#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rok n SER 424 N 0.00 0.66 0.14 1.61 7.64 -1.26 -4.83 113.62 117.57 2rok n SER 424 Ca 0.00 -1.30 0.06 0.00 1.01 0.00 0.00 58.87 58.64 2rok n SER 424 Cb 0.00 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 63.74 2rok n SER 424 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2rok h SER 425 N 0.00 0.22 0.22 6.43 0.87 -1.99 -1.23 113.55 118.07 2rok h SER 425 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2rok h SER 425 Cb 0.74 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 2rok h SER 425 CO 0.00 0.16 0.00 0.61 -0.53 0.00 0.00 176.83 177.07 2rok n GLY 426 N -1.51 -0.75 0.24 5.77 0.00 -1.26 -2.20 105.19 105.49 2rok n GLY 426 Ca -0.00 -0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2rok n GLY 426 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2rok n SER 427 N -1.58 1.25 -1.50 1.61 7.64 -0.56 -5.01 113.62 115.46 2rok n SER 427 Ca 0.01 -2.49 -0.13 0.00 1.01 0.00 0.00 58.87 57.27 2rok n SER 427 Cb 0.08 -0.29 -0.05 0.00 -1.01 0.00 0.00 64.21 62.93 2rok n SER 427 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2rok n SER 428 N -0.73 -3.47 0.00 6.43 7.64 -0.93 -1.88 113.62 120.69 2rok n SER 428 Ca 0.08 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.26 2rok n SER 428 Cb 0.64 -3.21 0.00 0.00 -1.01 0.00 0.00 64.21 60.63 2rok n SER 428 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rok n GLY 429 N -0.31 0.40 0.00 0.23 0.00 -0.62 -4.87 105.19 100.02 2rok n GLY 429 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2rok n GLY 429 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rok n GLY 430 N -1.73 0.16 3.65 -0.02 0.00 -0.79 -5.11 105.19 101.36 2rok n GLY 430 Ca 0.00 -1.44 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 2rok n GLY 430 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rok s PRO 431 N -1.80 -0.33 0.00 1.61 0.04 -1.26 -4.95 135.00 128.31 2rok s PRO 431 Ca 0.00 0.19 0.14 0.00 0.04 0.00 0.00 61.00 61.38 2rok s PRO 431 Cb 0.00 -1.68 0.86 0.00 0.04 0.00 0.00 34.50 33.72 2rok s PRO 431 CO 0.00 -3.17 1.29 -0.40 0.04 0.00 0.00 177.00 174.76 2rok n ASP 432 N -4.43 0.00 -3.53 6.66 5.75 -1.26 -4.83 116.55 114.92 2rok n ASP 432 Ca 0.09 -0.65 -0.16 0.00 -0.01 0.00 0.00 54.79 54.07 2rok n ASP 432 Cb 0.59 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.61 2rok n ASP 432 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 2rok s LEU 433 N -1.82 1.27 -0.10 -2.12 0.05 -1.26 -5.19 118.68 109.50 2rok s LEU 433 Ca 0.22 -1.53 -0.10 0.00 0.05 0.00 0.00 54.13 52.77 2rok s LEU 433 Cb 0.10 0.93 0.03 0.00 -2.05 0.00 0.00 46.19 45.20 2rok s LEU 433 CO 0.17 -1.11 0.28 0.00 -0.55 0.00 0.00 176.35 175.14 2rok s GLN 434 N -3.49 0.33 0.40 1.48 -2.07 -1.26 -5.08 119.66 109.97 2rok s GLN 434 Ca 0.36 0.37 0.07 0.00 -1.82 0.00 0.00 55.36 54.34 2rok s GLN 434 Cb 0.02 0.16 0.84 0.00 -1.09 0.00 0.00 33.01 32.94 2rok s GLN 434 CO 0.21 -0.04 2.04 -1.35 -1.32 0.00 0.00 175.29 174.83 2rok h PRO 435 N 5.67 0.57 -4.58 9.60 0.11 -2.03 -3.46 132.00 137.88 2rok h PRO 435 Ca -0.26 -0.03 -0.29 0.00 0.11 0.00 0.00 66.00 65.52 2rok h PRO 435 Cb 1.19 -0.13 -0.14 0.00 0.11 0.00 0.00 31.00 32.04 2rok h PRO 435 CO 0.33 0.38 -0.52 0.15 -0.21 0.00 0.00 178.00 178.13 2rok s LYS 436 N -5.52 1.42 -0.03 1.05 -0.14 -1.26 -5.10 119.74 110.17 2rok s LYS 436 Ca -0.08 -1.72 0.04 0.00 -1.36 0.00 0.00 55.97 52.85 2rok s LYS 436 Cb 0.18 0.31 0.06 0.00 -1.68 