#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 0.00 -1.91 2.61 5.66 -1.26 -4.43 114.28 114.95 2jwh n THR 422 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 2jwh n THR 422 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 2jwh n THR 422 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2jwh s LYS 423 N 0.00 4.20 0.18 1.09 1.02 -1.26 -4.61 119.74 120.36 2jwh s LYS 423 Ca 0.00 2.41 0.00 0.00 0.02 0.00 0.00 55.97 58.40 2jwh s LYS 423 Cb 0.00 -3.11 0.00 0.00 -0.52 0.00 0.00 37.83 34.20 2jwh s LYS 423 CO 0.00 -0.57 0.00 0.00 -0.92 0.00 0.00 175.35 173.86 2jwh n ALA 424 N 3.18 -1.92 -0.14 5.17 0.00 -1.26 -4.84 120.51 120.70 2jwh n ALA 424 Ca 0.11 0.16 -0.10 0.00 0.00 0.00 0.00 53.44 53.62 2jwh n ALA 424 Cb 0.38 -0.83 -0.01 0.00 0.00 0.00 0.00 19.45 19.00 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 0.71 0.64 -3.68 0.00 0.87 -1.87 -3.18 113.55 107.04 2jwh h SER 425 Ca 0.00 -0.24 -0.14 0.00 -1.23 0.00 0.00 61.79 60.18 2jwh h SER 425 Cb 0.00 -0.17 -0.26 0.00 -0.44 0.00 0.00 62.40 61.54 2jwh h SER 425 CO 0.00 0.71 -0.33 -1.59 -0.53 0.00 0.00 176.83 175.09 2jwh s LYS 426 N -5.28 0.38 -0.34 2.24 0.00 -1.26 -2.06 119.74 113.42 2jwh s LYS 426 Ca -0.13 0.55 0.13 0.00 0.00 0.00 0.00 55.97 56.52 2jwh s LYS 426 Cb 0.10 0.12 0.42 0.00 0.00 0.00 0.00 37.83 38.46 2jwh s LYS 426 CO 0.77 -0.08 1.51 -1.13 0.00 0.00 0.00 175.35 176.42 2jwh n SER 427 N 3.32 -1.29 -4.74 0.03 3.41 -1.26 -4.99 113.62 108.09 2jwh n SER 427 Ca -0.16 -2.23 -0.41 0.00 -0.26 0.00 0.00 58.87 55.81 2jwh n SER 427 Cb 0.57 0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 65.11 2jwh n SER 427 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2jwh s GLY 428 N -1.32 2.69 -0.03 5.00 0.00 -1.26 -5.03 107.32 107.37 2jwh s GLY 428 Ca 0.11 1.00 0.01 0.00 0.00 0.00 0.00 44.72 45.84 2jwh s GLY 428 CO -0.12 1.87 -0.01 0.54 0.00 0.00 0.00 173.10 175.38 2jwh s VAL 429 N -0.22 0.26 0.08 1.40 0.11 -1.26 -5.07 120.40 115.70 2jwh s VAL 429 Ca 0.52 0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 59.29 2jwh s VAL 429 Cb -0.34 -0.32 -0.16 0.00 -1.53 0.00 0.00 36.38 34.04 2jwh s VAL 429 CO 0.39 0.15 1.65 -0.65 -3.33 0.00 0.00 175.10 173.30 2jwh h PRO 430 N 7.05 -0.63 -5.96 1.54 0.11 -2.08 -3.47 132.00 128.56 2jwh h PRO 430 Ca -0.40 0.04 -0.41 0.00 0.11 0.00 0.00 66.00 65.34 2jwh h PRO 430 Cb 1.15 0.14 0.09 0.00 0.11 0.00 0.00 31.00 32.49 2jwh h PRO 430 CO 0.48 -0.42 -0.73 0.28 -0.21 0.00 0.00 178.00 177.40 2jwh n VAL 431 N -5.40 -3.41 -1.28 3.15 0.31 -1.26 -4.87 118.33 105.58 2jwh n VAL 431 Ca -0.11 -0.14 -0.25 0.00 -0.01 0.00 0.00 64.34 63.83 2jwh n VAL 431 Cb 0.30 -3.84 0.01 0.00 -0.91 0.00 0.00 33.84 29.40 2jwh n VAL 431 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2jwh n THR 432 N -4.70 3.19 -3.07 2.52 -2.24 -1.26 -4.94 114.28 103.78 2jwh n THR 432 Ca -0.07 -2.59 -0.40 0.00 -2.27 0.00 0.00 64.05 58.73 2jwh n THR 432 Cb 0.58 -1.39 -0.05 0.00 -2.10 0.00 0.00 70.33 67.37 2jwh n THR 432 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jwh s GLN 433 N -2.31 4.43 -0.29 -0.78 -2.07 -1.26 -5.03 119.66 112.34 2jwh s GLN 433 Ca 0.48 0.85 -0.14 0.00 -1.82 0.00 0.00 55.36 54.74 2jwh s GLN 433 Cb 0.35 -3.44 0.13 0.00 -1.09 0.00 0.00 33.01 28.97 2jwh s GLN 433 CO -0.12 0.08 0.82 -0.08 -1.32 0.00 0.00 175.29 174.67 2jwh s THR 434 N 0.76 -0.49 -0.14 3.63 -1.32 -1.26 -5.16 115.64 111.65 2jwh s THR 434 Ca 0.37 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.75 2jwh s THR 434 Cb -0.18 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 69.86 2jwh s THR 434 CO 0.18 0.00 0.35 -1.10 -2.21 0.00 0.00 174.62 171.84 2jwh s GLN 435 N 2.26 0.36 -0.10 7.08 -0.21 -1.26 -5.12 119.66 122.66 2jwh s GLN 435 Ca -0.06 0.61 -0.30 0.00 0.02 0.00 0.00 55.36 55.64 2jwh s GLN 435 Cb -0.07 0.04 -0.04 0.00 1.00 0.00 0.00 33.01 33.94 2jwh s GLN 435 CO -0.18 -0.12 1.46 0.99 -2.12 0.00 0.00 175.29 175.32 2jwh s THR 436 N 0.90 3.91 0.03 -0.19 2.01 -1.26 -4.92 115.64 116.12 2jwh s THR 436 Ca -0.06 1.12 -0.25 0.00 0.31 0.00 0.00 61.69 62.80 2jwh s THR 436 Cb -0.07 -3.72 -0.17 0.00 0.01 0.00 0.00 72.50 68.55 2jwh s THR 436 CO -0.07 -0.09 1.42 0.00 -0.69 0.00 0.00 174.62 175.20 2jwh h ALA 437 N 8.82 -0.21 0.00 7.40 0.00 -2.04 -3.44 119.26 129.79 2jwh h ALA 437 Ca -0.33 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.27 2jwh h ALA 437 Cb 1.14 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.89 2jwh h ALA 437 CO 0.96 -0.49 -0.12 0.41 0.00 0.00 0.00 179.25 180.01 2jwh n GLY 438 N -0.48 -0.57 1.99 0.00 0.00 -1.26 -5.00 105.19 99.87 2jwh n GLY 438 Ca -0.09 0.47 -0.03 0.00 0.00 0.00 0.00 46.02 46.37 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 0.34 2.56 -2.61 4.61 0.00 -1.26 -4.78 120.51 119.37 2jwh n ALA 439 Ca -0.03 -0.78 -0.43 0.00 0.00 0.00 0.00 53.44 52.20 2jwh n ALA 439 Cb 0.73 -0.63 -0.03 0.00 0.00 0.00 0.00 19.45 19.53 2jwh n ALA 439 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2jwh s ASP 440 N -0.95 6.73 0.00 0.00 -4.77 -1.26 -4.32 116.67 112.10 2jwh s ASP 440 Ca 0.05 0.67 0.00 0.00 -3.30 0.00 0.00 52.55 49.97 2jwh s ASP 440 Cb 0.26 -2.51 0.00 0.00 -1.09 0.00 0.00 42.92 39.59 2jwh s ASP 440 CO -0.08 -0.96 0.00 0.41 0.70 0.00 0.00 175.17 175.24 2jwh n THR 441 N 6.16 0.00 -3.61 2.11 -1.04 -1.26 -4.62 114.28 112.02 2jwh n THR 441 Ca 0.10 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.06 2jwh n THR 441 Cb 0.48 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.95 2jwh n THR 441 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2jwh s THR 442 N 0.00 0.00 -0.04 12.58 -1.32 -1.26 -5.11 115.64 120.49 2jwh s THR 442 Ca 0.00 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.18 2jwh s THR 442 Cb 0.00 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.92 2jwh s THR 442 CO 0.00 0.00 1.96 0.00 -2.21 0.00 0.00 174.62 174.37 2jwh s ALA 443 N -1.59 3.40 -0.28 11.08 0.00 -1.26 -4.84 121.76 128.28 2jwh s ALA 443 Ca 0.07 1.