#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 3.60 -0.03 2.61 -1.04 -1.26 -4.49 114.28 113.66 2jwh n THR 422 Ca 0.00 -2.17 -0.15 0.00 -2.04 0.00 0.00 64.05 59.69 2jwh n THR 422 Cb 0.00 -2.16 -0.09 0.00 -1.82 0.00 0.00 70.33 66.26 2jwh n THR 422 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2jwh h LYS 423 N 3.74 0.33 -6.52 -2.82 3.64 -2.14 -3.44 116.57 109.35 2jwh h LYS 423 Ca 0.46 -0.25 -0.53 0.00 -1.27 0.00 0.00 60.65 59.06 2jwh h LYS 423 Cb 0.97 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.81 2jwh h LYS 423 CO 0.87 0.89 0.17 0.00 -2.27 0.00 0.00 179.45 179.11 2jwh s ALA 424 N -3.69 3.45 0.00 5.00 0.00 -1.26 -4.99 121.76 120.27 2jwh s ALA 424 Ca -0.14 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2jwh s ALA 424 Cb 0.04 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2jwh s ALA 424 CO 0.77 0.30 0.00 -1.13 0.00 0.00 0.00 175.76 175.70 2jwh n SER 425 N 1.55 0.00 -3.41 0.00 3.41 -1.26 -5.06 113.62 108.84 2jwh n SER 425 Ca -0.06 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.35 2jwh n SER 425 Cb 0.49 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.49 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 -0.54 -1.74 0.28 4.33 4.81 -1.26 -4.88 118.16 119.16 2jwh n LYS 426 Ca 0.00 0.76 0.17 0.00 -0.87 0.00 0.00 58.31 58.37 2jwh n LYS 426 Cb 0.00 -5.07 0.71 0.00 0.02 0.00 0.00 35.03 30.69 2jwh n LYS 426 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2jwh h SER 427 N -1.24 0.00 -3.31 3.14 4.64 -2.05 -3.45 113.55 111.28 2jwh h SER 427 Ca -0.58 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.31 2jwh h SER 427 Cb 1.30 0.00 0.20 0.00 -0.31 0.00 0.00 62.40 63.60 2jwh h SER 427 CO 0.44 0.02 0.02 -0.83 -0.87 0.00 0.00 176.83 175.61 2jwh s GLY 428 N -4.19 1.52 0.06 -0.77 0.00 -1.26 -4.92 107.32 97.77 2jwh s GLY 428 Ca 0.00 -0.33 -0.31 0.00 0.00 0.00 0.00 44.72 44.09 2jwh s GLY 428 CO 0.54 0.43 1.52 0.14 0.00 0.00 0.00 173.10 175.74 2jwh s VAL 429 N -2.54 3.28 0.55 1.40 1.01 -1.26 -4.96 120.40 117.87 2jwh s VAL 429 Ca 0.68 0.75 -0.21 0.00 0.00 0.00 0.00 61.98 63.21 2jwh s VAL 429 Cb -0.22 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 2jwh s VAL 429 CO 0.62 0.01 1.29 -2.16 0.00 0.00 0.00 175.10 174.86 2jwh s PRO 430 N 2.25 3.16 -1.42 2.72 0.04 -1.26 -4.88 135.00 135.61 2jwh s PRO 430 Ca 0.69 2.05 -0.09 0.00 0.04 0.00 0.00 61.00 63.69 2jwh s PRO 430 Cb -0.37 -2.18 -0.08 0.00 0.04 0.00 0.00 34.50 31.91 2jwh s PRO 430 CO 0.30 -1.12 2.77 0.28 0.04 0.00 0.00 177.00 179.27 2jwh n VAL 431 N -1.13 3.84 0.17 -0.36 0.31 -1.26 -4.56 118.33 115.34 2jwh n VAL 431 Ca 0.11 -2.28 0.02 0.00 -0.01 0.00 0.00 64.34 62.18 2jwh n VAL 431 Cb 0.47 -2.49 0.28 0.00 -0.91 0.00 0.00 33.84 31.19 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 3.09 1.21 0.00 2.52 2.02 -2.03 -3.48 112.91 116.24 2jwh h THR 432 Ca 