0.00 0.00 37.83 36.70 2rok s LYS 436 CO 0.74 -0.51 0.89 0.54 -0.76 0.00 0.00 175.35 176.25 2rok n ARG 437 N -0.39 1.07 0.14 1.68 5.12 -1.26 -4.86 116.66 118.17 2rok n ARG 437 Ca 0.03 -1.33 0.10 0.00 -1.93 0.00 0.00 57.85 54.72 2rok n ARG 437 Cb 0.64 -0.85 0.52 0.00 -1.16 0.00 0.00 32.46 31.61 2rok n ARG 437 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2rok n ASP 438 N -0.44 0.50 -0.29 0.55 8.00 -1.26 -1.84 116.55 121.76 2rok n ASP 438 Ca 0.03 0.73 0.08 0.00 0.71 0.00 0.00 54.79 56.34 2rok n ASP 438 Cb 0.51 -0.79 0.15 0.00 -0.02 0.00 0.00 41.12 40.97 2rok n ASP 438 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rok n HIS 439 N -2.17 0.26 -4.76 1.24 1.44 -1.26 -4.49 115.22 105.48 2rok n HIS 439 Ca -0.01 -0.87 -0.26 0.00 -2.01 0.00 0.00 57.72 54.56 2rok n HIS 439 Cb 0.04 -0.17 -0.14 0.00 0.12 0.00 0.00 29.99 29.83 2rok n HIS 439 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2rok s VAL 440 N -2.50 1.72 0.34 0.61 1.01 -0.76 -1.23 120.40 119.59 2rok s VAL 440 Ca 0.30 -1.16 0.08 0.00 0.00 0.00 0.00 61.98 61.20 2rok s VAL 440 Cb 0.25 -1.48 -0.07 0.00 0.00 0.00 0.00 36.38 35.08 2rok s VAL 440 CO 0.05 0.28 -0.05 -0.76 0.00 0.00 0.00 175.10 174.62 2rok s LEU 441 N -1.03 2.67 0.02 3.92 1.43 0.02 -2.43 118.68 123.27 2rok s LEU 441 Ca 0.08 -1.25 0.07 0.00 -1.03 0.00 0.00 54.13 51.99 2rok s LEU 441 Cb -0.09 -0.85 -0.02 0.00 0.03 0.00 0.00 46.19 45.26 2rok s LEU 441 CO 0.01 -0.33 -0.20 -2.28 0.23 0.00 0.00 176.35 173.79 2rok s HIS 442 N -2.78 1.74 0.01 0.29 5.65 0.29 -1.02 115.29 119.47 2rok s HIS 442 Ca 0.33 -0.35 0.02 0.00 0.25 0.00 0.00 55.06 55.30 2rok s HIS 442 Cb 0.05 -1.07 -0.01 0.00 -1.18 0.00 0.00 32.58 30.37 2rok s HIS 442 CO 0.16 0.04 -0.06 0.08 -0.65 0.00 0.00 174.74 174.30 2rok s VAL 443 N -0.65 0.48 -0.02 0.89 1.01 0.03 -0.96 120.40 121.18 2rok s VAL 443 Ca 0.07 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.63 2rok s VAL 443 Cb -0.08 -0.44 -0.00 0.00 0.00 0.00 0.00 36.38 35.85 2rok s VAL 443 CO 0.01 0.00 -0.13 -0.89 0.00 0.00 0.00 175.10 174.09 2rok s THR 444 N -0.44 1.06 0.10 3.92 2.01 -0.29 -1.86 115.64 120.14 2rok s THR 444 Ca -0.01 -0.53 -0.24 0.00 0.31 0.00 0.00 61.69 61.21 2rok s THR 444 Cb -0.04 -0.90 0.07 0.00 0.01 0.00 0.00 72.50 71.63 2rok s THR 444 CO -0.00 0.31 0.60 0.72 -0.69 0.00 0.00 174.62 175.56 2rok s PHE 445 N -0.05 -0.54 0.44 4.92 -0.12 -0.62 -1.12 117.98 120.88 2rok s PHE 445 Ca 0.00 0.50 -0.24 0.00 -0.05 0.00 0.00 56.93 57.14 2rok s PHE 445 Cb -0.08 0.49 -0.10 0.00 -0.63 0.00 0.00 43.02 42.71 2rok s PHE 445 CO 0.00 -0.77 1.11 -2.30 -0.05 0.00 0.00 175.22 173.21 2rok n PRO 446 N -0.01 1.52 0.18 1.99 -0.02 -1.26 -4.59 135.00 132.81 2rok n PRO 446 Ca -0.18 0.55 0.18 0.00 -2.02 0.00 0.00 63.50 62.03 2rok n PRO 446 Cb 0.63 -2.19 0.81 0.00 -0.02 0.00 0.00 33.50 32.73 2rok n PRO 446 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2rok h LYS 447 N 1.64 0.00 0.00 -0.52 2.10 -1.92 -1.79 116.57 116.08 2rok h LYS 447 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2rok h LYS 447 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 2rok h LYS 447 CO 0.57 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.41 2rok n GLU 448 N -3.73 0.13 -1.58 0.07 1.02 -1.26 -4.78 120.64 110.50 2rok n GLU 448 Ca 0.03 0.47 -0.33 0.00 -0.02 0.00 0.00 57.16 57.31 2rok n GLU 448 Cb 0.41 -1.79 0.06 0.00 -0.02 0.00 0.00 31.44 30.09 2rok n GLU 448 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2rok