#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 0.00 -4.17 1.61 7.64 -1.26 -5.13 113.62 112.30 2rok n SER 424 Ca 0.00 -0.76 -0.14 0.00 1.01 0.00 0.00 58.87 58.98 2rok n SER 424 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 2rok n SER 424 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2rok s SER 425 N 0.00 0.62 0.00 6.43 0.01 -1.26 -5.04 113.70 114.46 2rok s SER 425 Ca 0.00 -1.42 0.00 0.00 1.31 0.00 0.00 55.95 55.84 2rok s SER 425 Cb 0.00 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.56 2rok s SER 425 CO 0.00 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.44 2rok n GLY 426 N -0.37 0.08 0.02 3.44 0.00 -1.26 -5.01 105.19 102.09 2rok n GLY 426 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2rok n GLY 426 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rok n SER 427 N 0.00 0.13 -4.68 1.61 3.41 -1.26 -4.89 113.62 107.94 2rok n SER 427 Ca 0.00 0.53 -0.32 0.00 -0.26 0.00 0.00 58.87 58.81 2rok n SER 427 Cb 0.00 -0.56 0.14 0.00 -0.26 0.00 0.00 64.21 63.54 2rok n SER 427 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2rok n SER 428 N -1.64 0.69 0.00 4.04 7.64 -1.26 -4.84 113.62 118.25 2rok n SER 428 Ca 0.04 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.43 2rok n SER 428 Cb 0.21 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 61.92 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 0.46 -0.50 3.71 0.23 0.00 -1.26 -5.03 105.19 102.80 2rok n GLY 429 Ca 0.13 -1.11 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 2rok n GLY 429 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2rok s GLY 430 N -0.31 0.41 0.56 -0.02 0.00 -1.26 -5.18 107.32 101.52 2rok s GLY 430 Ca 0.00 -0.74 -0.18 0.00 0.00 0.00 0.00 44.72 43.80 2rok s GLY 430 CO 0.00 -0.43 1.09 2.56 0.00 0.00 0.00 173.10 176.32 2rok s PRO 431 N -3.49 3.36 0.22 2.90 0.04 -1.26 -5.08 135.00 131.69 2rok s PRO 431 Ca 0.18 1.42 -0.17 0.00 0.04 0.00 0.00 61.00 62.47 2rok s PRO 431 Cb -0.03 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.50 2rok s PRO 431 CO 0.10 -0.81 0.53 0.34 0.04 0.00 0.00 177.00 177.21 2rok s ASP 432 N -2.20 -0.20 -0.05 6.66 2.15 -1.26 -5.11 116.67 116.66 2rok s ASP 432 Ca 0.68 -0.63 0.07 0.00 0.43 0.00 0.00 52.55 53.10 2rok s ASP 432 Cb -0.20 0.60 0.11 0.00 -0.30 0.00 0.00 42.92 43.13 2rok s ASP 432 CO 0.30 -1.12 0.98 0.18 -0.17 0.00 0.00 175.17 175.34 2rok n LEU 433 N -0.37 1.41 -4.06 -1.34 4.77 -1.26 -5.07 117.00 111.09 2rok n LEU 433 Ca -0.07 -1.90 -0.16 0.00 -0.03 0.00 0.00 56.01 53.86 2rok n LEU 433 Cb 0.62 -0.16 -0.13 0.00 -2.33 0.00 0.00 43.42 41.42 2rok n LEU 433 CO 0.18 0.45 -0.42 -1.10 -1.33 0.00 0.00 177.39 175.18 2rok s GLN 434 N -1.34 0.61 0.47 3.23 -0.21 -1.26 -5.15 119.66 116.00 2rok s GLN 434 Ca 0.12 -0.61 -0.22 0.00 0.02 0.00 0.00 55.36 54.67 2rok s GLN 434 Cb 0.10 -0.50 -0.08 0.00 1.00 0.00 0.00 33.01 33.53 2rok s GLN 434 CO 0.01 0.12 1.10 -1.25 -2.12 0.00 0.00 175.29 173.14 2rok s PRO 435 N -1.09 3.79 -0.04 2.91 0.04 -1.26 -5.00 135.00 134.36 2rok s PRO 435 Ca -0.04 1.57 0.25 0.00 0.04 0.00 0.00 61.00 62.82 2rok s PRO 435 Cb -0.07 -2.28 0.43 0.00 0.04 0.00 0.00 34.50 32.62 2rok s PRO 435 CO 0.01 -0.48 1.16 1.63 0.04 0.00 0.00 177.00 179.36 2rok n LYS 436 N -0.67 0.23 -3.77 4.56 5.02 -1.26 -5.06 118.16 117.21 2rok n LYS 436 Ca 0.08 -2.18 -0.27 0.00 -2.02 0.00 0.00 58.31 53.92 2rok n LYS 436 Cb 0.50 -0.20 -0.17 0.00 -0.02 0.00 0.00 35.03 35.14 2rok n LYS 436 