0.77 -1.69 0.00 0.00 0.77 0.00 0.00 66.41 66.26 2jwh h THR 432 Cb 0.27 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 2jwh h THR 432 CO 1.67 0.46 0.00 0.00 0.37 0.00 0.00 175.52 178.03 2jwh n GLN 433 N -3.79 0.00 -4.07 6.66 10.64 -1.26 -4.83 117.38 120.73 2jwh n GLN 433 Ca -0.01 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.82 2jwh n GLN 433 Cb 0.52 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 29.88 2jwh n GLN 433 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 2jwh n THR 434 N 0.00 -0.93 -0.02 -0.39 5.66 -1.26 -4.85 114.28 112.49 2jwh n THR 434 Ca 0.00 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.84 2jwh n THR 434 Cb 0.00 -1.60 -0.10 0.00 -1.55 0.00 0.00 70.33 67.08 2jwh n THR 434 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 2jwh h GLN 435 N -1.34 0.36 0.11 1.09 4.20 -2.01 -3.34 115.11 114.18 2jwh h GLN 435 Ca -0.55 -0.33 -0.01 0.00 0.06 0.00 0.00 58.65 57.82 2jwh h GLN 435 Cb 1.36 0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.22 2jwh h GLN 435 CO 0.73 1.00 -0.05 1.15 -0.67 0.00 0.00 178.83 180.99 2jwh h THR 436 N -0.15 1.02 -1.49 -0.54 2.02 -2.02 -3.47 112.91 108.28 2jwh h THR 436 Ca -0.04 -0.52 0.09 0.00 0.77 0.00 0.00 66.41 66.71 2jwh h THR 436 Cb 1.11 1.36 -0.26 0.00 -1.74 0.00 0.00 68.15 68.61 2jwh h THR 436 CO 0.09 0.13 0.56 0.00 0.37 0.00 0.00 175.52 176.66 2jwh s ALA 437 N -5.22 -2.00 -0.29 6.16 0.00 -1.25 -5.17 121.76 113.98 2jwh s ALA 437 Ca -0.15 1.77 -0.16 0.00 0.00 0.00 0.00 51.96 53.42 2jwh s ALA 437 Cb 0.03 -1.28 0.16 0.00 0.00 0.00 0.00 23.12 22.03 2jwh s ALA 437 CO 0.64 -0.24 1.04 0.20 0.00 0.00 0.00 175.76 177.40 2jwh s GLY 438 N -0.24 0.14 -1.35 0.00 0.00 -1.26 -4.81 107.32 99.80 2jwh s GLY 438 Ca 0.03 3.29 -0.07 0.00 0.00 0.00 0.00 44.72 47.97 2jwh s GLY 438 CO -0.05 2.63 1.08 0.00 0.00 0.00 0.00 173.10 176.76 2jwh n ALA 439 N 3.56 -1.52 -1.66 3.20 0.00 -1.26 -4.98 120.51 117.85 2jwh n ALA 439 Ca -0.18 0.23 -0.31 0.00 0.00 0.00 0.00 53.44 53.18 2jwh n ALA 439 Cb 0.57 -4.44 0.03 0.00 0.00 0.00 0.00 19.45 15.62 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 -3.63 5.66 -0.03 0.00 1.47 -1.26 -4.94 116.67 113.95 2jwh s ASP 440 Ca 0.43 1.58 -0.34 0.00 1.18 0.00 0.00 52.55 55.40 2jwh s ASP 440 Cb -0.19 -2.49 -0.13 0.00 -0.34 0.00 0.00 42.92 39.77 2jwh s ASP 440 CO 0.75 -1.25 1.78 0.41 0.68 0.00 0.00 175.17 177.54 2jwh n THR 441 N -2.89 0.40 0.00 2.11 -1.04 -1.26 -4.50 114.28 107.10 2jwh n THR 441 Ca 0.07 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2jwh n THR 441 Cb 0.54 -1.72 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 2jwh n THR 441 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 2jwh n THR 442 N 4.59 0.00 -0.39 12.58 5.66 -1.26 -5.04 114.28 130.43 2jwh n THR 442 Ca 0.21 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.21 2jwh n THR 