s TRP 449 N -3.30 2.56 0.33 -0.32 0.52 -0.67 -5.10 118.94 112.96 2rok s TRP 449 Ca 0.02 1.56 0.03 0.00 0.02 0.00 0.00 56.10 57.74 2rok s TRP 449 Cb 0.07 -3.16 -0.06 0.00 -1.15 0.00 0.00 33.47 29.18 2rok s TRP 449 CO 0.27 -1.79 0.07 0.15 0.02 0.00 0.00 176.95 175.67 2rok s LYS 450 N -4.31 1.67 0.47 4.98 3.01 -1.26 -5.02 119.74 119.29 2rok s LYS 450 Ca 0.66 -1.94 0.23 0.00 -1.01 0.00 0.00 55.97 53.91 2rok s LYS 450 Cb -0.20 -0.77 1.25 0.00 -1.01 0.00 0.00 37.83 37.10 2rok s LYS 450 CO 0.46 -0.24 1.90 1.15 0.51 0.00 0.00 175.35 179.12 2rok h THR 451 N 2.09 0.66 -0.49 2.17 2.02 -1.99 -1.45 112.91 115.92 2rok h THR 451 Ca -0.40 -0.07 -0.05 0.00 0.77 0.00 0.00 66.41 66.66 2rok h THR 451 Cb 1.25 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 2rok h THR 451 CO 0.67 0.04 0.13 0.28 0.37 0.00 0.00 175.52 177.01 2rok h SER 452 N 0.22 0.74 0.23 4.18 0.02 -1.99 0.20 113.55 117.16 2rok h SER 452 Ca 0.41 -0.23 -0.07 0.00 -0.84 0.00 0.00 61.79 61.06 2rok h SER 452 Cb 1.27 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 2rok h SER 452 CO -0.09 0.77 -0.30 0.44 -1.14 0.00 0.00 176.83 176.52 2rok h ASP 453 N 0.67 0.10 -0.23 3.07 3.32 -1.69 -0.86 116.42 120.81 2rok h ASP 453 Ca 0.16 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 2rok h ASP 453 Cb 0.32 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2rok h ASP 453 CO 0.00 0.40 -0.27 -0.07 -1.72 0.00 0.00 179.24 177.59 2rok h LEU 454 N 0.10 0.63 -1.02 1.55 3.38 -1.14 -1.02 115.31 117.79 2rok h LEU 454 Ca 0.01 -0.49 0.04 0.00 0.09 0.00 0.00 57.88 57.53 2rok h LEU 454 Cb 0.58 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 2rok h LEU 454 CO 0.04 0.99 0.66 1.88 0.09 0.00 0.00 178.44 182.10 2rok h TYR 455 N 0.28 1.23 -0.29 1.13 0.05 -0.75 -2.12 116.97 116.49 2rok h TYR 455 Ca 0.03 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.77 2rok h TYR 455 Cb 0.83 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 2rok h TYR 455 CO 0.08 0.70 -0.14 0.37 -1.05 0.00 0.00 178.16 178.12 2rok h GLN 456 N 1.26 0.50 -0.03 4.88 4.15 -1.01 -0.55 115.11 124.29 2rok h GLN 456 Ca 0.40 -0.15 -0.12 0.00 0.77 0.00 0.00 58.65 59.56 2rok h GLN 456 Cb 0.02 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 2rok h GLN 456 CO -0.13 0.63 -0.53 1.25 -1.93 0.00 0.00 178.83 178.12 2rok h LEU 457 N 0.46 0.10 -2.24 -2.39 5.85 -0.74 -3.35 115.31 113.00 2rok h LEU 457 Ca 0.08 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2rok h LEU 457 Cb 0.52 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.52 2rok h LEU 457 CO 0.03 0.61 0.00 0.49 -0.34 0.00 0.00 178.44 179.23 2rok n PHE 458 N -3.92 0.08 0.24 1.25 3.72 -0.84 -4.71 117.46 113.29 2rok n PHE 458 Ca -0.02 -0.30 0.17 0.00 -0.05 0.00 0.00 57.45 57.25 2rok n PHE 458 Cb 0.55 -0.03 0.86 0.00 -0.94 0.00 0.00 39.48 39.92 2rok n PHE 458 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2rok h SER 459 N 0.63 0.00 0.00 4.37 4.64 -1.24 -2.50 113.55 119.44 2rok h SER 459 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rok h SER 459 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2rok h SER 459 CO 0.00 0.00 0.03 0.00 -0.87 0.00 0.00 176.83 175.99 2rok h ALA 460 N 1.83 1.02 -0.23 5.18 0.00 -1.87 -2.71 119.26 122.48 2rok h ALA 460 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2rok h ALA 460 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2rok h ALA 460 CO -0.00 -0.02 0.00 1.19 0.00 0.00 0.00 179.25 