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2rok s ARG 437 N -0.50 0.79 0.00 1.97 1.04 -1.26 -4.89 118.95 116.10 2rok s ARG 437 Ca 0.32 -0.36 0.00 0.00 -1.04 0.00 0.00 55.73 54.65 2rok s ARG 437 Cb 0.37 -1.92 0.00 0.00 -2.04 0.00 0.00 34.95 31.37 2rok s ARG 437 CO -0.15 -0.55 0.00 -3.47 -0.04 0.00 0.00 175.30 171.09 2rok n ASP 438 N 5.03 0.00 -1.61 -2.89 2.03 -1.26 -4.93 116.55 112.92 2rok n ASP 438 Ca -0.09 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.22 2rok n ASP 438 Cb 0.48 0.12 0.00 0.00 -0.72 0.00 0.00 41.12 41.00 2rok n ASP 438 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2rok n HIS 439 N -1.81 0.00 -4.36 -0.67 1.44 -1.26 -4.83 115.22 103.73 2rok n HIS 439 Ca 0.00 -0.47 -0.26 0.00 -2.01 0.00 0.00 57.72 54.98 2rok n HIS 439 Cb 0.00 -0.34 -0.17 0.00 0.12 0.00 0.00 29.99 29.60 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 0.89 1.20 0.53 0.61 1.01 -1.26 -1.09 120.40 122.29 2rok s VAL 440 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2rok s VAL 440 Cb 0.00 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 35.28 2rok s VAL 440 CO 0.00 0.38 0.76 -0.76 0.00 0.00 0.00 175.10 175.48 2rok s LEU 441 N 1.03 3.35 -0.03 3.92 1.43 0.10 -1.48 118.68 127.00 2rok s LEU 441 Ca -0.07 0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 2rok s LEU 441 Cb -0.15 -2.98 -0.00 0.00 0.03 0.00 0.00 46.19 43.09 2rok s LEU 441 CO -0.01 -1.04 -0.14 -2.28 0.23 0.00 0.00 176.35 173.10 2rok s HIS 442 N -2.74 1.43 -0.02 0.29 5.65 0.50 -1.10 115.29 119.30 2rok s HIS 442 Ca 0.55 -0.38 0.02 0.00 0.25 0.00 0.00 55.06 55.51 2rok s HIS 442 Cb -0.10 -0.97 0.00 0.00 -1.18 0.00 0.00 32.58 30.33 2rok s HIS 442 CO 0.39 -0.12 -0.08 0.08 -0.65 0.00 0.00 174.74 174.35 2rok s VAL 443 N 0.02 0.73 -0.04 0.89 1.01 -0.06 -1.24 120.40 121.70 2rok s VAL 443 Ca -0.02 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.68 2rok s VAL 443 Cb -0.10 -0.65 -0.01 0.00 0.00 0.00 0.00 36.38 35.63 2rok s VAL 443 CO 0.01 0.23 -0.19 -0.89 0.00 0.00 0.00 175.10 174.26 2rok s THR 444 N 0.19 1.55 0.08 3.92 2.01 -0.38 -1.61 115.64 121.40 2rok s THR 444 Ca -0.03 -0.79 -0.21 0.00 0.31 0.00 0.00 61.69 60.97 2rok s THR 444 Cb -0.08 -1.33 0.05 0.00 0.01 0.00 0.00 72.50 71.15 2rok s THR 444 CO 0.00 0.44 0.50 0.72 -0.69 0.00 0.00 174.62 175.60 2rok s PHE 445 N -0.02 -0.39 0.64 4.92 -0.12 -0.59 -1.50 117.98 120.91 2rok s PHE 445 Ca -0.03 0.33 -0.17 0.00 -0.05 0.00 0.00 56.93 57.00 2rok s PHE 445 Cb -0.12 0.35 -0.04 0.00 -0.63 0.00 0.00 43.02 42.58 2rok s PHE 445 CO 0.02 -0.68 0.86 -2.30 -0.05 0.00 0.00 175.22 173.07 2rok n PRO 446 N 0.18 0.69 0.28 1.99 -0.02 -1.26 -4.58 135.00 132.27 2rok n PRO 446 Ca -0.18 0.28 0.18 0.00 -2.02 0.00 0.00 63.50 61.76 2rok n PRO 446 Cb 0.62 -2.08 0.93 0.00 -0.02 0.00 0.00 33.50 32.94 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 0.18 0.00 0.00 -0.52 2.10 -1.93 -1.90 116.57 114.51 2rok h LYS 447 Ca -0.48 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.16 2rok h LYS 447 Cb 1.36 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.69 2rok h LYS 447 CO 0.48 0.00 -0.08 0.93 -2.00 0.00 0.00 179.45 178.78 2rok h GLU 448 N 0.00 0.00 -7.09 0.07 4.39 -1.90 -3.45 114.58 106.59 2rok h GLU 448 Ca 0.04 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.23 2rok h GLU 448 Cb 0.46 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.19 2rok h GLU 448 CO -0.00 0.08 0.44 -1.58 -1.16 0.00 0.00 179.01 176.79 2rok s