#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 0.00 0.00 2.61 -1.32 -1.26 -4.98 115.64 110.70 2jwh s THR 422 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 2jwh s THR 422 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2jwh s THR 422 CO 0.00 0.00 0.00 1.17 -2.21 0.00 0.00 174.62 173.58 2jwh n LYS 423 N 1.92 0.00 -3.38 7.08 4.81 -1.26 -4.62 118.16 122.71 2jwh n LYS 423 Ca -0.14 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.10 2jwh n LYS 423 Cb 0.56 0.00 0.06 0.00 0.02 0.00 0.00 35.03 35.67 2jwh n LYS 423 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jwh n ALA 424 N 0.00 -2.51 -1.77 3.14 0.00 -1.26 -4.90 120.51 113.20 2jwh n ALA 424 Ca 0.00 0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.04 2jwh n ALA 424 Cb 0.00 -5.16 -0.01 0.00 0.00 0.00 0.00 19.45 14.28 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 -3.40 6.34 -0.88 0.00 0.01 -1.26 -4.86 113.70 109.65 2jwh s SER 425 Ca 0.45 3.02 -0.08 0.00 1.31 0.00 0.00 55.95 60.65 2jwh s SER 425 Cb -0.09 -2.65 -0.17 0.00 0.21 0.00 0.00 66.02 63.32 2jwh s SER 425 CO 0.78 -0.90 3.20 0.29 0.41 0.00 0.00 173.24 177.02 2jwh n LYS 426 N 1.23 2.87 -3.65 12.44 4.01 -1.26 -4.74 118.16 129.07 2jwh n LYS 426 Ca 0.04 -1.63 -0.14 0.00 -0.51 0.00 0.00 58.31 56.08 2jwh n LYS 426 Cb 0.38 -2.43 -0.08 0.00 -0.51 0.00 0.00 35.03 32.40 2jwh n LYS 426 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 2jwh s SER 427 N 2.14 -0.70 -0.37 4.39 0.01 -1.26 -5.08 113.70 112.84 2jwh s SER 427 Ca 0.67 1.34 0.11 0.00 1.31 0.00 0.00 55.95 59.39 2jwh s SER 427 Cb 0.24 1.36 0.40 0.00 0.21 0.00 0.00 66.02 68.23 2jwh s SER 427 CO -0.03 -0.23 1.42 0.61 0.41 0.00 0.00 173.24 175.42 2jwh n GLY 428 N 2.76 1.64 0.21 3.44 0.00 -1.26 -5.01 105.19 106.97 2jwh n GLY 428 Ca -0.14 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 2jwh n GLY 428 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jwh h VAL 429 N 2.93 0.49 -0.28 1.61 2.07 -1.90 0.71 116.25 121.88 2jwh h VAL 429 Ca -0.34 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.45 2jwh h VAL 429 Cb 1.30 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2jwh h VAL 429 CO -0.10 0.11 0.00 -0.81 0.02 0.00 0.00 177.57 176.79 2jwh n PRO 430 N -5.10 3.31 -3.51 1.57 -0.05 -1.26 -3.82 135.00 126.14 2jwh n PRO 430 Ca -0.09 0.00 -0.21 0.00 -0.05 0.00 0.00 63.50 63.16 2jwh n PRO 430 Cb 0.27 0.00 0.06 0.00 -0.05 0.00 0.00 33.50 33.77 2jwh n PRO 430 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 175.50 175.73 2jwh n VAL 431 N 0.00 -6.58 -0.66 0.52 0.31 -1.26 -4.62 118.33 106.04 2jwh n VAL 431 Ca 0.00 -0.89 0.00 0.00 -0.01 0.00 0.00 64.34 63.44 2jwh n VAL 431 Cb 0.00 -5.00 0.00 0.00 -0.91 0.00 0.00 33.84 27.93 2jwh n VAL 431 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2jwh n THR 432 N -3.89 -2.68 -0.81 2.52 -1.04 -1.26 -4.64 114.28 102.48 2jwh n THR 432 Ca -0.18 0.94 -0.18 0.00 -2.04 0.00 0.00 64.05 62.59 2jwh n THR 432 Cb 0.64 -1.85 -0.07 0.00 -1.82 0.00 0.00 70.33 67.23 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 -0.17 2.01 -0.06 -2.82 1.13 -1.26 -4.32 117.38 111.88 2jwh n GLN 433 Ca 0.00 -1.21 -0.07 0.00 -1.94 0.00 0.00 57.00 53.78 2jwh n GLN 433 Cb 0.00 -2.21 -0.06 0.00 0.11 0.00 0.00 30.24 28.08 2jwh n GLN 433 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 2jwh h THR 434 N 2.82 0.79 0.10 5.09 1.35 -1.87 -3.39 112.91 117.80 2jwh h THR 434 Ca 0.38 -1.62 -0.30 0.00 -0.55 0.00 0.00 66.41 64.32 2jwh h THR 434 Cb 0.61 1.52 -0.01 0.00 -1.73 0.00 0.00 68.15 68.54 2jwh h THR 434 CO 0.95 0.27 -1.59 1.56 -0.25 0.00 0.00 175.52 176.46 2jwh h GLN 435 N -1.00 0.22 -5.53 4.72 1.08 -1.81 -3.49 115.11 109.30 2jwh h GLN 435 Ca -0.02 -0.37 -0.36 0.00 -1.45 0.00 0.00 58.65 56.45 2jwh h GLN 435 Cb 0.51 0.14 0.14 0.00 -0.05 0.00 0.00 27.48 28.21 2jwh h GLN 435 CO -0.01 1.18 -0.66 2.41 -0.95 0.00 0.00 178.83 180.80 2jwh n THR 436 N -3.86 -3.52 0.00 -0.54 -1.04 -1.19 -3.22 114.28 100.91 2jwh n THR 436 Ca -0.28 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 2jwh n THR 436 Cb 0.92 -4.10 0.00 0.00 -1.82 0.00 0.00 70.33 65.33 2jwh n THR 436 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jwh n ALA 437 N -4.64 0.00 0.00 2.41 0.00 0.24 -4.63 120.51 113.89 2jwh n ALA 437 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2jwh n ALA 437 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 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 0.00 3.40 1.11 0.00 0.00 -1.20 -4.82 105.19 103.69 2jwh n GLY 438 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.67 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 0.71 -2.42 -1.85 4.61 0.00 -1.26 -4.96 120.51 115.34 2jwh n ALA 439 Ca 0.00 0.29 -0.37 0.00 0.00 0.00 0.00 53.44 53.36 2jwh n ALA 439 Cb 0.00 -1.07 -0.06 0.00 0.00 0.00 0.00 19.45 18.32 2jwh n ALA 439 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jwh s ASP 440 N -1.62 7.29 0.30 0.00 -1.08 -1.26 -4.96 116.67 115.34 2jwh s ASP 440 Ca 0.00 1.74 -0.01 0.00 -0.52 0.00 0.00 52.55 53.76 2jwh s ASP 440 Cb 0.00 -2.54 0.47 0.00 -1.46 0.00 0.00 42.92 39.39 2jwh s ASP 440 CO 0.00 -0.03 1.96 0.74 0.52 0.00 0.00 175.17 178.36 2jwh h THR 441 N 2.67 1.18 -3.31 1.71 2.02 -2.00 -3.38 112.91 111.80 2jwh h THR 441 Ca -0.47 -0.37 -0.57 0.00 0.77 0.00 0.00 66.41 65.77 2jwh h THR 441 Cb 1.19 -0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.54 2jwh h THR 441 CO 0.65 0.20 0.96 -0.89 0.37 0.00 0.00 175.52 176.81 2jwh s THR 442 N -5.91 4.17 0.00 3.16 2.01 -1.26 -4.70 115.64 113.11 2jwh s THR 442 Ca -0.11 1.28 0.00 0.00 0.31 0.00 0.00 61.69 63.17 2jwh s THR 442 Cb 0.18 