180.42 2rok n PHE 461 N -2.37 0.28 0.00 0.00 3.72 -0.94 -5.01 117.46 113.14 2rok n PHE 461 Ca -0.02 -0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 2rok n PHE 461 Cb 0.07 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 2rok n PHE 461 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2rok n GLY 462 N 1.31 1.73 3.33 1.37 0.00 -1.02 -4.67 105.19 107.23 2rok n GLY 462 Ca 0.16 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 2rok n GLY 462 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2rok s ASN 463 N 0.00 -0.45 0.29 1.61 2.47 -1.26 -5.06 114.94 112.54 2rok s ASN 463 Ca 0.00 0.87 -0.03 0.00 0.42 0.00 0.00 52.86 54.12 2rok s ASN 463 Cb 0.00 0.88 -0.01 0.00 -1.45 0.00 0.00 41.25 40.67 2rok s ASN 463 CO 0.00 -0.16 0.37 0.27 -3.72 0.00 0.00 177.10 173.87 2rok s ILE 464 N 0.20 0.00 -0.00 -5.21 -4.36 -1.26 -3.41 121.20 107.16 2rok s ILE 464 Ca -0.00 -1.70 0.00 0.00 -0.26 0.00 0.00 60.65 58.69 2rok s ILE 464 Cb -0.03 -2.50 0.00 0.00 1.25 0.00 0.00 42.46 41.18 2rok s ILE 464 CO 0.01 0.00 0.00 -1.58 0.24 0.00 0.00 174.94 173.61 2rok s GLN 465 N -3.55 0.01 -0.10 0.37 -0.44 -0.76 -4.99 119.66 110.20 2rok s GLN 465 Ca 0.32 0.00 0.04 0.00 -2.50 0.00 0.00 55.36 53.22 2rok s GLN 465 Cb 0.02 -0.02 0.00 0.00 -1.64 0.00 0.00 33.01 31.37 2rok s GLN 465 CO 0.17 -0.01 -0.23 0.42 0.50 0.00 0.00 175.29 176.15 2rok s ILE 466 N 0.05 1.97 -0.31 -2.34 1.01 -1.26 -0.65 121.20 119.67 2rok s ILE 466 Ca -0.00 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 59.66 2rok s ILE 466 Cb -0.01 -1.71 0.10 0.00 0.01 0.00 0.00 42.46 40.86 2rok s ILE 466 CO -0.00 0.54 0.11 -0.44 0.00 0.00 0.00 174.94 175.15 2rok s SER 467 N 0.36 3.84 0.70 3.58 0.01 -0.44 -5.02 113.70 116.73 2rok s SER 467 Ca -0.18 -1.55 -0.16 0.00 1.31 0.00 0.00 55.95 55.36 2rok s SER 467 Cb -0.18 -0.69 0.00 0.00 0.21 0.00 0.00 66.02 65.37 2rok s SER 467 CO 0.08 -0.42 1.07 0.79 0.41 0.00 0.00 173.24 175.17 2rok n TRP 468 N 4.94 1.04 0.00 2.43 7.02 -1.26 -0.70 117.44 130.91 2rok n TRP 468 Ca -0.03 0.41 0.00 0.00 -1.02 0.00 0.00 57.50 56.86 2rok n TRP 468 Cb 0.42 -2.13 0.00 0.00 -2.42 0.00 0.00 31.31 27.17 2rok n TRP 468 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 2rok n ILE 469 N -2.36 0.00 -3.90 -0.99 -5.35 -1.13 -4.84 119.36 100.80 2rok n ILE 469 Ca 0.14 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.51 2rok n ILE 469 Cb 0.49 -0.11 0.01 0.00 -1.74 0.00 0.00 39.64 38.28 2rok n ILE 469 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2rok s ASP 470 N -1.17 0.35 0.25 7.28 1.47 -1.00 -5.03 116.67 118.82 2rok s ASP 470 Ca 0.00 -1.30 0.21 0.00 1.18 0.00 0.00 52.55 52.64 2rok s ASP 470 Cb 0.00 0.80 0.96 0.00 -0.34 0.00 0.00 42.92 44.34 2rok s ASP 470 CO 0.00 -1.58 1.63 0.47 0.68 0.00 0.00 175.17 176.37 2rok n ASP 471 N -1.48 0.54 0.00 2.11 8.00 -1.26 -3.30 116.55 121.16 2rok n ASP 471 Ca -0.05 0.68 0.00 0.00 0.71 0.00 0.00 54.79 56.12 2rok n ASP 471 Cb 0.60 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 2rok n ASP 471 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2rok n THR 472 N -2.15 0.24 -3.73 -3.53 -2.24 -1.26 -4.43 114.28 97.18 2rok n THR 472 Ca 0.01 -0.31 -0.13 0.00 -2.27 0.00 0.00 64.05 61.35 2rok n THR 472 Cb 0.14 1.10 -0.08 0.00 -2.10 0.00 0.00 70.33 69.40 2rok n THR 472 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2rok s SER 473 N -0.24 -0.22 0.13 3.42 1.04 -1.21 -1.59 113.70 115.03 2rok s SER 473 Ca 0.00 0.03 -0.18 0.00 0.48 0.00 0.00 55.95 56.28 2rok s SER 473 Cb 0.00 0.36 0.04 0.00 0.10 0.00 0.00 66.02 66.52 2rok s SER 473 CO 0.00 -0.54 0.46 0.00 0.98 0.00 0.00 173.24 174.14 2rok s ALA 474 N -1.85 -1.12 0.29 5.32 0.00 -0.78 -2.37 121.76 121.25 2rok s ALA 474 Ca -0.10 0.14 -0.09 0.00 0.00 0.00 0.00 51.96 51.91 2rok s ALA 474 Cb -0.03 0.71 -0.07 0.00 0.00 0.00 0.00 23.12 23.73 2rok s ALA 474 CO 0.01 -0.66 0.61 -0.06 0.00 0.00 0.00 175.76 175.67 2rok s PHE 475 N -3.65 3.45 -0.11 0.00 0.08 0.13 -0.79 117.98 117.09 2rok s PHE 475 Ca 0.02 0.87 -0.02 0.00 0.12 0.00 0.00 56.93 57.91 2rok s PHE 475 Cb 0.01 -2.27 0.04 0.00 -0.57 0.00 0.00 43.02 40.23 2rok s PHE 475 CO -0.11 0.14 0.04 0.08 -0.10 0.00 0.00 175.22 175.27 2rok s VAL 476 N -2.03 0.20 0.16 -0.44 1.01 -0.19 -1.32 120.40 117.79 2rok s VAL 476 Ca 0.48 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 62.23 2rok s VAL 476 Cb -0.11 -0.55 -0.08 0.00 0.00 0.00 0.00 36.38 35.65 2rok s VAL 476 CO 0.26 0.05 0.74 -0.55 0.00 0.00 0.00 175.10 175.60 2rok s SER 477 N 2.03 7.28 0.34 3.32 0.15 0.18 -0.80 113.70 126.20 2rok s SER 477 Ca 0.03 1.55 0.09 0.00 0.70 0.00 0.00 55.95 58.33 2rok s SER 477 Cb -0.14 -2.47 -0.06 0.00 -1.71 0.00 0.00 66.02 61.65 2rok s SER 477 CO -0.06 0.19 -0.03 -0.76 1.20 0.00 0.00 173.24 173.77 2rok s LEU 478 N -1.30 2.88 0.40 3.45 1.43 -0.36 -1.84 118.68 123.34 2rok s LEU 478 Ca 0.36 -1.09 0.09 0.00 -1.03 0.00 0.00 54.13 52.47 2rok s LEU 478 Cb -0.21 -1.20 0.84 0.00 0.03 0.00 0.00 46.19 45.65 2rok s LEU 478 CO 0.24 -0.23 1.97 -1.28 0.23 0.00 0.00 176.35 177.28 2rok h SER 479 N 1.89 0.27 -5.06 2.29 0.87 -1.82 -3.45 113.55 108.53 2rok h SER 479 Ca -0.42 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.03 2rok h SER 479 Cb 1.25 -0.07 -0.15 0.00 -0.44 0.00 0.00 62.40 62.99 2rok h SER 479 CO 0.69 0.34 -0.12 0.00 -0.53 0.00 0.00 176.83 177.21 2rok s GLN 480 N -4.93 0.97 0.46 2.24 -2.07 -1.26 -5.07 119.66 110.00 2rok s GLN 480 Ca -0.06 -0.56 0.20 0.00 -1.82 0.00 0.00 55.36 53.12 2rok s GLN 480 Cb 0.16 0.43 1.18 0.00 -1.09 0.00 0.00 33.01 33.68 2rok s GLN 480 CO 0.73 -0.35 1.91 -1.35 -1.32 0.00 0.00 175.29 174.90 2rok h PRO 481 N 2.74 0.28 -0.65 9.60 0.11 -1.87 -2.61 132.00 139.59 2rok h PRO 481 Ca -0.33 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.82 2rok h PRO 481 Cb 1.23 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 2rok h PRO 481 CO 0.46 0.19 0.43 1.49 -0.21 0.00 0.00 178.00 180.36 2rok h GLU 482 N 0.29 0.68 0.00 1.05 4.81 -1.98 -2.68 114.58 116.76 2rok h GLU 482 Ca 0.39 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.55 2rok h GLU 482 Cb 1.10 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 2rok h GLU 482 CO -0.10 0.45 -0.17 1.96 -0.73 0.00 0.00 179.01 180.42 2rok h GLN 483 N 0.70 0.00 -0.59 1.92 4.20 -1.87 -3.13 115.11 116.34 2rok h GLN 483 Ca 0.27 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.99 2rok h GLN 483 Cb 0.18 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 2rok h GLN 483 CO -0.08 0.17 0.38 0.28 -0.67 0.00 0.00 178.83 178.91 2rok h VAL 484 N 0.00 1.12 -0.29 -0.54 2.07 -1.62 -2.14 116.25 114.84 2rok h VAL 484 Ca -0.00 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 2rok h VAL 484 Cb 0.63 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2rok h VAL 484 CO 0.02 0.14 -0.19 1.56 0.02 0.00 0.00 177.57 179.13 2rok h GLN 485 N 0.77 0.53 -0.13 1.57 7.50 -1.70 -1.90 115.11 121.76 2rok h GLN 485 Ca 