TRP 449 N -4.64 2.59 0.31 4.33 0.52 -0.72 -5.08 118.94 116.25 2rok s TRP 449 Ca -0.04 1.54 0.03 0.00 0.02 0.00 0.00 56.10 57.65 2rok s TRP 449 Cb 0.15 -3.34 -0.04 0.00 -1.15 0.00 0.00 33.47 29.10 2rok s TRP 449 CO 0.63 -1.75 0.15 0.15 0.02 0.00 0.00 176.95 176.15 2rok s LYS 450 N -3.33 1.61 0.40 4.98 1.02 -1.26 -5.03 119.74 118.14 2rok s LYS 450 Ca 0.74 -1.92 0.19 0.00 0.02 0.00 0.00 55.97 55.00 2rok s LYS 450 Cb -0.25 -0.17 1.13 0.00 -0.52 0.00 0.00 37.83 38.02 2rok s LYS 450 CO 0.29 -0.44 1.76 1.15 -0.92 0.00 0.00 175.35 177.19 2rok h THR 451 N 2.19 0.49 -0.33 2.17 2.02 -1.99 -1.25 112.91 116.21 2rok h THR 451 Ca -0.34 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 2rok h THR 451 Cb 1.25 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 2rok h THR 451 CO 0.53 0.07 0.08 0.28 0.37 0.00 0.00 175.52 176.85 2rok h SER 452 N 0.36 0.51 0.09 4.18 0.02 -1.99 -0.88 113.55 115.84 2rok h SER 452 Ca 0.61 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 61.29 2rok h SER 452 Cb 1.60 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 64.00 2rok h SER 452 CO -0.31 0.61 -0.13 0.44 -1.14 0.00 0.00 176.83 176.30 2rok h ASP 453 N 0.38 0.10 -0.10 3.07 3.32 -1.65 -1.24 116.42 120.30 2rok h ASP 453 Ca 0.10 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 2rok h ASP 453 Cb 0.30 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2rok h ASP 453 CO 0.00 0.25 -0.18 -0.07 -1.72 0.00 0.00 179.24 177.53 2rok h LEU 454 N 0.11 0.34 -1.70 1.55 3.38 -1.15 -0.63 115.31 117.19 2rok h LEU 454 Ca 0.02 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.43 2rok h LEU 454 Cb 0.30 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2rok h LEU 454 CO 0.02 0.81 -0.04 1.88 0.09 0.00 0.00 178.44 181.21 2rok h TYR 455 N -0.13 0.14 -0.10 1.13 0.05 -0.93 -2.11 116.97 115.02 2rok h TYR 455 Ca 0.01 -0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.61 2rok h TYR 455 Cb 0.75 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.44 2rok h TYR 455 CO 0.10 0.18 -0.66 1.96 -1.05 0.00 0.00 178.16 178.69 2rok h GLN 456 N 0.14 0.39 -0.04 4.88 1.08 -1.17 -1.87 115.11 118.51 2rok h GLN 456 Ca 0.03 -0.29 -0.05 0.00 -1.45 0.00 0.00 58.65 56.89 2rok h GLN 456 Cb 0.16 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2rok h GLN 456 CO 0.01 0.92 -0.20 1.25 -0.95 0.00 0.00 178.83 179.85 2rok h LEU 457 N 0.28 0.07 -3.15 1.46 5.85 -0.60 -3.25 115.31 115.97 2rok h LEU 457 Ca -0.02 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 2rok h LEU 457 Cb 1.21 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 2rok h LEU 457 CO 0.11 0.27 -0.07 0.49 -0.34 0.00 0.00 178.44 178.90 2rok n PHE 458 N -4.27 0.52 0.32 1.25 3.72 -0.84 -4.68 117.46 113.48 2rok n PHE 458 Ca -0.02 -1.13 0.20 0.00 -0.05 0.00 0.00 57.45 56.45 2rok n PHE 458 Cb 0.28 -0.28 1.09 0.00 -0.94 0.00 0.00 39.48 39.63 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 0.91 0.00 0.17 4.37 4.64 -1.37 -0.63 113.55 121.64 2rok h SER 459 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2rok h SER 459 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2rok h SER 459 CO 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.11 2rok h ALA 460 N 1.92 1.00 0.00 5.18 0.00 -1.87 -3.25 119.26 122.23 2rok h ALA 460 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2rok h ALA 460 Cb 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2rok h ALA 460 CO -0.00 0.00 -1.36 1.19 0.00 0.00 0.00 