#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 4.00 -0.03 2.61 2.01 -1.26 -4.90 115.64 118.07 2jwh s THR 422 Ca 0.00 1.21 -0.17 0.00 0.31 0.00 0.00 61.69 63.05 2jwh s THR 422 Cb 0.00 -3.78 -0.32 0.00 0.01 0.00 0.00 72.50 68.41 2jwh s THR 422 CO 0.00 -0.11 0.82 0.11 -0.69 0.00 0.00 174.62 174.75 2jwh h LYS 423 N 8.73 0.39 0.00 4.92 1.57 -2.10 -3.47 116.57 126.61 2jwh h LYS 423 Ca -0.31 -0.67 0.00 0.00 -1.87 0.00 0.00 60.65 57.80 2jwh h LYS 423 Cb 1.13 0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.69 2jwh h LYS 423 CO 0.96 1.32 0.00 0.00 -0.57 0.00 0.00 179.45 181.16 2jwh n ALA 424 N -2.78 0.00 -2.25 3.86 0.00 -1.26 -4.73 120.51 113.34 2jwh n ALA 424 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.88 2jwh n ALA 424 Cb 0.98 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.37 2jwh n ALA 424 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jwh s SER 425 N -3.26 6.98 0.09 0.00 0.15 -1.26 -5.07 113.70 111.32 2jwh s SER 425 Ca 0.00 1.24 -0.20 0.00 0.70 0.00 0.00 55.95 57.69 2jwh s SER 425 Cb 0.00 -2.35 0.05 0.00 -1.71 0.00 0.00 66.02 62.01 2jwh s SER 425 CO 0.00 0.14 0.49 -1.59 1.20 0.00 0.00 173.24 173.48 2jwh s LYS 426 N -1.67 1.08 0.00 5.44 -2.85 -1.26 -4.95 119.74 115.53 2jwh s LYS 426 Ca 0.36 -0.43 0.00 0.00 -1.00 0.00 0.00 55.97 54.90 2jwh s LYS 426 Cb -0.17 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 2jwh s LYS 426 CO 0.20 -0.42 0.00 0.43 0.10 0.00 0.00 175.35 175.66 2jwh n SER 427 N 0.07 0.00 0.00 0.03 7.64 -1.26 -4.71 113.62 115.39 2jwh n SER 427 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.71 2jwh n SER 427 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 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 0.00 0.61 3.72 0.23 0.00 -1.26 -5.13 105.19 103.36 2jwh n GLY 428 Ca 0.00 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 2jwh n GLY 428 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jwh n VAL 429 N -0.02 0.52 -0.16 1.61 0.31 -1.26 -4.83 118.33 114.50 2jwh n VAL 429 Ca 0.00 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 2jwh n VAL 429 Cb 0.00 -1.89 0.00 0.00 -0.91 0.00 0.00 33.84 31.04 2jwh n VAL 429 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2jwh n PRO 430 N 2.97 0.54 -1.69 5.55 -0.04 -1.26 -4.57 135.00 136.50 2jwh n PRO 430 Ca 0.13 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.18 2jwh n PRO 430 Cb 0.35 -1.23 -0.01 0.00 -0.04 0.00 0.00 33.50 32.56 2jwh n PRO 430 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2jwh n VAL 431 N 1.59 4.39 -0.87 0.52 3.14 -1.26 -4.82 118.33 121.01 2jwh n VAL 431 Ca 0.00 -3.33 -0.21 0.00 -2.96 0.00 0.00 64.34 57.84 2jwh n VAL 431 Cb 0.27 -2.45 -0.06 0.00 -1.06 0.00 0.00 33.84 30.54 2jwh n VAL 431 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2jwh n THR 432 N 3.38 