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 68.39 2jwh s THR 442 CO 0.79 -0.63 0.00 0.00 -0.69 0.00 0.00 174.62 174.09 2jwh n ALA 443 N 7.77 1.00 -1.49 7.40 0.00 -1.26 -5.11 120.51 128.82 2jwh n ALA 443 Ca 0.14 0.00 -0.54 0.00 0.00 0.00 0.00 53.44 53.04 2jwh n ALA 443 Cb 0.47 0.01 -0.06 0.00 0.00 0.00 0.00 19.45 19.88 2jwh n ALA 443 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2jwh n GLU 444 N -0.55 0.19 0.00 0.00 -0.00 -1.26 -4.81 120.64 114.21 2jwh n GLU 444 Ca 0.00 0.07 0.03 0.00 -0.00 0.00 0.00 57.16 57.26 2jwh n GLU 444 Cb 0.03 -1.44 0.20 0.00 -0.00 0.00 0.00 31.44 30.23 2jwh n GLU 444 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 2jwh n LYS 445 N 1.44 0.91 -0.00 3.44 4.81 -1.26 -3.11 118.16 124.38 2jwh n LYS 445 Ca 0.19 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.54 2jwh n LYS 445 Cb 0.15 -1.12 0.07 0.00 0.02 0.00 0.00 35.03 34.15 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 -3.98 1.57 0.00 0.00 3.00 -1.18 -0.71 118.16 116.86 2jwh n LYS 447 Ca -0.03 0.52 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 2jwh n LYS 447 Cb 0.58 -2.54 0.00 0.00 0.00 0.00 0.00 35.03 33.07 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 5.31 0.77 3.75 3.14 0.00 -1.26 -5.02 105.19 111.87 2jwh n GLY 448 Ca 0.31 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.93 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 4.78 0.00 1.61 1.02 0.11 -5.01 119.74 122.25 2jwh s LYS 449 Ca 0.00 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.43 2jwh s LYS 449 Cb 0.00 -3.31 0.00 0.00 -0.52 0.00 0.00 37.83 34.00 2jwh s LYS 449 CO 0.00 0.43 0.00 0.41 -0.92 0.00 0.00 175.35 175.27 2jwh n GLY 450 N 1.75 -1.56 0.16 -3.33 0.00 -1.26 -3.77 105.19 97.19 2jwh n GLY 450 Ca -0.01 -1.60 -0.09 0.00 0.00 0.00 0.00 46.02 44.32 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 0.49 -0.31 1.61 4.81 -1.97 0.48 114.58 119.68 2jwh h GLU 451 Ca 0.00 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 2jwh h GLU 451 Cb 0.00 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2jwh h GLU 451 CO 0.00 0.46 -0.04 1.57 -0.73 0.00 0.00 179.01 180.27 2jwh h LYS 452 N 0.40 0.49 0.25 1.92 2.10 -2.04 -2.93 116.57 116.75 2jwh h LYS 452 Ca 0.11 -0.11 -0.33 0.00 -2.00 0.00 0.00 60.65 58.32 2jwh h LYS 452 Cb 0.14 -0.07 0.04 0.00 -0.90 0.00 0.00 32.23 31.44 2jwh h LYS 452 CO -0.01 0.54 -1.45 -0.44 -2.00 0.00 0.00 179.45 176.09 2jwh h ASP 453 N 0.46 0.82 -2.02 7.07 5.19 -1.83 -3.45 116.42 122.67 2jwh h ASP 453 Ca 0.10 -0.92 -0.58 0.00 -0.62 0.00 0.00 57.03 55.00 2jwh h ASP 453 Cb 0.36 -0.27 0.01 0.00 0.18 0.00 0.00 39.33 39.61 2jwh h ASP 453 CO 0.02 1.70 1.37 0.00 -3.12 0.00 0.00 179.24 179.21 2jwh s LYS 455 N 5.55 4.29 0.10 0.00 -0.14 -1.26 -4.91 119.74 123.37 2jwh s LYS 455 Ca 0.97 0.77 -0.22 