179.25 179.08 2rok n PHE 461 N -2.95 0.00 -0.93 0.00 3.72 -0.37 -5.05 117.46 111.87 2rok n PHE 461 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2rok n PHE 461 Cb 0.10 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 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 3.16 0.16 0.38 1.37 0.00 -0.44 -4.72 105.19 105.10 2rok n GLY 462 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2rok n GLY 462 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rok n ASN 463 N -0.58 0.00 -4.40 1.61 5.15 -1.26 -5.06 115.26 110.71 2rok n ASN 463 Ca 0.00 -1.64 -0.29 0.00 -0.60 0.00 0.00 54.58 52.05 2rok n ASN 463 Cb 0.29 -0.13 0.23 0.00 -0.53 0.00 0.00 39.78 39.65 2rok n ASN 463 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2rok s ILE 464 N 0.00 1.90 0.02 -1.44 -4.36 -1.26 -4.68 121.20 111.37 2rok s ILE 464 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 60.65 60.42 2rok s ILE 464 Cb 0.00 -2.24 -0.01 0.00 1.25 0.00 0.00 42.46 41.46 2rok s ILE 464 CO 0.00 0.00 -0.08 -1.58 0.24 0.00 0.00 174.94 173.52 2rok s GLN 465 N -4.76 0.59 -0.06 0.37 0.74 -0.67 -5.01 119.66 110.86 2rok s GLN 465 Ca 0.68 -0.48 0.05 0.00 0.05 0.00 0.00 55.36 55.66 2rok s GLN 465 Cb -0.21 -0.51 -0.01 0.00 1.10 0.00 0.00 33.01 33.39 2rok s GLN 465 CO 0.61 0.13 -0.23 0.42 -0.55 0.00 0.00 175.29 175.67 2rok s ILE 466 N -0.65 1.89 -0.33 -2.34 1.01 -1.26 -0.75 121.20 118.76 2rok s ILE 466 Ca -0.02 -0.96 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 2rok s ILE 466 Cb -0.06 -1.61 0.11 0.00 0.01 0.00 0.00 42.46 40.91 2rok s ILE 466 CO 0.00 0.53 0.14 -0.44 0.00 0.00 0.00 174.94 175.17 2rok s SER 467 N 0.02 3.70 0.88 3.58 0.01 -0.23 -5.02 113.70 116.63 2rok s SER 467 Ca -0.07 -1.78 -0.12 0.00 1.31 0.00 0.00 55.95 55.29 2rok s SER 467 Cb -0.14 -0.69 0.09 0.00 0.21 0.00 0.00 66.02 65.49 2rok s SER 467 CO 0.04 -0.38 0.98 0.79 0.41 0.00 0.00 173.24 175.08 2rok n TRP 468 N 4.64 0.41 0.00 2.43 7.02 -1.26 -0.79 117.44 129.89 2rok n TRP 468 Ca 0.01 0.36 0.00 0.00 -1.02 0.00 0.00 57.50 56.85 2rok n TRP 468 Cb 0.40 -1.98 0.00 0.00 -2.42 0.00 0.00 31.31 27.31 2rok n TRP 468 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2rok n ILE 469 N -3.71 0.00 -3.85 -0.99 5.41 -1.05 -4.76 119.36 110.40 2rok n ILE 469 Ca 0.11 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 63.76 2rok n ILE 469 Cb 0.52 -0.38 0.00 0.00 -0.71 0.00 0.00 39.64 39.07 2rok n ILE 469 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2rok n ASP 470 N -2.10 -1.75 0.21 4.38 5.75 -0.89 -5.01 116.55 117.13 2rok n ASP 470 Ca 0.00 -2.59 0.14 0.00 -0.01 0.00 0.00 54.79 52.33 2rok n ASP 470 Cb 0.18 3.03 0.74 0.00 -1.03 0.00 0.00 41.12 44.04 2rok n ASP 470 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 2rok h ASP 471 N 1.83 0.00 0.00 -1.12 3.58 -2.00 -3.15 116.42 115.56 2rok h ASP 471 Ca -0.28 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.17 2rok h ASP 471 Cb 1.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.17 2rok h ASP 471 CO 0.37 0.00 0.00 0.35 -2.88 0.00 0.00 179.24 177.08 2rok n THR 472 N -2.46 0.12 -3.70 2.25 -2.24 -1.26 -4.49 114.28 102.49 2rok n THR 472 Ca -0.02 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 2rok n THR 472 Cb 0.06 1.37 -0.07 0.00 -2.10 0.00 0.00 70.33 69.59 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 -0.12 -0.23 0.05 3.42 1.04 -1.19 -1.55 113.70 115.12 2rok s SER 473 Ca 0.00 -0.03 -0.15 0.00 0.48 0.00 0.00 55.95 56.25 