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.86 2jwh s ALA 443 Cb -0.01 -3.88 -0.01 0.00 0.00 0.00 0.00 23.12 19.23 2jwh s ALA 443 CO -0.05 -1.81 1.39 -2.00 0.00 0.00 0.00 175.76 173.29 2jwh s GLU 444 N 4.79 3.88 0.00 0.00 2.12 -1.26 -4.67 118.70 123.56 2jwh s GLU 444 Ca 0.88 1.37 0.00 0.00 0.36 0.00 0.00 54.97 57.58 2jwh s GLU 444 Cb -0.39 -3.92 0.00 0.00 0.26 0.00 0.00 34.13 30.08 2jwh s GLU 444 CO 0.38 -1.17 0.00 1.17 -0.54 0.00 0.00 175.26 175.10 2jwh n LYS 445 N 7.41 0.00 0.00 4.30 4.81 -1.26 -4.83 118.16 128.60 2jwh n LYS 445 Ca 0.16 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.51 2jwh n LYS 445 Cb 0.46 -0.34 -0.14 0.00 0.02 0.00 0.00 35.03 35.04 2jwh n LYS 445 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jwh s LYS 447 N -2.62 4.18 -0.29 0.00 2.20 -1.25 -3.64 119.74 118.31 2jwh s LYS 447 Ca -0.04 2.47 -0.01 0.00 -0.36 0.00 0.00 55.97 58.03 2jwh s LYS 447 Cb 0.08 -3.08 -0.01 0.00 -1.51 0.00 0.00 37.83 33.32 2jwh s LYS 447 CO 0.82 -0.59 0.25 0.41 -0.36 0.00 0.00 175.35 175.88 2jwh n GLY 448 N 2.70 0.30 1.11 5.54 0.00 -1.25 -5.00 105.19 108.59 2jwh n GLY 448 Ca 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.85 0.00 0.00 1.61 5.02 -1.24 -5.09 118.16 116.61 2jwh n LYS 449 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2jwh n LYS 449 Cb 0.54 -0.45 0.00 0.00 -0.02 0.00 0.00 35.03 35.10 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 2.87 3.71 0.30 0.72 0.00 -1.26 -4.64 105.19 106.88 2jwh n GLY 450 Ca 0.00 -1.72 -0.06 0.00 0.00 0.00 0.00 46.02 44.24 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 1.01 -0.12 1.61 4.22 -1.94 0.62 114.58 119.97 2jwh h GLU 451 Ca 0.00 -0.13 -0.16 0.00 0.08 0.00 0.00 59.36 59.15 2jwh h GLU 451 Cb 0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 2jwh h GLU 451 CO 0.00 0.77 -0.61 1.57 -2.18 0.00 0.00 179.01 178.56 2jwh h LYS 452 N 0.99 0.41 -0.02 1.92 2.10 -2.04 -3.23 116.57 116.70 2jwh h LYS 452 Ca 0.25 -0.28 -0.26 0.00 -2.00 0.00 0.00 60.65 58.36 2jwh h LYS 452 Cb 0.06 0.04 0.02 0.00 -0.90 0.00 0.00 32.23 31.45 2jwh h LYS 452 CO -0.04 0.90 -0.99 -0.44 -2.00 0.00 0.00 179.45 176.88 2jwh h ASP 453 N 0.31 0.91 -2.30 7.07 5.19 -1.73 -3.44 116.42 122.43 2jwh h ASP 453 Ca -0.01 -0.72 -0.54 0.00 -0.62 0.00 0.00 57.03 55.14 2jwh h ASP 453 Cb 1.14 -0.28 0.02 0.00 0.18 0.00 0.00 39.33 40.39 2jwh h ASP 453 CO 0.11 1.51 1.27 0.00 -3.12 0.00 0.00 179.24 179.01 2jwh s LYS 455 N 4.74 4.30 -0.04 0.00 -0.14 -1.26 -4.92 119.74 122.42 2jwh s LYS 455 Ca 0.91 1.71 -0.25 0.00 -1.36 0.00 0.00 55.97 56.98 2jwh s LYS 455 Cb -0.42 -3.64 -0.19 0.00 -1.68 0.00 0.00 37.83 31.89 2jwh s LYS 455 CO 0.41 -0.56 1.12 0.77 -0.76 0.00 0.00 175.35 176.33 2jwh h SER 456 N 7.81 -0.08 0.23 2.83 0.02 -1.92 0.50 113.55 122.93 2jwh h SER 456 Ca -0.32 -0.47 -0.03 0.00 -0.84 0.00 0.00 61.79 60.14 2jwh h SER 456 Cb 1.14 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.70 2jwh h SER 456 CO 0.92 0.45 -0.13 1.55 -1.14 0.00 0.00 176.83 178.48 2jwh h PRO 457 N -0.65 0.00 0.01 3.45 0.13 -2.03 -3.19 132.00 129.72 2jwh h PRO 457 Ca -0.01 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.76 2jwh h PRO 457 Cb 0.54 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.61 2jwh h PRO 457 CO 0.02 0.13 -2.25 -0.25 -0.23 0.00 0.00 178.00 175.41 2jwh n ASP 458 N -3.99 0.80 -4.19 1.44 8.00 -1.22 -5.01 116.55 112.37 2jwh n ASP 458 Ca -0.02 0.06 -0.19 0.00 0.71 0.00 0.00 54.79 55.35 2jwh n ASP 458 Cb 0.22 0.32 -0.12 0.00 -0.02 0.00 0.00 41.12 41.52 2jwh n ASP 458 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jwh s LYS 460 N -1.81 4.38 -0.20 0.00 1.02 -0.69 -4.23 119.74 118.20 2jwh s LYS 460 Ca -0.00 0.93 -0.03 0.00 0.02 0.00 0.00 55.97 56.88 2jwh s LYS 460 Cb -0.10 -3.27 -0.01 0.00 -0.52 0.00 0.00 37.83 33.93 2jwh s LYS 460 CO 0.03 0.56 -0.05 -0.46 -0.92 0.00 0.00 175.35 174.50 2jwh s TRP 461 N -0.96 2.95 -0.26 3.18 -0.11 -1.26 -0.57 118.94 121.91 2jwh s TRP 461 Ca 0.33 -0.80 -0.19 0.00 1.22 0.00 0.00 56.10 56.66 2jwh s TRP 461 Cb -0.21 -2.05 0.07 0.00 -1.50 0.00 0.00 33.47 29.78 2jwh s TRP 461 CO 0.22 -0.43 0.65 -2.00 -4.62 0.00 0.00 176.95 170.78 2jwh s GLU 462 N 1.17 0.71 -1.27 5.86 2.12 -0.15 -4.92 118.70 122.22 2jwh s GLU 462 Ca 0.02 1.05 -0.01 0.00 0.36 0.00 0.00 54.97 56.39 2jwh s GLU 462 Cb -0.14 0.23 0.00 0.00 0.26 0.00 0.00 34.13 34.48 2jwh s GLU 462 CO -0.01 -0.12 0.14 0.41 -0.54 0.00 0.00 175.26 175.14 2jwh n GLY 463 N 3.59 -0.25 2.95 -1.50 0.00 -1.26 -2.49 105.19 106.23 2jwh n GLY 463 Ca -0.18 -0.20 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.11 -0.23 3.58 -0.02 0.00 -1.26 -5.00 105.19 101.15 2jwh n GLY 464 Ca -0.15 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.15 0.00 0.25 2.61 -1.32 -1.04 -5.00 115.64 107.99 2jwh s THR 465 Ca 0.36 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.68 2jwh s THR 465 Cb -0.16 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.75 2jwh s THR 465 CO 0.44 0.00 0.68 0.00 -2.21 0.00 0.00 174.62 173.53 2jwh s LYS 467 N -2.49 0.40 0.00 0.00 0.00 0.26 -3.86 119.74 114.05 2jwh s LYS 467 Ca 0.47 0.21 0.31 0.00 0.00 0.00 0.00 55.97 56.95 2jwh s LYS 467 Cb -0.13 0.19 1.82 0.00 0.00 0.00 0.00 37.83 39.71 2jwh s LYS 467 CO 0.19 -0.07 2.15 -0.25 0.00 0.00 0.00 175.35 177.37