0.23 -0.18 -0.01 0.00 0.50 0.00 0.00 58.65 59.18 2rok h GLN 485 Cb -0.05 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.43 2rok h GLN 485 CO -0.07 0.69 0.02 0.82 -1.50 0.00 0.00 178.83 178.80 2rok h ILE 486 N 0.48 1.21 -0.65 2.54 2.04 -1.56 -0.99 117.51 120.59 2rok h ILE 486 Ca 0.08 -0.66 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 2rok h ILE 486 Cb 0.59 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 2rok h ILE 486 CO 0.04 0.20 0.18 0.00 0.00 0.00 0.00 178.15 178.56 2rok h ALA 487 N 0.81 1.10 -0.74 1.87 0.00 -1.28 -0.89 119.26 120.13 2rok h ALA 487 Ca 0.04 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2rok h ALA 487 Cb 0.28 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2rok h ALA 487 CO 0.00 0.61 0.24 0.28 0.00 0.00 0.00 179.25 180.38 2rok h VAL 488 N 0.96 1.26 -0.01 0.00 2.07 -1.29 -2.22 116.25 117.03 2rok h VAL 488 Ca 0.21 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2rok h VAL 488 Cb 0.31 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2rok h VAL 488 CO -0.00 0.36 0.00 -1.13 0.02 0.00 0.00 177.57 176.82 2rok h ASN 489 N 1.10 0.01 0.47 0.57 -0.73 -0.78 -3.22 115.58 113.01 2rok h ASN 489 Ca 0.24 -0.05 -0.05 0.00 1.87 0.00 0.00 56.30 58.30 2rok h ASN 489 Cb 0.30 -0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.88 2rok h ASN 489 CO -0.01 0.06 -0.26 0.71 -0.37 0.00 0.00 177.43 177.57 2rok h THR 490 N -0.04 0.89 0.00 -3.57 1.35 -1.06 -1.86 112.91 108.61 2rok h THR 490 Ca 0.00 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 2rok h THR 490 Cb 0.05 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 2rok h THR 490 CO -0.00 0.25 0.00 -1.28 -0.25 0.00 0.00 175.52 174.24 2rok h SER 491 N 0.00 0.00 0.07 5.36 0.87 -1.41 -2.59 113.55 115.86 2rok h SER 491 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2rok h SER 491 Cb 0.56 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 2rok h SER 491 CO 0.03 0.00 0.00 0.50 -0.53 0.00 0.00 176.83 176.83 2rok h LYS 492 N 0.00 0.00 -0.08 2.24 3.64 -1.41 -2.82 116.57 118.14 2rok h LYS 492 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2rok h LYS 492 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2rok h LYS 492 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 2rok n TYR 493 N -2.89 0.10 -1.30 1.91 4.01 -0.98 -5.06 117.16 112.95 2rok n TYR 493 Ca -0.02 -0.38 -0.32 0.00 -0.16 0.00 0.00 57.90 57.01 2rok n TYR 493 Cb 0.08 -0.03 0.10 0.00 -0.31 0.00 0.00 39.34 39.18 2rok n TYR 493 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2rok s ALA 494 N -0.83 2.08 0.00 -0.72 0.00 -1.06 -5.01 121.76 116.21 2rok s ALA 494 Ca 0.06 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.62 2rok s ALA 494 Cb 0.03 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2rok s ALA 494 CO 0.04 -1.93 0.00 0.39 0.00 0.00 0.00 175.76 174.27 2rok n GLU 495 N -3.18 2.53 0.00 0.00 1.02 -1.26 -4.90 120.64 114.84 2rok n GLU 495 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2rok n GLU 495 Cb 0.52 -0.26 0.00 0.00 -0.02 0.00 0.00 31.44 31.68 2rok n GLU 495 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2rok n SER 496 N -0.32 0.07 -3.25 1.62 7.64 -1.26 -5.12 113.62 113.00 2rok n SER 496 Ca 0.00 -1.03 -0.09 0.00 1.01 0.00 0.00 58.87 58.76 2rok n SER 496 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2rok n SER 496 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 2rok s TYR 497 N -0.03 0.12 -0.04 1.43 1.13 -1.26 -4.35 117.35 114.35 2rok s TYR 497 Ca 0.00 -0.69 -0.10 0.00 -1.41 0.00 0.00 57.07 54.86 2rok s TYR 497 Cb 0.00 0.70 0.02 0.00 -1.10 0.00 0.00 41.96 41.58 2rok s TYR 497 CO 0.00 -1.42 0.24 0.50 -2.51 0.00 0.00 175.55 172.36 2rok s ARG 498 N -2.88 0.47 0.01 -3.49 3.52 -0.28 -4.83 118.95 111.46 2rok s ARG 498 Ca 0.16 -0.02 0.04 0.00 -0.13 0.00 0.00 55.73 55.78 2rok s ARG 498 Cb -0.05 0.21 -0.01 0.00 -1.56 0.00 0.00 34.95 33.54 2rok s ARG 498 CO 0.11 -0.10 -0.12 0.42 -0.81 0.00 0.00 175.30 174.79 2rok s ILE 499 N -0.73 0.98 0.17 4.11 1.01 -1.26 -1.14 121.20 124.34 2rok s ILE 499 Ca -0.08 -0.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.84 2rok s ILE 499 Cb -0.04 -0.84 -0.02 0.00 0.01 0.00 0.00 42.46 41.56 2rok s ILE 499 CO 0.02 0.17 0.23 0.00 0.00 0.00 0.00 174.94 175.36 2rok s GLN 500 N -0.57 1.16 0.82 2.79 -2.07 -0.13 -4.88 119.66 116.78 2rok s GLN 500 Ca 0.03 -1.32 -0.11 0.00 -1.82 0.00 0.00 55.36 52.14 2rok s GLN 500 Cb -0.06 0.34 0.08 0.00 -1.09 0.00 0.00 33.01 32.29 2rok s GLN 500 CO 0.00 -0.41 1.09 0.95 -1.32 0.00 0.00 175.29 175.60 2rok s THR 501 N -4.02 3.07 0.34 3.63 -4.23 -1.26 -0.55 115.64 112.62 2rok s THR 501 Ca 0.23 0.35 0.03 0.00 -1.18 0.00 0.00 61.69 61.11 2rok s THR 501 Cb 0.04 -2.93 0.28 0.00 1.34 0.00 0.00 72.50 71.23 2rok s THR 501 CO 0.03 -0.46 1.97 0.22 -0.54 0.00 0.00 174.62 175.85 2rok h TYR 502 N -1.24 0.87 -0.66 3.99 5.03 -1.75 -1.76 116.97 121.44 2rok h TYR 502 Ca -0.47 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 60.80 2rok h TYR 502 Cb 1.26 -0.29 -0.03 0.00 1.55 0.00 0.00 36.73 39.22 2rok h TYR 502 CO 0.49 0.50 0.16 0.00 -1.32 0.00 0.00 178.16 177.99 2rok h ALA 503 N 1.57 0.88 -0.18 1.82 0.00 -1.90 -0.96 119.26 120.49 2rok h ALA 503 Ca 0.30 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2rok h ALA 503 Cb 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2rok h ALA 503 CO -0.09 0.60 -0.17 0.93 0.00 0.00 0.00 179.25 180.52 2rok h GLU 504 N 0.99 0.30 0.06 0.00 4.39 -1.84 -1.20 114.58 117.29 2rok h GLU 504 Ca 0.21 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 2rok h GLU 504 Cb 0.37 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 2rok h GLU 504 CO 0.00 0.47 -0.03 -0.92 -1.16 0.00 0.00 179.01 177.38 2rok h TYR 505 N 0.28 -0.07 -0.73 4.33 3.20 -1.07 -3.26 116.97 119.65 2rok h TYR 505 Ca 0.05 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.03 2rok h TYR 505 Cb 0.47 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.69 2rok h TYR 505 CO 0.01 0.25 0.34 0.28 -1.64 0.00 0.00 178.16 177.40 2rok h VAL 506 N -0.40 0.78 0.00 1.81 2.07 -0.98 0.24 116.25 119.77 2rok h VAL 506 Ca -0.01 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2rok h VAL 506 Cb 0.36 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2rok h VAL 506 CO 0.01 0.10 0.00 0.61 0.02 0.00 0.00 177.57 178.31 2rok n GLY 507 N -1.31 -0.69 0.02 2.17 0.00 -0.47 -1.87 105.19 103.05 2rok n GLY 507 Ca 0.12 -0.06 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 2rok n GLY 507 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rok n LYS 508 N -1.29 2.88 0.03 1.61 5.02 -0.59 -4.63 118.16 121.19 2rok n LYS 508 Ca 0.06 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.39 2rok n LYS 508 Cb 0.10 -1.12 0.44 0.00 -0.02 0.00 0.00 35.03 34.42 2rok n LYS 508 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2rok h LYS 509 N 0.00 0.48 -4.20 1.97 3.11 -0.78 -3.41 116.57 113.73 2rok h LYS 509 