2rok s SER 473 Cb 0.00 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.53 2rok s SER 473 CO 0.00 -0.62 0.33 0.00 0.98 0.00 0.00 173.24 173.94 2rok s ALA 474 N -2.31 -0.77 0.22 5.32 0.00 -0.64 -2.09 121.76 121.50 2rok s ALA 474 Ca -0.06 0.08 -0.13 0.00 0.00 0.00 0.00 51.96 51.85 2rok s ALA 474 Cb -0.01 0.34 -0.07 0.00 0.00 0.00 0.00 23.12 23.37 2rok s ALA 474 CO -0.01 -0.43 0.59 -0.06 0.00 0.00 0.00 175.76 175.85 2rok s PHE 475 N -2.58 3.48 -0.16 0.00 0.08 0.03 -0.89 117.98 117.95 2rok s PHE 475 Ca -0.05 1.02 -0.04 0.00 0.12 0.00 0.00 56.93 57.98 2rok s PHE 475 Cb -0.01 -2.36 0.06 0.00 -0.57 0.00 0.00 43.02 40.14 2rok s PHE 475 CO -0.03 0.29 0.07 0.08 -0.10 0.00 0.00 175.22 175.53 2rok s VAL 476 N -1.72 0.06 0.24 -0.44 1.01 -0.26 -1.07 120.40 118.23 2rok s VAL 476 Ca 0.45 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 2rok s VAL 476 Cb -0.12 -0.64 -0.09 0.00 0.00 0.00 0.00 36.38 35.53 2rok s VAL 476 CO 0.20 -0.20 1.02 -0.44 0.00 0.00 0.00 175.10 175.67 2rok s SER 477 N 2.07 7.46 0.43 3.32 0.01 0.07 -0.72 113.70 126.34 2rok s SER 477 Ca 0.02 2.08 0.07 0.00 1.31 0.00 0.00 55.95 59.43 2rok s SER 477 Cb -0.16 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.43 2rok s SER 477 CO -0.08 0.00 0.28 -0.76 0.41 0.00 0.00 173.24 173.09 2rok s LEU 478 N -1.17 3.18 0.28 2.44 1.43 -0.25 -1.67 118.68 122.94 2rok s LEU 478 Ca 0.43 -0.97 0.15 0.00 -1.03 0.00 0.00 54.13 52.71 2rok s LEU 478 Cb -0.28 -1.66 0.18 0.00 0.03 0.00 0.00 46.19 44.46 2rok s LEU 478 CO 0.36 -0.64 1.49 0.28 0.23 0.00 0.00 176.35 178.07 2rok h SER 479 N 1.21 0.00 -4.84 2.29 0.02 -1.86 -3.46 113.55 106.91 2rok h SER 479 Ca -0.42 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.38 2rok h SER 479 Cb 1.26 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.59 2rok h SER 479 CO 0.64 0.54 -0.48 -1.10 -1.14 0.00 0.00 176.83 175.29 2rok s GLN 480 N -3.09 0.46 0.54 3.45 -0.21 -1.26 -5.05 119.66 114.49 2rok s GLN 480 Ca 0.03 -0.31 0.25 0.00 0.02 0.00 0.00 55.36 55.34 2rok s GLN 480 Cb 0.09 0.19 1.41 0.00 1.00 0.00 0.00 33.01 35.70 2rok s GLN 480 CO 0.74 -0.11 2.01 -1.35 -2.12 0.00 0.00 175.29 174.46 2rok h PRO 481 N 4.45 0.00 -0.63 2.91 0.11 -1.89 -2.46 132.00 134.49 2rok h PRO 481 Ca -0.30 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.82 2rok h PRO 481 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2rok h PRO 481 CO 0.40 0.00 0.42 1.49 -0.21 0.00 0.00 178.00 180.10 2rok h GLU 482 N 0.00 0.81 0.00 1.05 4.81 -1.99 -2.86 114.58 116.41 2rok h GLU 482 Ca 0.22 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2rok h GLU 482 Cb 0.92 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 2rok h GLU 482 CO -0.00 0.54 -0.03 1.96 -0.73 0.00 0.00 179.01 180.74 2rok h GLN 483 N 0.84 0.00 -0.55 1.92 4.20 -1.86 -2.94 115.11 116.71 2rok h GLN 483 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 2rok h GLN 483 Cb -0.08 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 2rok h GLN 483 CO -0.05 0.03 0.35 0.28 -0.67 0.00 0.00 178.83 178.77 2rok h VAL 484 N 0.00 1.15 -0.27 -0.54 2.07 -1.65 -1.98 116.25 115.03 2rok h VAL 484 Ca -0.00 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.10 2rok h VAL 484 Cb 0.39 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2rok h VAL 484 CO 0.00 0.15 -0.29 1.56 0.02 0.00 0.00 177.57 179.02 2rok h GLN 485 N 0.74 0.55 -0.15 1.57 7.50 -1.69 -2.39 115.11 121.23 2rok h GLN 485 Ca 0.20 -0.23 -0.00 0.00 0.50 