#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 2.97 0.14 2.61 2.01 -1.26 -4.91 115.64 117.20 2jwh s THR 422 Ca 0.00 0.62 -0.12 0.00 0.31 0.00 0.00 61.69 62.50 2jwh s THR 422 Cb 0.00 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.08 2jwh s THR 422 CO 0.00 0.03 1.49 0.50 -0.69 0.00 0.00 174.62 175.95 2jwh h LYS 423 N 7.31 0.89 0.00 4.92 1.63 -2.10 -3.48 116.57 125.74 2jwh h LYS 423 Ca -0.42 -0.43 0.00 0.00 -0.85 0.00 0.00 60.65 58.95 2jwh h LYS 423 Cb 1.20 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 2jwh h LYS 423 CO 0.91 1.08 0.00 0.00 -3.45 0.00 0.00 179.45 177.99 2jwh n ALA 424 N -2.52 0.00 -3.76 5.00 0.00 -1.26 -4.92 120.51 113.05 2jwh n ALA 424 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.15 2jwh n ALA 424 Cb 0.49 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.99 2jwh n ALA 424 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jwh n SER 425 N -1.60 -5.31 -4.73 0.00 7.64 -1.26 -4.92 113.62 103.44 2jwh n SER 425 Ca 0.00 -0.67 -0.41 0.00 1.01 0.00 0.00 58.87 58.79 2jwh n SER 425 Cb 0.00 -4.42 -0.04 0.00 -1.01 0.00 0.00 64.21 58.75 2jwh n SER 425 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2jwh s LYS 426 N -6.44 4.55 -1.53 1.43 2.20 -1.26 -2.62 119.74 116.07 2jwh s LYS 426 Ca 0.59 1.67 -0.05 0.00 -0.36 0.00 0.00 55.97 57.82 2jwh s LYS 426 Cb -0.28 -3.33 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 2jwh s LYS 426 CO 0.78 -0.02 0.63 0.43 -0.36 0.00 0.00 175.35 176.81 2jwh n SER 427 N 3.03 -5.94 0.00 1.43 7.64 -1.26 -4.77 113.62 113.75 2jwh n SER 427 Ca 0.05 -0.31 0.00 0.00 1.01 0.00 0.00 58.87 59.62 2jwh n SER 427 Cb 0.47 -4.80 0.00 0.00 -1.01 0.00 0.00 64.21 58.87 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 -1.52 0.00 3.72 0.23 0.00 -1.19 -5.14 105.19 101.30 2jwh n GLY 428 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 2jwh n GLY 428 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jwh s VAL 429 N 0.00 3.28 0.12 1.61 0.11 -1.08 -4.89 120.40 119.56 2jwh s VAL 429 Ca 0.00 0.97 -0.23 0.00 -2.93 0.00 0.00 61.98 59.79 2jwh s VAL 429 Cb 0.00 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.19 2jwh s VAL 429 CO 0.00 0.10 1.66 -0.65 -3.33 0.00 0.00 175.10 172.89 2jwh h PRO 430 N 6.22 -0.24 -3.14 1.54 0.11 -2.00 -2.69 132.00 131.79 2jwh h PRO 430 Ca -0.43 0.02 -0.71 0.00 0.11 0.00 0.00 66.00 64.98 2jwh h PRO 430 Cb 1.21 0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 2jwh h PRO 430 CO 0.83 -0.16 3.05 0.28 -0.21 0.00 0.00 178.00 181.79 2jwh n VAL 431 N -5.31 4.44 0.05 3.15 0.31 -1.26 -4.64 118.33 115.08 2jwh n VAL 431 Ca -0.04 -3.42 -0.06 0.00 -0.01 0.00 0.00 64.34 60.81 2jwh n VAL 431 Cb 0.22 -2.42 0.12 0.00 -0.91 0.00 0.00 33.84 30.85 2jwh n VAL 431 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jwh h THR 