#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rok s SER 424 N 0.00 0.19 0.11 1.61 0.01 -1.26 -5.19 113.70 109.17 2rok s SER 424 Ca 0.00 -1.01 -0.12 0.00 1.31 0.00 0.00 55.95 56.13 2rok s SER 424 Cb 0.00 0.35 0.01 0.00 0.21 0.00 0.00 66.02 66.60 2rok s SER 424 CO 0.00 -0.79 0.29 -0.55 0.41 0.00 0.00 173.24 172.59 2rok s SER 425 N -2.99 -0.03 0.00 2.44 0.15 -1.26 -5.01 113.70 107.00 2rok s SER 425 Ca 0.19 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.31 2rok s SER 425 Cb 0.05 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 2rok s SER 425 CO -0.01 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.25 2rok n GLY 426 N -0.14 0.77 0.00 9.45 0.00 -1.26 -5.00 105.19 109.01 2rok n GLY 426 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 0.60 0.06 1.61 3.41 -1.26 -4.73 113.62 113.32 2rok n SER 427 Ca 0.00 -1.08 0.11 0.00 -0.26 0.00 0.00 58.87 57.64 2rok n SER 427 Cb 0.00 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.38 2rok n SER 427 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2rok n SER 428 N -0.04 0.36 -2.68 4.04 3.41 -1.26 -4.86 113.62 112.59 2rok n SER 428 Ca 0.00 0.57 -0.10 0.00 -0.26 0.00 0.00 58.87 59.08 2rok n SER 428 Cb 0.16 -0.66 0.07 0.00 -0.26 0.00 0.00 64.21 63.52 2rok n SER 428 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2rok n GLY 429 N 0.39 -1.49 0.93 5.00 0.00 -1.26 -5.13 105.19 103.63 2rok n GLY 429 Ca 0.04 -1.64 -0.00 0.00 0.00 0.00 0.00 46.02 44.41 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 1.69 0.83 2.24 -0.02 0.00 -1.26 -5.05 105.19 103.62 2rok n GLY 430 Ca 0.06 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 44.99 2rok n GLY 430 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rok n PRO 431 N -0.20 1.95 -0.98 1.61 -0.04 -1.26 -4.95 135.00 131.13 2rok n PRO 431 Ca 0.00 -1.10 -0.33 0.00 -0.04 0.00 0.00 63.50 62.03 2rok n PRO 431 Cb 0.14 -2.12 0.14 0.00 -0.04 0.00 0.00 33.50 31.61 2rok n PRO 431 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2rok s ASP 432 N 2.44 3.38 1.01 3.54 2.15 -1.26 -5.02 116.67 122.91 2rok s ASP 432 Ca 0.52 2.30 -0.11 0.00 0.43 0.00 0.00 52.55 55.68 2rok s ASP 432 Cb 0.21 -2.58 0.20 0.00 -0.30 0.00 0.00 42.92 40.44 2rok s ASP 432 CO -0.02 -2.81 1.09 -1.48 -0.17 0.00 0.00 175.17 171.78 2rok s LEU 433 N -6.01 1.93 -0.36 -1.34 0.05 -1.26 -5.06 118.68 106.63 2rok s LEU 433 Ca 0.71 1.78 -0.00 0.00 0.05 0.00 0.00 54.13 56.67 2rok s LEU 433 Cb -0.26 -3.99 0.13 0.00 -2.05 0.00 0.00 46.19 40.02 2rok s LEU 433 CO 0.53 -3.44 0.20 -1.10 -0.55 0.00 0.00 176.35 171.99 2rok s GLN 434 N -4.63 0.62 0.78 1.48 -0.21 -1.26 -5.15 119.66 111.29 2rok s GLN 434 Ca 0.67 -1.33 -0.11 0.00 0.02 0.00 0.00 55.36 54.61 2rok s GLN 434 Cb -0.23 -1.46 0.06 0.00 1.00 0.00 0.00 33.01 32.38 2rok s GLN 434 CO 0.60 -1.17 1.09 -1.25 -2.12 0.00 0.00 175.29 172.44 2rok s PRO 435 N 1.11 2.22 0.00 2.91 0.04 -1.26 -4.93 135.00 135.08 2rok s PRO 435 Ca 0.17 0.77 0.00 0.00 0.04 0.00 0.00 61.00 61.97 2rok s PRO 435 Cb -0.22 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2rok s PRO 435 CO -0.04 -1.56 0.48 0.36 0.04 0.00 0.00 177.00 176.27 2rok n LYS 436 N -3.41 0.56 -3.55 4.56 2.85 -1.26 -4.76 118.16 113.16 2rok n LYS 436 Ca 0.07 0.00 -0.26 0.00 -1.05 0.00 0.00 58.31 57.07 2rok n LYS 436 Cb 0.55 -1.24 0.00 0.00 -0.65 0.00 0.00 35.03 33.69 2rok n LYS 436 