0.00 0.00 58.65 59.11 2rok h GLN 485 Cb -0.05 -0.02 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 2rok h GLN 485 CO -0.04 0.78 0.08 0.82 -1.50 0.00 0.00 178.83 178.98 2rok h ILE 486 N 0.48 1.10 -0.41 2.54 2.04 -1.53 -0.79 117.51 120.95 2rok h ILE 486 Ca 0.06 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.57 2rok h ILE 486 Cb 0.75 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2rok h ILE 486 CO 0.06 0.10 -0.02 0.00 0.00 0.00 0.00 178.15 178.29 2rok h ALA 487 N 0.97 1.21 -0.54 1.87 0.00 -1.26 -1.75 119.26 119.75 2rok h ALA 487 Ca 0.05 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 2rok h ALA 487 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2rok h ALA 487 CO -0.01 0.52 0.03 0.28 0.00 0.00 0.00 179.25 180.07 2rok h VAL 488 N 0.62 1.26 -0.20 0.00 2.07 -1.31 -1.63 116.25 117.07 2rok h VAL 488 Ca 0.12 -1.07 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 2rok h VAL 488 Cb 0.42 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2rok h VAL 488 CO 0.02 0.38 0.00 -1.13 0.02 0.00 0.00 177.57 176.86 2rok h ASN 489 N 0.82 0.26 0.86 0.57 -1.24 -0.68 -2.96 115.58 113.21 2rok h ASN 489 Ca 0.16 -0.03 -0.20 0.00 0.71 0.00 0.00 56.30 56.94 2rok h ASN 489 Cb 0.50 -0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.45 2rok h ASN 489 CO 0.02 0.31 -1.23 0.71 -1.29 0.00 0.00 177.43 175.95 2rok h THR 490 N 0.28 0.89 0.00 -3.57 1.35 -1.25 -3.36 112.91 107.26 2rok h THR 490 Ca 0.07 -2.49 -0.04 0.00 -0.55 0.00 0.00 66.41 63.39 2rok h THR 490 Cb 0.19 2.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.97 2rok h THR 490 CO 0.00 0.51 -0.19 -1.28 -0.25 0.00 0.00 175.52 174.31 2rok h SER 491 N 0.00 0.00 0.07 5.36 0.87 -1.12 -3.26 113.55 115.46 2rok h SER 491 Ca -0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 2rok h SER 491 Cb 1.69 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.65 2rok h SER 491 CO 0.07 0.19 0.00 0.07 -0.53 0.00 0.00 176.83 176.64 2rok h LYS 492 N 0.00 0.00 0.00 2.24 2.10 -1.70 -1.41 116.57 117.79 2rok h LYS 492 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2rok h LYS 492 Cb 0.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 2rok h LYS 492 CO 0.03 0.00 -0.53 0.66 -2.00 0.00 0.00 179.45 177.61 2rok n TYR 493 N -2.97 0.03 -1.96 0.07 4.01 -1.23 -5.00 117.16 110.11 2rok n TYR 493 Ca -0.03 0.01 -0.34 0.00 -0.16 0.00 0.00 57.90 57.38 2rok n TYR 493 Cb 0.08 -0.27 0.03 0.00 -0.31 0.00 0.00 39.34 38.87 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 -3.01 2.55 0.00 -0.72 0.00 -0.53 -4.98 121.76 115.05 2rok s ALA 494 Ca 0.11 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.78 2rok s ALA 494 Cb 0.17 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.94 2rok s ALA 494 CO 0.71 -1.10 0.14 -0.85 0.00 0.00 0.00 175.76 174.66 2rok n GLU 495 N -1.92 0.00 0.00 0.00 0.28 -1.26 -4.88 120.64 112.86 2rok n GLU 495 Ca 0.11 -0.14 0.00 0.00 -0.16 0.00 0.00 57.16 56.97 2rok n GLU 495 Cb 0.51 -0.48 0.00 0.00 1.43 0.00 0.00 31.44 32.90 2rok n GLU 495 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2rok n SER 496 N 0.00 0.23 -3.40 -1.84 3.41 -1.26 -5.10 113.62 105.66 2rok n SER 496 Ca 0.00 -1.02 -0.09 0.00 -0.26 0.00 0.00 58.87 57.49 2rok n SER 496 Cb 0.32 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.26 2rok n SER 496 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2rok s TYR 497 N -0.02 0.26 -0.03 7.33 1.13 -1.26 -4.41 117.35 120.34 2rok s TYR 497 Ca 