0.00 72.50 68.46 2jwh s THR 442 CO 0.07 -0.18 3.36 0.00 -0.69 0.00 0.00 174.62 177.18 2jwh n ALA 443 N 7.62 5.97 -1.67 7.40 0.00 -1.26 -4.91 120.51 133.65 2jwh n ALA 443 Ca 0.17 -1.58 -0.44 0.00 0.00 0.00 0.00 53.44 51.59 2jwh n ALA 443 Cb 0.44 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 2jwh n ALA 443 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jwh n GLU 444 N 2.41 2.67 0.14 0.00 -0.58 -1.26 -4.83 120.64 119.20 2jwh n GLU 444 Ca 0.37 0.98 0.11 0.00 -0.42 0.00 0.00 57.16 58.20 2jwh n GLU 444 Cb 0.85 -2.89 0.62 0.00 -0.57 0.00 0.00 31.44 29.45 2jwh n GLU 444 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2jwh h LYS 445 N 9.71 0.09 0.00 3.49 3.64 -1.98 0.33 116.57 131.85 2jwh h LYS 445 Ca -0.49 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 58.84 2jwh h LYS 445 Cb 1.24 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2jwh h LYS 445 CO 0.94 0.06 -0.21 0.00 -2.27 0.00 0.00 179.45 177.96 2jwh n LYS 447 N -3.17 1.88 -2.59 0.00 3.00 0.10 -3.05 118.16 114.33 2jwh n LYS 447 Ca 0.03 0.67 -0.13 0.00 -0.00 0.00 0.00 58.31 58.88 2jwh n LYS 447 Cb 0.60 -2.34 0.01 0.00 0.00 0.00 0.00 35.03 33.30 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 2.51 -0.07 3.38 3.14 0.00 -1.26 -4.99 105.19 107.91 2jwh n GLY 448 Ca 0.14 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 -5.07 1.63 0.66 1.61 1.02 -1.17 -5.06 119.74 113.36 2jwh s LYS 449 Ca 0.13 -1.22 -0.15 0.00 0.02 0.00 0.00 55.97 54.76 2jwh s LYS 449 Cb -0.06 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 2jwh s LYS 449 CO 0.16 0.48 1.10 0.20 -0.92 0.00 0.00 175.35 176.38 2jwh s GLY 450 N -1.71 2.10 0.42 -3.33 0.00 -1.26 -4.44 107.32 99.11 2jwh s GLY 450 Ca 0.13 0.50 0.12 0.00 0.00 0.00 0.00 44.72 45.47 2jwh s GLY 450 CO 0.05 0.84 1.98 -2.09 0.00 0.00 0.00 173.10 173.89 2jwh h GLU 451 N -0.03 0.45 -0.93 2.90 4.81 -1.98 0.87 114.58 120.66 2jwh h GLU 451 Ca -0.46 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 58.81 2jwh h GLU 451 Cb 1.24 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.46 2jwh h GLU 451 CO 0.54 0.29 0.59 0.87 -0.73 0.00 0.00 179.01 180.58 2jwh h LYS 452 N 0.46 1.03 0.01 1.92 1.57 -2.03 -3.20 116.57 116.33 2jwh h LYS 452 Ca 0.27 -0.06 -0.28 0.00 -1.87 0.00 0.00 60.65 58.71 2jwh h LYS 452 Cb 0.46 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 2jwh h LYS 452 CO -0.08 0.68 -1.53 -3.47 -0.57 0.00 0.00 179.45 174.49 2jwh n ASP 453 N -4.57 1.90 -4.56 0.86 2.03 -0.48 -4.75 116.55 106.98 2jwh n ASP 453 Ca 0.14 0.39 -0.34 0.00 0.52 0.00 0.00 54.79 55.50 2jwh n ASP 453 Cb 0.19 -0.93 -0.04 0.00 -0.72 0.00 0.00 41.12 39.62 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 6.41 0.49 -0.14 0.00 -0.14 -1.26 -4.61 119.74 120.48 2jwh s LYS 455 Ca 0.60 0.74 -0.30 0.00 -1.36 0.00 0.00 55.97 55.65 2jwh s LYS 455 