432 N 3.17 1.34 -2.92 2.52 1.03 -1.87 -3.44 112.91 112.74 2jwh h THR 432 Ca 0.70 -1.79 -0.61 0.00 -0.01 0.00 0.00 66.41 64.70 2jwh h THR 432 Cb 0.40 1.82 -0.05 0.00 -1.07 0.00 0.00 68.15 69.25 2jwh h THR 432 CO 1.70 0.54 -0.52 -1.10 -0.01 0.00 0.00 175.52 176.12 2jwh s GLN 433 N -3.96 3.28 0.29 0.00 -0.21 -1.26 -5.08 119.66 112.72 2jwh s GLN 433 Ca -0.05 -0.54 -0.27 0.00 0.02 0.00 0.00 55.36 54.51 2jwh s GLN 433 Cb 0.12 -2.94 -0.10 0.00 1.00 0.00 0.00 33.01 31.10 2jwh s GLN 433 CO 0.81 0.58 0.94 0.95 -2.12 0.00 0.00 175.29 176.45 2jwh s THR 434 N -1.52 4.15 0.29 -0.19 -4.23 -1.26 -4.96 115.64 107.92 2jwh s THR 434 Ca 0.33 1.92 -0.02 0.00 -1.18 0.00 0.00 61.69 62.74 2jwh s THR 434 Cb -0.12 -4.12 0.20 0.00 1.34 0.00 0.00 72.50 69.79 2jwh s THR 434 CO 0.26 0.27 1.88 0.06 -0.54 0.00 0.00 174.62 176.56 2jwh h GLN 435 N 3.53 0.96 -6.34 3.99 3.07 -1.98 -3.35 115.11 114.98 2jwh h GLN 435 Ca -0.46 -0.13 -0.55 0.00 0.09 0.00 0.00 58.65 57.60 2jwh h GLN 435 Cb 1.19 -0.18 -0.04 0.00 0.08 0.00 0.00 27.48 28.54 2jwh h GLN 435 CO 0.66 0.75 0.07 0.99 0.09 0.00 0.00 178.83 181.39 2jwh s THR 436 N -5.53 4.60 -0.96 1.86 2.01 -1.26 -3.84 115.64 112.52 2jwh s THR 436 Ca -0.11 1.45 -0.06 0.00 0.31 0.00 0.00 61.69 63.29 2jwh s THR 436 Cb 0.16 -4.02 0.01 0.00 0.01 0.00 0.00 72.50 68.66 2jwh s THR 436 CO 0.80 0.51 0.84 0.00 -0.69 0.00 0.00 174.62 176.08 2jwh n ALA 437 N 1.86 -1.02 -0.00 7.40 0.00 -1.26 -4.95 120.51 122.54 2jwh n ALA 437 Ca -0.07 0.25 -0.20 0.00 0.00 0.00 0.00 53.44 53.42 2jwh n ALA 437 Cb 0.50 -3.82 -0.14 0.00 0.00 0.00 0.00 19.45 15.99 2jwh n ALA 437 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2jwh h GLY 438 N -1.88 0.23 0.00 0.00 0.00 -1.70 -3.47 103.07 96.25 2jwh h GLY 438 Ca -0.41 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.34 2jwh h GLY 438 CO 0.40 0.50 0.00 0.00 0.00 0.00 0.00 176.54 177.44 2jwh n ALA 439 N -2.86 0.00 -1.74 3.60 0.00 -1.26 -4.93 120.51 113.31 2jwh n ALA 439 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 2jwh n ALA 439 Cb 0.79 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.23 2jwh n ALA 439 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jwh n ASP 440 N 0.70 3.51 -3.22 0.00 8.00 -1.26 -1.92 116.55 122.36 2jwh n ASP 440 Ca 0.00 1.19 -0.22 0.00 0.71 0.00 0.00 54.79 56.47 2jwh n ASP 440 Cb 0.00 -1.56 0.06 0.00 -0.02 0.00 0.00 41.12 39.60 2jwh n ASP 440 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2jwh n THR 441 N 1.19 -2.52 -1.13 -3.53 -1.04 -1.26 -4.55 114.28 101.44 2jwh n THR 441 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2jwh n THR 441 Cb 0.37 -3.69 0.00 0.00 -1.82 0.00 0.00 70.33 65.19 2jwh n THR 441 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2jwh n THR 442 N -4.73 -4.62 -0.96 12.58 -1.04 -0.81 -4.69 114.28 110.00 2jwh