0.00 -0.75 -0.10 0.00 -1.41 0.00 0.00 57.07 54.81 2rok s TYR 497 Cb 0.00 0.52 0.02 0.00 -1.10 0.00 0.00 41.96 41.40 2rok s TYR 497 CO 0.00 -1.31 0.23 0.50 -2.51 0.00 0.00 175.55 172.46 2rok s ARG 498 N -3.14 0.49 -0.01 -3.49 3.52 -0.56 -4.81 118.95 110.94 2rok s ARG 498 Ca 0.18 -0.10 0.04 0.00 -0.13 0.00 0.00 55.73 55.73 2rok s ARG 498 Cb -0.04 0.21 -0.01 0.00 -1.56 0.00 0.00 34.95 33.56 2rok s ARG 498 CO 0.12 -0.11 -0.14 0.42 -0.81 0.00 0.00 175.30 174.77 2rok s ILE 499 N -0.89 1.10 0.25 4.11 1.01 -1.26 -1.25 121.20 124.27 2rok s ILE 499 Ca -0.10 -0.59 -0.08 0.00 0.00 0.00 0.00 60.65 59.89 2rok s ILE 499 Cb -0.05 -0.92 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 2rok s ILE 499 CO 0.02 0.31 0.37 0.00 0.00 0.00 0.00 174.94 175.64 2rok s GLN 500 N -0.27 1.49 0.82 2.79 -2.07 -0.37 -4.89 119.66 117.16 2rok s GLN 500 Ca 0.04 -1.45 -0.11 0.00 -1.82 0.00 0.00 55.36 52.02 2rok s GLN 500 Cb -0.06 0.40 0.08 0.00 -1.09 0.00 0.00 33.01 32.35 2rok s GLN 500 CO -0.00 -0.59 1.09 0.95 -1.32 0.00 0.00 175.29 175.42 2rok s THR 501 N -3.92 3.04 0.23 3.63 -4.23 -1.26 -0.37 115.64 112.76 2rok s THR 501 Ca 0.29 0.34 -0.06 0.00 -1.18 0.00 0.00 61.69 61.08 2rok s THR 501 Cb 0.02 -2.98 0.19 0.00 1.34 0.00 0.00 72.50 71.07 2rok s THR 501 CO 0.12 -0.44 1.75 0.22 -0.54 0.00 0.00 174.62 175.72 2rok h TYR 502 N -1.21 0.51 -0.23 3.99 5.03 -1.49 -2.51 116.97 121.07 2rok h TYR 502 Ca -0.47 0.03 -0.12 0.00 2.58 0.00 0.00 58.73 60.75 2rok h TYR 502 Cb 1.26 -0.12 -0.01 0.00 1.55 0.00 0.00 36.73 39.41 2rok h TYR 502 CO 0.48 0.11 -0.38 0.00 -1.32 0.00 0.00 178.16 177.05 2rok h ALA 503 N 1.49 0.92 -0.49 1.82 0.00 -1.93 -2.19 119.26 118.87 2rok h ALA 503 Ca 0.37 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2rok h ALA 503 Cb 0.50 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2rok h ALA 503 CO -0.35 0.63 0.18 0.93 0.00 0.00 0.00 179.25 180.64 2rok h GLU 504 N 0.43 0.75 0.02 0.00 5.08 -1.88 -0.16 114.58 118.82 2rok h GLU 504 Ca 0.04 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2rok h GLU 504 Cb 0.86 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 2rok h GLU 504 CO 0.07 0.68 -0.05 -0.92 -1.00 0.00 0.00 179.01 177.79 2rok h TYR 505 N 0.66 -0.13 -0.06 4.33 3.20 -1.34 -2.32 116.97 121.31 2rok h TYR 505 Ca 0.16 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.05 2rok h TYR 505 Cb 0.23 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2rok h TYR 505 CO 0.01 -0.08 -0.06 0.28 -1.64 0.00 0.00 178.16 176.66 2rok h VAL 506 N -0.11 0.82 -0.76 1.81 2.07 -1.33 -1.48 116.25 117.28 2rok h VAL 506 Ca 0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 2rok h VAL 506 Cb 0.12 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2rok h VAL 506 CO -0.04 0.00 0.39 1.23 0.02 0.00 0.00 177.57 179.17 2rok h GLY 507 N -0.08 1.16 0.65 2.17 0.00 -0.95 -0.46 103.07 105.56 2rok h GLY 507 Ca 0.05 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2rok h GLY 507 CO -0.11 0.52 -0.04 0.50 0.00 0.00 0.00 176.54 177.41 2rok h LYS 508 N 1.08 -0.12 -0.95 4.80 1.57 -1.37 -3.29 116.57 118.29 2rok h LYS 508 Ca 0.27 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.10 2rok h LYS 508 Cb 0.08 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 2rok h LYS 508 CO -0.04 0.22 0.62 -0.22 -0.57 0.00 0.00 179.45 179.47 2rok h LYS 509 N -0.47 1.14 0.00 3.15 3.64 -0.89 -2.27 116.57 120.87 2rok h LYS 509 Ca -0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2rok