2.81 -2.69 1.55 -1.04 -1.26 -3.85 114.28 113.17 2jwh n THR 432 Ca 0.65 -1.59 -0.06 0.00 -2.04 0.00 0.00 64.05 61.00 2jwh n THR 432 Cb 0.28 -2.15 0.11 0.00 -1.82 0.00 0.00 70.33 66.76 2jwh n THR 432 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 2jwh n GLN 433 N 3.47 1.23 0.00 -2.82 -0.06 -1.26 -5.14 117.38 112.79 2jwh n GLN 433 Ca 0.48 -1.85 0.00 0.00 -2.00 0.00 0.00 57.00 53.63 2jwh n GLN 433 Cb 0.36 -0.07 0.00 0.00 -4.06 0.00 0.00 30.24 26.47 2jwh n GLN 433 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2jwh n THR 434 N -0.71 0.00 -3.77 1.69 -2.24 -1.25 -4.87 114.28 103.13 2jwh n THR 434 Ca -0.04 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.61 2jwh n THR 434 Cb 0.85 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.98 2jwh n THR 434 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2jwh s GLN 435 N 0.00 0.47 -0.23 -0.78 -0.21 -1.26 -4.95 119.66 112.69 2jwh s GLN 435 Ca 0.00 0.20 -0.15 0.00 0.02 0.00 0.00 55.36 55.43 2jwh s GLN 435 Cb 0.00 0.22 -0.09 0.00 1.00 0.00 0.00 33.01 34.13 2jwh s GLN 435 CO 0.00 -0.09 -0.35 2.41 -2.12 0.00 0.00 175.29 175.14 2jwh n THR 436 N 2.33 1.49 0.00 -0.19 -1.04 -1.26 -5.02 114.28 110.59 2jwh n THR 436 Ca -0.16 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 2jwh n THR 436 Cb 0.57 -2.05 0.00 0.00 -1.82 0.00 0.00 70.33 67.03 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 -4.30 0.00 -2.00 2.41 0.00 -1.26 -4.97 120.51 110.39 2jwh n ALA 437 Ca -0.37 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.01 2jwh n ALA 437 Cb 0.73 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.13 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 0.49 2.51 0.00 0.00 -1.26 -4.92 105.19 102.01 2jwh n GLY 438 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.10 1.34 -0.17 4.61 0.00 -1.26 -5.00 120.51 119.93 2jwh n ALA 439 Ca -0.24 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.27 2jwh n ALA 439 Cb 0.67 -0.84 0.16 0.00 0.00 0.00 0.00 19.45 19.43 2jwh n ALA 439 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2jwh h ASP 440 N 1.13 0.86 0.00 0.00 3.32 -1.94 -2.99 116.42 116.80 2jwh h ASP 440 Ca -0.36 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2jwh h ASP 440 Cb 1.25 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.58 2jwh h ASP 440 CO -0.13 0.83 0.00 0.35 -1.72 0.00 0.00 179.24 178.56 2jwh n THR 441 N -4.27 1.59 0.29 0.35 -2.24 -1.26 -4.34 114.28 104.40 2jwh n THR 441 Ca 0.04 -0.38 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 2jwh n THR 441 Cb 0.23 -1.37 -0.06 0.00 -2.10 0.00 0.00 70.33 67.03 2jwh n THR 441 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2jwh h THR 442 N 1.10 0.00 0.00 4.28 2.02 -1.96 -3.48 112.91 114.87 2jwh h THR 442 Ca 0.00 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.99 2jwh