Ca -0.13 -0.03 -0.39 0.00 -2.81 0.00 0.00 60.65 57.28 2rok h LYS 509 Cb 1.29 -0.11 -0.32 0.00 -1.00 0.00 0.00 32.23 32.09 2rok h LYS 509 CO 0.00 0.33 -0.77 -1.14 -2.81 0.00 0.00 179.45 175.06 2rok s GLN 510 N -5.42 0.75 -0.02 1.90 0.74 -0.78 -5.05 119.66 111.78 2rok s GLN 510 Ca -0.08 -0.16 0.03 0.00 0.05 0.00 0.00 55.36 55.20 2rok s GLN 510 Cb 0.17 -0.75 0.04 0.00 1.10 0.00 0.00 33.01 33.58 2rok s GLN 510 CO 0.73 0.00 1.01 1.63 -0.55 0.00 0.00 175.29 178.11 2rok n LYS 511 N 3.64 0.20 -3.83 1.67 5.02 -1.26 -4.51 118.16 119.09 2rok n LYS 511 Ca -0.21 -1.22 -0.04 0.00 -2.02 0.00 0.00 58.31 54.81 2rok n LYS 511 Cb 0.53 -0.65 0.01 0.00 -0.02 0.00 0.00 35.03 34.90 2rok n LYS 511 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2rok s GLY 512 N -1.25 0.04 0.00 0.72 0.00 -1.26 -5.10 107.32 100.46 2rok s GLY 512 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.50 2rok s GLY 512 CO 0.00 0.99 0.00 1.17 0.00 0.00 0.00 173.10 175.26 2rok n LYS 513 N -0.58 0.00 0.00 2.90 4.81 -1.26 -4.95 118.16 119.08 2rok n LYS 513 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 2rok n LYS 513 Cb 0.60 -0.33 0.00 0.00 0.02 0.00 0.00 35.03 35.31 2rok n LYS 513 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2rok n GLN 514 N -1.02 0.87 0.31 1.64 -0.06 -1.26 -4.41 117.38 113.45 2rok n GLN 514 Ca 0.00 0.00 0.20 0.00 -2.00 0.00 0.00 57.00 55.20 2rok n GLN 514 Cb 0.00 -1.08 0.97 0.00 -4.06 0.00 0.00 30.24 26.07 2rok n GLN 514 CO 0.00 0.00 0.00 -0.39 -0.20 0.00 0.00 177.06 176.47 2rok h VAL 515 N 0.13 0.05 -1.89 1.69 -1.51 -2.05 -3.37 116.25 109.30 2rok h VAL 515 Ca 0.00 -0.25 -0.31 0.00 -1.23 0.00 0.00 66.70 64.92 2rok h VAL 515 Cb 0.86 1.23 -0.30 0.00 -2.13 0.00 0.00 31.29 30.94 2rok h VAL 515 CO 0.00 0.01 -0.63 -0.75 -1.23 0.00 0.00 177.57 174.97 2rok s LYS 516 N -3.97 0.54 0.93 5.19 2.47 -1.26 -5.16 119.74 118.48 2rok s LYS 516 Ca -0.02 -0.49 -0.11 0.00 -1.56 0.00 0.00 55.97 53.79 2rok s LYS 516 Cb 0.11 -0.58 0.15 0.00 -1.46 0.00 0.00 37.83 36.05 2rok s LYS 516 CO 0.48 -1.13 1.12 -1.12 0.16 0.00 0.00 175.35 174.86 2rok s SER 517 N 1.86 2.88 0.00 1.43 0.01 -1.26 -5.05 113.70 113.56 2rok s SER 517 Ca 0.14 2.01 0.00 0.00 1.31 0.00 0.00 55.95 59.41 2rok s SER 517 Cb -0.14 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2rok s SER 517 CO -0.15 -3.10 0.00 0.61 0.41 0.00 0.00 173.24 171.01 2rok n GLY 518 N 0.03 0.59 0.30 3.44 0.00 -1.26 -5.01 105.19 103.27 2rok n GLY 518 Ca 0.10 -0.75 0.20 0.00 0.00 0.00 0.00 46.02 45.57 2rok n GLY 518 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rok h PRO 519 N 0.00 0.00 0.00 1.61 0.13 -1.97 -1.11 132.00 130.66 2rok h PRO 519 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2rok h PRO 519 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2rok h PRO 519 CO 0.00 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.64 2rok n SER 520 N -2.99 0.00 0.00 1.44 3.41 -1.26 -2.85 113.62 111.37 2rok n SER 520 Ca -0.02 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2rok n SER 520 Cb 0.14 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 2rok n SER 520 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2rok n SER 521 N -1.45 1.35 0.00 4.04 7.64 -0.42 -5.20 113.62 119.58 2rok n SER 521 Ca 0.02 -1.66 0.00 0.00 1.01 0.00 0.00 58.87 58.24 2rok n SER 521 Cb 0.08 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 2rok n SER 521 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64