h LYS 509 Cb 0.39 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2rok h LYS 509 CO 0.02 0.75 0.00 1.04 -2.27 0.00 0.00 179.45 178.99 2rok n GLN 510 N -4.46 0.25 0.00 1.90 1.13 -0.22 -4.02 117.38 111.97 2rok n GLN 510 Ca 0.13 0.08 0.00 0.00 -1.94 0.00 0.00 57.00 55.27 2rok n GLN 510 Cb 0.13 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.98 2rok n GLN 510 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2rok n LYS 511 N -1.34 5.59 0.00 -1.09 5.02 -0.88 -5.09 118.16 120.37 2rok n LYS 511 Ca 0.10 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2rok n LYS 511 Cb 0.21 -0.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.81 2rok n LYS 511 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rok n GLY 512 N 0.80 -0.25 3.64 0.72 0.00 -1.07 -5.11 105.19 103.92 2rok n GLY 512 Ca 0.00 -1.14 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 2rok n GLY 512 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rok s LYS 513 N -2.00 0.65 0.00 1.61 0.00 -1.26 -4.55 119.74 114.18 2rok s LYS 513 Ca 0.00 1.45 0.06 0.00 0.00 0.00 0.00 55.97 57.48 2rok s LYS 513 Cb 0.00 -1.69 0.15 0.00 0.00 0.00 0.00 37.83 36.29 2rok s LYS 513 CO 0.00 -2.85 1.06 1.04 0.00 0.00 0.00 175.35 174.59 2rok n GLN 514 N -4.38 2.31 -1.90 1.78 1.13 -1.26 -5.02 117.38 110.04 2rok n GLN 514 Ca 0.10 -1.63 -0.39 0.00 -1.94 0.00 0.00 57.00 53.14 2rok n GLN 514 Cb 0.52 -1.15 0.01 0.00 0.11 0.00 0.00 30.24 29.74 2rok n GLN 514 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2rok s VAL 515 N -0.91 2.30 0.00 5.09 1.01 -1.26 -4.93 120.40 121.70 2rok s VAL 515 Ca 0.12 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.36 2rok s VAL 515 Cb 0.07 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2rok s VAL 515 CO 0.09 0.03 0.00 1.17 0.00 0.00 0.00 175.10 176.39 2rok n LYS 516 N -0.20 0.00 -1.06 2.72 3.00 -1.26 -5.13 118.16 116.22 2rok n LYS 516 Ca 0.05 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.07 2rok n LYS 516 Cb 0.43 -0.14 0.17 0.00 0.00 0.00 0.00 35.03 35.49 2rok n LYS 516 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2rok s SER 517 N -3.32 2.74 0.25 3.14 0.01 -1.26 -5.10 113.70 110.16 2rok s SER 517 Ca 0.00 1.42 -0.15 0.00 1.31 0.00 0.00 55.95 58.53 2rok s SER 517 Cb 0.00 -2.09 0.06 0.00 0.21 0.00 0.00 66.02 64.19 2rok s SER 517 CO 0.00 -3.09 0.76 0.61 0.41 0.00 0.00 173.24 171.93 2rok n GLY 518 N -0.75 0.95 0.43 3.44 0.00 -1.26 -5.05 105.19 102.95 2rok n GLY 518 Ca 0.06 -1.17 0.25 0.00 0.00 0.00 0.00 46.02 45.15 2rok n GLY 518 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2rok h PRO 519 N 0.00 0.00 0.00 1.61 0.11 -2.09 -1.56 132.00 130.07 2rok h PRO 519 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2rok h PRO 519 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2rok h PRO 519 CO 0.34 0.00 0.00 0.77 -0.21 0.00 0.00 178.00 178.90 2rok h SER 520 N 0.00 0.00 -4.15 -2.05 0.02 -2.02 -3.46 113.55 101.89 2rok h SER 520 Ca 0.34 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.77 2rok h SER 520 Cb 1.40 0.00 0.12 0.00 0.14 0.00 0.00 62.40 64.06 2rok h SER 520 CO -0.00 0.00 0.42 -0.44 -1.14 0.00 0.00 176.83 175.66 2rok s SER 521 N -4.54 4.95 0.00 3.07 0.01 -0.59 -5.25 113.70 111.35 2rok s SER 521 Ca 0.07 2.24 0.00 0.00 1.31 0.00 0.00 55.95 59.57 2rok s SER 521 Cb 0.11 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.76 2rok s SER 521 CO 0.51 -1.75 0.00 0.61 0.41 0.00 0.00 173.24 173.03