h THR 442 Cb 0.83 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2jwh h THR 442 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 2jwh n ALA 443 N -2.52 0.00 -3.50 6.16 0.00 -1.26 -4.99 120.51 114.40 2jwh n ALA 443 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 2jwh n ALA 443 Cb 0.30 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.82 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 0.00 -7.28 -0.09 0.00 1.02 -1.26 -4.91 120.64 108.11 2jwh n GLU 444 Ca 0.00 0.77 -0.11 0.00 -0.02 0.00 0.00 57.16 57.80 2jwh n GLU 444 Cb 0.00 -5.63 -0.04 0.00 -0.02 0.00 0.00 31.44 25.75 2jwh n GLU 444 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2jwh h LYS 445 N -2.44 0.47 0.02 3.49 3.64 -1.94 -3.34 116.57 116.47 2jwh h LYS 445 Ca -0.53 -0.15 -0.39 0.00 -1.27 0.00 0.00 60.65 58.31 2jwh h LYS 445 Cb 1.34 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 33.06 2jwh h LYS 445 CO 0.51 0.63 -2.39 0.00 -2.27 0.00 0.00 179.45 175.93 2jwh n LYS 447 N -3.40 2.65 0.00 0.00 4.81 -1.25 -2.82 118.16 118.14 2jwh n LYS 447 Ca -0.44 0.96 0.00 0.00 -0.87 0.00 0.00 58.31 57.96 2jwh n LYS 447 Cb 0.99 -2.84 0.00 0.00 0.02 0.00 0.00 35.03 33.20 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 4.16 1.46 0.00 3.14 0.00 -1.26 -4.79 105.19 107.90 2jwh n GLY 448 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 3.31 -4.33 1.61 5.02 -1.13 -5.06 118.16 117.57 2jwh n LYS 449 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 2jwh n LYS 449 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 2jwh n LYS 449 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2jwh s GLY 450 N -0.27 1.41 0.32 0.72 0.00 -1.26 -4.72 107.32 103.52 2jwh s GLY 450 Ca 0.00 -1.66 0.09 0.00 0.00 0.00 0.00 44.72 43.15 2jwh s GLY 450 CO 0.00 -1.73 1.61 -2.09 0.00 0.00 0.00 173.10 170.90 2jwh h GLU 451 N 2.57 0.12 -0.54 2.90 4.81 -1.98 1.04 114.58 123.50 2jwh h GLU 451 Ca -0.38 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.80 2jwh h GLU 451 Cb 1.22 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 2jwh h GLU 451 CO 0.63 0.08 0.17 0.87 -0.73 0.00 0.00 179.01 180.03 2jwh h LYS 452 N 0.12 0.83 0.04 1.92 1.79 -1.99 -2.93 116.57 116.35 2jwh h LYS 452 Ca 0.67 -0.18 -0.00 0.00 -2.18 0.00 0.00 60.65 58.96 2jwh h LYS 452 Cb 1.54 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 32.07 2jwh h LYS 452 CO -0.75 0.76 -0.02 -0.44 -1.08 0.00 0.00 179.45 177.93 2jwh h ASP 453 N 0.74 -0.04 0.00 0.86 3.32 -1.25 -3.30 116.42 116.75 2jwh h ASP 453 Ca 0.17 -0.58 -0.24 0.00 0.02 0.00 0.00 57.03 56.40 2jwh h ASP 453 Cb 0.28 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 2jwh h ASP 453 CO -0.01 0.59 1.04 0.00 -1.72 0.00 0.00 179.24 179.14 2jwh s LYS 455 N 2.31 3.93 0.20 0.00 -2.85 -1.11 -4.63 119.74 117.59 2jwh s LYS 455 Ca 0.43 