442 Cb 0.28 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.06 2jwh n THR 442 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jwh n ALA 443 N -0.05 -2.62 -2.16 1.79 0.00 -1.26 -3.95 120.51 112.26 2jwh n ALA 443 Ca 0.00 0.10 -0.19 0.00 0.00 0.00 0.00 53.44 53.35 2jwh n ALA 443 Cb 0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 2jwh n ALA 443 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2jwh n GLU 444 N -0.39 -1.70 -1.49 0.00 4.07 -1.26 -0.77 120.64 119.10 2jwh n GLU 444 Ca 0.00 0.97 -0.12 0.00 -0.06 0.00 0.00 57.16 57.96 2jwh n GLU 444 Cb 0.00 -5.54 -0.04 0.00 -0.06 0.00 0.00 31.44 25.80 2jwh n GLU 444 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2jwh n LYS 445 N -2.76 -1.39 0.00 5.31 4.81 -1.26 -0.21 118.16 122.66 2jwh n LYS 445 Ca -0.21 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 2jwh n LYS 445 Cb 0.66 -4.94 0.00 0.00 0.02 0.00 0.00 35.03 30.76 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 -0.12 1.69 0.00 0.00 4.81 0.05 -1.15 118.16 123.44 2jwh n LYS 447 Ca 0.00 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.96 2jwh n LYS 447 Cb 0.00 -2.77 0.00 0.00 0.02 0.00 0.00 35.03 32.28 2jwh n LYS 447 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jwh n GLY 448 N 5.67 1.37 3.77 3.14 0.00 -1.26 -4.56 105.19 113.32 2jwh n GLY 448 Ca 0.32 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 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 4.19 1.02 1.61 1.02 -0.30 -5.01 119.74 122.26 2jwh s LYS 449 Ca 0.00 2.36 -0.14 0.00 0.02 0.00 0.00 55.97 58.21 2jwh s LYS 449 Cb 0.00 -2.98 0.20 0.00 -0.52 0.00 0.00 37.83 34.53 2jwh s LYS 449 CO 0.00 -0.39 1.13 0.20 -0.92 0.00 0.00 175.35 175.38 2jwh s GLY 450 N -0.38 1.59 0.24 -3.33 0.00 -1.26 -4.28 107.32 99.91 2jwh s GLY 450 Ca 0.52 -0.65 -0.05 0.00 0.00 0.00 0.00 44.72 44.54 2jwh s GLY 450 CO 0.57 0.03 1.85 -2.09 0.00 0.00 0.00 173.10 173.45 2jwh h GLU 451 N -1.92 0.92 -0.23 2.90 4.81 -1.95 0.37 114.58 119.49 2jwh h GLU 451 Ca -0.50 -0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 58.52 2jwh h GLU 451 Cb 1.31 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2jwh h GLU 451 CO 0.52 0.61 -0.48 0.87 -0.73 0.00 0.00 179.01 179.80 2jwh h LYS 452 N 0.95 0.72 -0.43 1.92 1.79 -2.03 -3.01 116.57 116.48 2jwh h LYS 452 Ca 0.38 -0.48 -0.05 0.00 -2.18 0.00 0.00 60.65 58.33 2jwh h LYS 452 Cb 0.20 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.90 2jwh h LYS 452 CO -0.19 1.10 0.08 -0.44 -1.08 0.00 0.00 179.45 178.92 2jwh h ASP 453 N 0.45 0.62 -2.64 0.86 3.32 -1.78 -3.40 116.42 113.83 2jwh h ASP 453 Ca 0.00 -0.11 -0.57 0.00 0.02 0.00 0.00 57.03 56.38 2jwh h ASP 453 Cb 1.09 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 2jwh h ASP 453 CO 0.11 0.64 1.27 0.00 -1.72 0.00 0.00 179.24 179.54 2jwh s LYS 455 N 5.73 4.38 0.10 0.00 3.01 -1.26 -4.91 