0.00 -1.36 0.00 0.00 55.97 56.14 2jwh s LYS 455 Cb -0.45 -3.54 -0.12 0.00 -1.68 0.00 0.00 37.83 32.05 2jwh s LYS 455 CO 0.40 -0.17 1.72 0.77 -0.76 0.00 0.00 175.35 177.31 2jwh h SER 456 N 7.23 0.11 0.01 2.83 0.02 -1.93 0.32 113.55 122.15 2jwh h SER 456 Ca -0.34 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2jwh h SER 456 Cb 1.15 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.67 2jwh h SER 456 CO 0.78 0.12 -0.00 1.55 -1.14 0.00 0.00 176.83 178.14 2jwh h PRO 457 N 0.09 0.00 0.07 3.45 0.13 -2.03 -2.92 132.00 130.80 2jwh h PRO 457 Ca 0.03 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.90 2jwh h PRO 457 Cb 0.03 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.14 2jwh h PRO 457 CO -0.01 0.00 -1.41 0.22 -0.23 0.00 0.00 178.00 176.58 2jwh h ASP 458 N 0.00 0.24 -5.03 1.44 3.58 -1.88 -3.49 116.42 111.29 2jwh h ASP 458 Ca -0.00 -0.77 -0.12 0.00 0.42 0.00 0.00 57.03 56.56 2jwh h ASP 458 Cb 0.01 -0.08 -0.19 0.00 1.72 0.00 0.00 39.33 40.79 2jwh h ASP 458 CO 0.00 1.60 -0.42 0.00 -2.88 0.00 0.00 179.24 177.54 2jwh s LYS 460 N -2.03 4.36 -0.37 0.00 2.47 0.18 -3.77 119.74 120.57 2jwh s LYS 460 Ca -0.09 0.69 -0.29 0.00 -1.56 0.00 0.00 55.97 54.72 2jwh s LYS 460 Cb -0.04 -3.40 0.02 0.00 -1.46 0.00 0.00 37.83 32.95 2jwh s LYS 460 CO -0.01 0.21 1.17 -0.46 0.16 0.00 0.00 175.35 176.42 2jwh s TRP 461 N 0.38 2.88 -0.03 4.03 -0.11 -1.26 -2.35 118.94 122.48 2jwh s TRP 461 Ca 0.31 0.93 -0.24 0.00 1.22 0.00 0.00 56.10 58.33 2jwh s TRP 461 Cb -0.17 -4.03 -0.22 0.00 -1.50 0.00 0.00 33.47 27.55 2jwh s TRP 461 CO 0.15 -1.23 1.09 1.49 -4.62 0.00 0.00 176.95 173.83 2jwh h GLU 462 N 8.92 0.21 0.00 5.86 4.81 -1.81 -3.48 114.58 129.09 2jwh h GLU 462 Ca -0.23 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2jwh h GLU 462 Cb 1.07 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2jwh h GLU 462 CO 1.07 0.88 0.00 0.41 -0.73 0.00 0.00 179.01 180.64 2jwh n GLY 463 N 0.88 0.42 1.70 1.92 0.00 -1.26 -4.95 105.19 103.90 2jwh n GLY 463 Ca -0.09 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 45.94 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 1.12 3.61 -0.02 0.00 -1.26 -5.07 105.19 103.57 2jwh n GLY 464 Ca 0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.58 0.00 -0.04 2.61 -1.32 -1.26 -5.07 115.64 109.98 2jwh s THR 465 Ca 0.33 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.59 2jwh s THR 465 Cb 0.38 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.32 2jwh s THR 465 CO -0.15 0.00 0.65 0.00 -2.21 0.00 0.00 174.62 172.91 2jwh s LYS 467 N 0.34 1.07 0.00 0.00 0.00 -0.99 -3.13 119.74 117.03 2jwh s LYS 467 Ca 0.34 -0.04 0.16 0.00 0.00 0.00 0.00 55.97 56.43 2jwh s LYS 467 Cb -0.18 0.50 0.98 0.00 0.00 0.00 0.00 37.83 39.13 2jwh s LYS 467 CO 0.18 -0.37 1.39 -3.47 0.00 0.00 0.00 175.35 173.07