n THR 442 Ca -0.03 1.60 -0.12 0.00 -2.04 0.00 0.00 64.05 63.46 2jwh n THR 442 Cb 0.58 -2.70 -0.10 0.00 -1.82 0.00 0.00 70.33 66.28 2jwh n THR 442 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jwh n ALA 443 N 0.26 5.81 -3.52 2.41 0.00 -1.18 -4.72 120.51 119.58 2jwh n ALA 443 Ca 0.00 -1.63 -0.21 0.00 0.00 0.00 0.00 53.44 51.60 2jwh n ALA 443 Cb 0.00 -1.95 0.05 0.00 0.00 0.00 0.00 19.45 17.55 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 1.89 -3.41 -0.01 0.00 4.71 -1.26 -4.93 120.64 117.63 2jwh n GLU 444 Ca 0.34 0.69 -0.17 0.00 -0.01 0.00 0.00 57.16 58.01 2jwh n GLU 444 Cb 0.75 -5.23 -0.10 0.00 -1.01 0.00 0.00 31.44 25.85 2jwh n GLU 444 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2jwh h LYS 445 N -1.63 0.45 0.14 3.49 1.79 -1.96 -3.33 116.57 115.52 2jwh h LYS 445 Ca -0.62 -0.43 -0.19 0.00 -2.18 0.00 0.00 60.65 57.23 2jwh h LYS 445 Cb 1.34 0.11 0.02 0.00 -1.58 0.00 0.00 32.23 32.12 2jwh h LYS 445 CO 0.50 1.08 -0.85 0.00 -1.08 0.00 0.00 179.45 179.09 2jwh s LYS 447 N -2.43 3.49 0.00 0.00 2.47 -1.12 -2.10 119.74 120.06 2jwh s LYS 447 Ca -0.14 2.23 0.00 0.00 -1.56 0.00 0.00 55.97 56.50 2jwh s LYS 447 Cb 0.01 -4.30 0.00 0.00 -1.46 0.00 0.00 37.83 32.09 2jwh s LYS 447 CO 0.83 -1.69 0.00 0.41 0.16 0.00 0.00 175.35 175.06 2jwh n GLY 448 N 5.32 1.24 3.76 5.54 0.00 -1.26 -4.89 105.19 114.90 2jwh n GLY 448 Ca 0.26 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.89 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 4.58 0.65 1.61 1.02 -0.89 -5.03 119.74 121.68 2jwh s LYS 449 Ca 0.00 1.69 -0.12 0.00 0.02 0.00 0.00 55.97 57.56 2jwh s LYS 449 Cb 0.00 -3.07 -0.01 0.00 -0.52 0.00 0.00 37.83 34.23 2jwh s LYS 449 CO 0.00 0.19 1.05 0.20 -0.92 0.00 0.00 175.35 175.87 2jwh s GLY 450 N -1.07 1.82 0.33 -3.33 0.00 -1.26 -4.40 107.32 99.40 2jwh s GLY 450 Ca 0.47 0.17 0.01 0.00 0.00 0.00 0.00 44.72 45.36 2jwh s GLY 450 CO 0.37 0.47 1.99 -2.09 0.00 0.00 0.00 173.10 173.84 2jwh h GLU 451 N -0.28 0.91 -1.63 2.90 4.81 -1.96 0.84 114.58 120.16 2jwh h GLU 451 Ca -0.45 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 58.60 2jwh h GLU 451 Cb 1.21 -0.20 -0.06 0.00 0.63 0.00 0.00 28.75 30.33 2jwh h GLU 451 CO 0.57 0.62 0.16 1.63 -0.73 0.00 0.00 179.01 181.26 2jwh n LYS 452 N -4.42 1.30 0.00 1.92 5.02 -1.26 -3.77 118.16 116.95 2jwh n LYS 452 Ca 0.07 -0.61 0.00 0.00 -2.02 0.00 0.00 58.31 55.75 2jwh n LYS 452 Cb 0.05 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2jwh n LYS 452 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jwh n ASP 453 N 0.86 -0.05 -4.69 4.39 2.03 -0.75 -5.10 116.55 113.24 2jwh n ASP 453 Ca 0.12 0.01 -0.42 0.00 0.52 0.00 0.00 54.79 55.02 2jwh n ASP 453 Cb 0.57 0.45 -0.03 0.00 -0.72 0.00 0.00 41.12 41.40 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 2.35 4.14 0.08 