119.74 126.78 2jwh s LYS 455 Ca 0.78 0.97 -0.22 0.00 -1.01 0.00 0.00 55.97 56.50 2jwh s LYS 455 Cb -0.21 -3.51 -0.11 0.00 -1.01 0.00 0.00 37.83 32.98 2jwh s LYS 455 CO 0.33 -0.13 1.74 1.03 0.51 0.00 0.00 175.35 178.83 2jwh h SER 456 N 7.05 0.02 -0.27 2.83 0.87 -1.94 0.62 113.55 122.73 2jwh h SER 456 Ca -0.36 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.20 2jwh h SER 456 Cb 1.17 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 2jwh h SER 456 CO 0.79 0.02 0.15 1.55 -0.53 0.00 0.00 176.83 178.81 2jwh h PRO 457 N 0.06 0.41 0.06 2.24 0.13 -2.02 -2.93 132.00 129.95 2jwh h PRO 457 Ca 0.03 -0.04 -0.14 0.00 -0.87 0.00 0.00 66.00 64.98 2jwh h PRO 457 Cb 0.02 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.08 2jwh h PRO 457 CO -0.03 0.33 -0.59 0.22 -0.23 0.00 0.00 178.00 177.69 2jwh h ASP 458 N 0.42 0.41 -4.19 1.44 3.58 -1.86 -3.47 116.42 112.76 2jwh h ASP 458 Ca 0.11 -0.87 -0.15 0.00 0.42 0.00 0.00 57.03 56.53 2jwh h ASP 458 Cb 0.05 -0.13 -0.24 0.00 1.72 0.00 0.00 39.33 40.73 2jwh h ASP 458 CO -0.02 1.24 -0.42 0.00 -2.88 0.00 0.00 179.24 177.17 2jwh s LYS 460 N -0.34 4.42 -0.26 0.00 -2.85 -0.38 -3.67 119.74 116.67 2jwh s LYS 460 Ca -0.04 0.94 -0.15 0.00 -1.00 0.00 0.00 55.97 55.71 2jwh s LYS 460 Cb -0.03 -3.34 -0.04 0.00 -2.06 0.00 0.00 37.83 32.36 2jwh s LYS 460 CO 0.01 0.36 0.38 -0.46 0.10 0.00 0.00 175.35 175.75 2jwh s TRP 461 N -0.27 3.27 0.00 1.78 -0.11 -1.26 -1.97 118.94 120.38 2jwh s TRP 461 Ca 0.35 0.46 0.00 0.00 1.22 0.00 0.00 56.10 58.13 2jwh s TRP 461 Cb -0.20 -2.57 0.00 0.00 -1.50 0.00 0.00 33.47 29.20 2jwh s TRP 461 CO 0.21 -0.18 0.00 -1.91 -4.62 0.00 0.00 176.95 170.45 2jwh n GLU 462 N 5.16 2.24 0.08 5.86 2.13 -0.20 -4.97 120.64 130.94 2jwh n GLU 462 Ca -0.08 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.52 2jwh n GLU 462 Cb 0.51 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 32.07 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 0.44 -5.05 8.31 0.00 -2.04 -3.42 103.07 101.31 2jwh h GLY 463 Ca 0.00 -1.10 -0.22 0.00 0.00 0.00 0.00 47.33 46.01 2jwh h GLY 463 CO 0.00 0.97 -0.51 0.61 0.00 0.00 0.00 176.54 177.61 2jwh n GLY 464 N 1.66 1.70 3.64 4.60 0.00 -1.26 -5.11 105.19 110.42 2jwh n GLY 464 Ca -0.15 -0.39 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.70 0.00 -0.11 2.61 -1.32 -1.26 -5.03 115.64 109.83 2jwh s THR 465 Ca 0.18 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.53 2jwh s THR 465 Cb 0.42 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.36 2jwh s THR 465 CO -0.09 0.00 0.29 0.00 -2.21 0.00 0.00 174.62 172.61 2jwh s LYS 467 N -0.27 0.50 0.00 0.00 0.00 -0.83 -1.46 119.74 117.68 2jwh s LYS 467 Ca 0.18 0.76 0.14 0.00 0.00 0.00 0.00 55.97 57.05 2jwh s LYS 467 Cb -0.14 0.14 0.86 0.00 0.00 0.00 0.00 37.83 38.69 2jwh s LYS 467 CO 0.06 -0.11 1.28 -3.47 0.00 0.00 0.00 175.35 173.11