Cb -0.06 0.13 0.12 0.00 -1.68 0.00 0.00 37.83 36.33 2jwh s LYS 455 CO 0.03 -0.11 0.95 0.45 -0.76 0.00 0.00 175.35 175.90 2jwh s SER 456 N 0.83 -0.42 0.00 2.83 0.15 -1.26 -4.90 113.70 110.94 2jwh s SER 456 Ca -0.05 0.46 0.00 0.00 0.70 0.00 0.00 55.95 57.06 2jwh s SER 456 Cb -0.06 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 2jwh s SER 456 CO -0.07 -0.39 0.55 -0.81 1.20 0.00 0.00 173.24 173.73 2jwh n PRO 457 N 0.76 0.69 0.00 5.44 -0.04 -1.26 -3.05 135.00 137.54 2jwh n PRO 457 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2jwh n PRO 457 Cb 0.58 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 2jwh n PRO 457 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2jwh n ASP 458 N 0.46 0.00 -4.76 3.54 2.03 -1.26 -5.10 116.55 111.46 2jwh n ASP 458 Ca 0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 2jwh n ASP 458 Cb 0.28 0.09 -0.03 0.00 -0.72 0.00 0.00 41.12 40.73 2jwh n ASP 458 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jwh s LYS 460 N -1.27 2.78 -0.24 0.00 2.20 -1.25 -4.19 119.74 117.77 2jwh s LYS 460 Ca 0.48 -0.66 -0.15 0.00 -0.36 0.00 0.00 55.97 55.28 2jwh s LYS 460 Cb -0.34 -2.49 -0.04 0.00 -1.51 0.00 0.00 37.83 33.45 2jwh s LYS 460 CO 0.43 0.53 0.35 -0.46 -0.36 0.00 0.00 175.35 175.84 2jwh s TRP 461 N -0.47 3.30 0.01 4.03 -0.11 -1.26 -0.94 118.94 123.50 2jwh s TRP 461 Ca 0.06 0.45 -0.10 0.00 1.22 0.00 0.00 56.10 57.73 2jwh s TRP 461 Cb -0.12 -2.52 -0.32 0.00 -1.50 0.00 0.00 33.47 29.02 2jwh s TRP 461 CO 0.02 -0.12 0.90 0.93 -4.62 0.00 0.00 176.95 174.05 2jwh h GLU 462 N 7.83 0.41 0.00 5.86 4.39 -1.28 -3.49 114.58 128.30 2jwh h GLU 462 Ca -0.34 -0.70 0.00 0.00 0.34 0.00 0.00 59.36 58.66 2jwh h GLU 462 Cb 1.16 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 2jwh h GLU 462 CO 0.67 1.32 0.00 0.41 -1.16 0.00 0.00 179.01 180.24 2jwh n GLY 463 N 1.72 1.74 1.24 -3.84 0.00 -1.26 -4.89 105.19 99.90 2jwh n GLY 463 Ca -0.18 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.76 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 2.12 3.63 -0.02 0.00 -1.26 -5.05 105.19 104.61 2jwh n GLY 464 Ca 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 45.00 2jwh n GLY 464 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jwh s THR 465 N -0.88 0.00 -0.12 2.61 -1.32 -1.26 -5.11 115.64 109.56 2jwh s THR 465 Ca 0.35 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.83 2jwh s THR 465 Cb 0.38 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 70.35 2jwh s THR 465 CO -0.14 0.00 -0.11 0.00 -2.21 0.00 0.00 174.62 172.16 2jwh s LYS 467 N 0.06 0.08 0.00 0.00 -2.85 -0.11 -3.63 119.74 113.29 2jwh s LYS 467 Ca -0.04 0.08 0.00 0.00 -1.00 0.00 0.00 55.97 55.01 2jwh s LYS 467 Cb -0.14 0.04 0.00 0.00 -2.06 0.00 0.00 37.83 35.67 2jwh s LYS 467 CO 0.04 -0.02 0.00 -3.47 0.10 0.00 0.00 175.35 172.00