0.00 -0.14 -1.26 -4.74 119.74 120.17 2jwh s LYS 455 Ca 0.68 0.46 -0.23 0.00 -1.36 0.00 0.00 55.97 55.52 2jwh s LYS 455 Cb -0.35 -3.32 -0.15 0.00 -1.68 0.00 0.00 37.83 32.33 2jwh s LYS 455 CO 0.29 0.45 1.71 1.03 -0.76 0.00 0.00 175.35 178.08 2jwh h SER 456 N 5.56 0.00 0.13 2.83 0.87 -1.94 0.64 113.55 121.64 2jwh h SER 456 Ca -0.47 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.04 2jwh h SER 456 Cb 1.20 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2jwh h SER 456 CO 0.68 0.03 -0.11 -0.65 -0.53 0.00 0.00 176.83 176.25 2jwh h PRO 457 N -0.03 0.00 0.19 2.24 0.11 -2.01 -2.91 132.00 129.60 2jwh h PRO 457 Ca 0.00 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.84 2jwh h PRO 457 Cb 0.03 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.16 2jwh h PRO 457 CO -0.00 0.11 -1.20 0.22 -0.21 0.00 0.00 178.00 176.92 2jwh h ASP 458 N 0.00 0.63 -3.58 -2.05 3.58 -1.85 -3.46 116.42 109.69 2jwh h ASP 458 Ca -0.00 -0.93 -0.22 0.00 0.42 0.00 0.00 57.03 56.30 2jwh h ASP 458 Cb 0.21 -0.21 -0.29 0.00 1.72 0.00 0.00 39.33 40.76 2jwh h ASP 458 CO 0.01 1.57 -0.57 0.00 -2.88 0.00 0.00 179.24 177.37 2jwh s LYS 460 N 0.69 3.81 -0.26 0.00 2.47 -0.47 -3.72 119.74 122.27 2jwh s LYS 460 Ca -0.05 1.96 -0.24 0.00 -1.56 0.00 0.00 55.97 56.08 2jwh s LYS 460 Cb -0.07 -4.10 -0.00 0.00 -1.46 0.00 0.00 37.83 32.20 2jwh s LYS 460 CO -0.03 -1.29 0.82 -0.46 0.16 0.00 0.00 175.35 174.54 2jwh s TRP 461 N 5.36 3.28 -0.22 4.03 -0.11 -1.26 -0.10 118.94 129.92 2jwh s TRP 461 Ca 0.79 1.06 -0.10 0.00 1.22 0.00 0.00 56.10 59.06 2jwh s TRP 461 Cb -0.30 -3.08 0.08 0.00 -1.50 0.00 0.00 33.47 28.66 2jwh s TRP 461 CO 0.32 -0.44 0.50 -2.00 -4.62 0.00 0.00 176.95 170.72 2jwh s GLU 462 N 2.86 0.46 -0.95 5.86 2.56 0.15 -4.90 118.70 124.75 2jwh s GLU 462 Ca 0.34 1.04 -0.02 0.00 0.00 0.00 0.00 54.97 56.33 2jwh s GLU 462 Cb -0.15 0.22 0.00 0.00 2.00 0.00 0.00 34.13 36.20 2jwh s GLU 462 CO 0.09 -0.19 0.21 0.41 -0.56 0.00 0.00 175.26 175.22 2jwh n GLY 463 N 4.73 -0.06 3.17 -1.50 0.00 -1.26 -2.95 105.19 107.32 2jwh n GLY 463 Ca -0.17 -0.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.12 -0.30 3.60 -0.02 0.00 -1.26 -5.00 105.19 101.09 2jwh n GLY 464 Ca -0.10 0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.23 0.00 0.04 2.61 -1.32 -1.15 -5.03 115.64 107.55 2jwh s THR 465 Ca 0.45 0.00 -0.23 0.00 -1.21 0.00 0.00 61.69 60.70 2jwh s THR 465 Cb -0.20 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.73 2jwh s THR 465 CO 0.56 0.00 0.70 0.00 -2.21 0.00 0.00 174.62 173.67 2jwh s LYS 467 N -0.26 0.97 0.00 0.00 1.02 0.86 -2.79 119.74 119.54 2jwh s LYS 467 Ca 0.35 -0.42 0.22 0.00 0.02 0.00 0.00 55.97 56.14 2jwh s LYS 467 Cb -0.20 -0.94 1.32 0.00 -0.52 0.00 0.00 37.83 37.49 2jwh s LYS 467 CO 0.21 0.25 1.69 -3.47 -0.92 0.00 0.00 175.35 173.12