2.33 -0.12 0.00 -1.00 0.00 0.00 55.97 57.60 2jwh s LYS 455 Cb 0.17 -2.79 0.24 0.00 -2.06 0.00 0.00 37.83 33.38 2jwh s LYS 455 CO -0.01 -0.58 1.67 1.03 0.10 0.00 0.00 175.35 177.55 2jwh h SER 456 N 2.69 -0.27 -0.81 0.03 0.87 -1.83 0.60 113.55 114.82 2jwh h SER 456 Ca -0.50 0.14 0.06 0.00 -1.23 0.00 0.00 61.79 60.26 2jwh h SER 456 Cb 1.25 0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 63.41 2jwh h SER 456 CO 0.63 -0.10 0.53 1.55 -0.53 0.00 0.00 176.83 178.90 2jwh h PRO 457 N 0.10 0.87 0.13 2.24 0.13 -2.00 -2.83 132.00 130.64 2jwh h PRO 457 Ca 0.28 -0.05 -0.32 0.00 -0.87 0.00 0.00 66.00 65.04 2jwh h PRO 457 Cb 0.45 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.37 2jwh h PRO 457 CO -0.48 0.57 -1.64 0.22 -0.23 0.00 0.00 178.00 176.44 2jwh h ASP 458 N 0.89 0.43 -3.67 1.44 1.82 -1.71 -3.47 116.42 112.15 2jwh h ASP 458 Ca 0.34 -0.64 -0.29 0.00 -0.39 0.00 0.00 57.03 56.05 2jwh h ASP 458 Cb 0.21 -0.14 -0.31 0.00 0.68 0.00 0.00 39.33 39.78 2jwh h ASP 458 CO -0.12 1.54 -0.74 0.00 -1.61 0.00 0.00 179.24 178.32 2jwh s LYS 460 N 0.43 4.18 -0.14 0.00 2.20 -1.26 -3.49 119.74 121.66 2jwh s LYS 460 Ca -0.04 1.76 0.01 0.00 -0.36 0.00 0.00 55.97 57.34 2jwh s LYS 460 Cb -0.06 -2.74 -0.00 0.00 -1.51 0.00 0.00 37.83 33.52 2jwh s LYS 460 CO -0.01 -0.19 -0.16 -0.46 -0.36 0.00 0.00 175.35 174.17 2jwh s TRP 461 N -1.43 2.76 -0.07 4.03 -0.11 -1.26 0.39 118.94 123.25 2jwh s TRP 461 Ca 0.55 -0.98 -0.06 0.00 1.22 0.00 0.00 56.10 56.82 2jwh s TRP 461 Cb -0.29 -1.86 -0.02 0.00 -1.50 0.00 0.00 33.47 29.80 2jwh s TRP 461 CO 0.37 -0.43 -0.12 -1.91 -4.62 0.00 0.00 176.95 170.23 2jwh n GLU 462 N 3.91 0.22 -2.67 5.86 2.13 -1.10 -4.95 120.64 124.03 2jwh n GLU 462 Ca -0.19 0.20 0.01 0.00 0.66 0.00 0.00 57.16 57.84 2jwh n GLU 462 Cb 0.52 -1.01 0.02 0.00 0.27 0.00 0.00 31.44 31.24 2jwh n GLU 462 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2jwh s GLY 463 N -3.60 -1.73 -0.99 8.31 0.00 -1.26 -4.94 107.32 103.12 2jwh s GLY 463 Ca -0.10 1.32 -0.01 0.00 0.00 0.00 0.00 44.72 45.93 2jwh s GLY 463 CO 0.15 4.45 0.11 0.61 0.00 0.00 0.00 173.10 178.42 2jwh n GLY 464 N 3.26 -0.09 3.64 0.20 0.00 -1.26 -4.99 105.19 105.96 2jwh n GLY 464 Ca 0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.70 0.00 0.27 2.61 -1.32 -1.26 -5.08 115.64 108.16 2jwh s THR 465 Ca 0.06 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.24 2jwh s THR 465 Cb -0.02 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.87 2jwh s THR 465 CO 0.07 0.00 1.00 0.00 -2.21 0.00 0.00 174.62 173.47 2jwh s LYS 467 N -1.42 2.43 0.00 0.00 -0.14 0.16 -3.97 119.74 116.81 2jwh s LYS 467 Ca 0.44 -0.89 0.00 0.00 -1.36 0.00 0.00 55.97 54.16 2jwh s LYS 467 Cb -0.27 -2.49 0.00 0.00 -1.68 0.00 0.00 37.83 33.39 2jwh s LYS 467 CO 0.34 -0.79 0.00 -3.47 -0.76 0.00 0.00 175.35 170.67