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2rok n ARG 437 N 0.56 -3.80 0.20 -1.58 1.74 -1.26 -4.73 116.66 107.79 2rok n ARG 437 Ca 0.00 0.51 0.14 0.00 -0.77 0.00 0.00 57.85 57.73 2rok n ARG 437 Cb 0.24 -5.26 0.69 0.00 -1.02 0.00 0.00 32.46 27.11 2rok n ARG 437 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 2rok h ASP 438 N -1.25 0.00 -0.33 0.55 3.58 -2.01 -1.77 116.42 115.19 2rok h ASP 438 Ca -0.48 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.97 2rok h ASP 438 Cb 1.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.37 2rok h ASP 438 CO 0.59 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.95 2rok n HIS 439 N -2.51 0.51 -5.14 0.28 1.44 -1.26 -4.58 115.22 103.96 2rok n HIS 439 Ca -0.01 -0.24 -0.29 0.00 -2.01 0.00 0.00 57.72 55.17 2rok n HIS 439 Cb 0.13 -0.03 -0.16 0.00 0.12 0.00 0.00 29.99 30.05 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 -1.57 1.85 0.31 0.61 1.01 -0.66 -1.26 120.40 120.69 2rok s VAL 440 Ca 0.23 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.28 2rok s VAL 440 Cb 0.13 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 2rok s VAL 440 CO 0.15 0.52 0.46 -0.76 0.00 0.00 0.00 175.10 175.47 2rok s LEU 441 N -0.28 4.07 -0.04 3.92 1.43 0.10 -1.07 118.68 126.81 2rok s LEU 441 Ca 0.02 0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.20 2rok s LEU 441 Cb -0.11 -2.89 -0.02 0.00 0.03 0.00 0.00 46.19 43.20 2rok s LEU 441 CO 0.02 -0.31 -0.22 -2.28 0.23 0.00 0.00 176.35 173.78 2rok s HIS 442 N -2.16 2.47 -0.00 0.29 5.65 0.34 -1.04 115.29 120.84 2rok s HIS 442 Ca 0.41 -0.45 0.01 0.00 0.25 0.00 0.00 55.06 55.28 2rok s HIS 442 Cb -0.09 -1.57 -0.00 0.00 -1.18 0.00 0.00 32.58 29.73 2rok s HIS 442 CO 0.32 -0.04 -0.05 0.08 -0.65 0.00 0.00 174.74 174.40 2rok s VAL 443 N -0.49 0.38 -0.04 0.89 1.01 0.12 -0.74 120.40 121.53 2rok s VAL 443 Ca 0.06 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.86 2rok s VAL 443 Cb -0.11 -0.32 0.01 0.00 0.00 0.00 0.00 36.38 35.95 2rok s VAL 443 CO 0.01 0.11 -0.10 -0.89 0.00 0.00 0.00 175.10 174.23 2rok s THR 444 N -0.11 0.88 0.12 3.92 2.01 -0.23 -1.78 115.64 120.45 2rok s THR 444 Ca 0.02 -0.39 -0.21 0.00 0.31 0.00 0.00 61.69 61.42 2rok s THR 444 Cb -0.02 -0.79 0.06 0.00 0.01 0.00 0.00 72.50 71.75 2rok s THR 444 CO -0.00 0.28 0.53 0.72 -0.69 0.00 0.00 174.62 175.46 2rok s PHE 445 N 0.34 -0.43 0.47 4.92 -0.12 -0.46 -1.08 117.98 121.62 2rok s PHE 445 Ca -0.06 0.28 -0.23 0.00 -0.05 0.00 0.00 56.93 56.86 2rok s PHE 445 Cb -0.11 0.42 -0.08 0.00 -0.63 0.00 0.00 43.02 42.62 2rok s PHE 445 CO 0.01 -0.75 1.16 -2.30 -0.05 0.00 0.00 175.22 173.28 2rok n PRO 446 N -0.11 1.54 0.20 1.99 -0.02 -1.26 -4.57 135.00 132.77 2rok n PRO 446 Ca -0.17 0.56 0.18 0.00 -2.02 0.00 0.00 63.50 62.05 2rok n PRO 446 Cb 0.63 -2.28 0.83 0.00 -0.02 0.00 0.00 33.50 32.66 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 1.54 0.00 0.00 -0.52 2.10 -1.92 -1.94 116.57 115.83 2rok h LYS 447 Ca -0.47 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.17 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 -0.02 0.93 -2.00 0.00 0.00 179.45 178.93 2rok h GLU 448 N 0.00 0.00 -7.15 0.07 4.39 -1.90 -3.44 114.58 106.54 2rok h GLU 448 Ca 0.10 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.26 2rok h GLU 448 Cb 0.65 0.00 0.14 0.00 -0.10 0.00 0.00 28.75 29.44 2rok h GLU 448 CO -0.00 0.02 0.42 -1.58 -1.16 0.00 0.00 179.01 176.71 2rok s TRP 449 N -4.09 2.20 0.29 4.33 0.52 -0.73 -5.08 118.94 116.39 2rok s TRP 449 Ca -0.03 1.56 0.02 0.00 0.02 0.00 0.00 56.10 57.67 2rok s TRP 449 Cb 0.12 -3.47 -0.05 0.00 -1.15 0.00 0.00 33.47 28.93 2rok s TRP 449 CO 0.48 -2.45 0.11 0.15 0.02 0.00 0.00 176.95 175.26 2rok s LYS 450 N -3.73 1.54 0.42 4.98 1.02 -1.26 -5.03 119.74 117.68 2rok s LYS 450 Ca 0.75 -1.86 0.20 0.00 0.02 0.00 0.00 55.97 55.08 2rok s LYS 450 Cb -0.29 -0.33 1.13 0.00 -0.52 0.00 0.00 37.83 37.82 2rok s LYS 450 CO 0.41 -0.34 1.82 1.15 -0.92 0.00 0.00 175.35 177.48 2rok h THR 451 N 2.25 0.60 -0.52 2.17 2.02 -1.99 -1.42 112.91 116.03 2rok h THR 451 Ca -0.37 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 66.62 2rok h THR 451 Cb 1.25 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2rok h THR 451 CO 0.59 0.07 0.09 0.28 0.37 0.00 0.00 175.52 176.92 2rok h SER 452 N 0.36 0.82 0.17 4.18 0.02 -1.99 0.03 113.55 117.15 2rok h SER 452 Ca 0.52 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 61.15 2rok h SER 452 Cb 1.38 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2rok h SER 452 CO -0.20 0.87 -0.26 0.44 -1.14 0.00 0.00 176.83 176.53 2rok h ASP 453 N 0.74 0.16 -0.17 3.07 3.32 -1.68 -1.05 116.42 120.81 2rok h ASP 453 Ca 0.16 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 2rok h ASP 453 Cb 0.39 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2rok h ASP 453 CO 0.01 0.42 -0.28 -0.07 -1.72 0.00 0.00 179.24 177.60 2rok h LEU 454 N 0.14 0.55 -0.84 1.55 3.38 -1.13 -0.78 115.31 118.19 2rok h LEU 454 Ca 0.02 -0.53 0.06 0.00 0.09 0.00 0.00 57.88 57.52 2rok h LEU 454 Cb 0.54 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 2rok h LEU 454 CO 0.04 0.97 0.52 1.88 0.09 0.00 0.00 178.44 181.94 2rok h TYR 455 N 0.14 0.96 -0.61 1.13 0.05 -0.84 -2.39 116.97 115.41 2rok h TYR 455 Ca 0.01 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.74 2rok h TYR 455 Cb 0.86 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.27 2rok h TYR 455 CO 0.09 0.49 0.07 0.37 -1.05 0.00 0.00 178.16 178.13 2rok h GLN 456 N 0.95 1.02 -0.32 4.88 4.15 -1.09 -1.08 115.11 123.63 2rok h GLN 456 Ca 0.36 -0.28 -0.08 0.00 0.77 0.00 0.00 58.65 59.43 2rok h GLN 456 Cb 0.15 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 2rok h GLN 456 CO -0.17 0.96 -0.14 1.25 -1.93 0.00 0.00 178.83 178.81 2rok h LEU 457 N 0.95 0.54 -2.27 -2.39 5.85 -0.80 -3.29 115.31 113.91 2rok h LEU 457 Ca 0.19 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2rok h LEU 457 Cb 0.46 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2rok h LEU 457 CO 0.02 0.70 0.00 0.49 -0.34 0.00 0.00 178.44 179.31 2rok n PHE 458 N -4.18 0.24 -0.07 1.25 3.72 -0.93 -4.59 117.46 112.90 2rok n PHE 458 Ca 0.01 -0.29 0.22 0.00 -0.05 0.00 0.00 57.45 57.33 2rok n PHE 458 Cb 0.34 -0.02 0.67 0.00 -0.94 0.00 0.00 39.48 39.54 2rok n PHE 458 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2rok h SER 459 N 1.87 0.06 0.00 4.37 0.87 -1.26 -1.86 113.55 117.60 2rok h SER 459 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2rok h SER 459 Cb 0.59 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2rok h SER 459 CO 0.00 0.03 0.04 0.00 -0.53 0.00 0.00 176.83 176.37 2rok n ALA 460 N -2.64 0.95 0.19 6.23 0.00 -1.26 -2.11 120.51 121.86 2rok n ALA 460 Ca 0.13 0.08 0.04 0.00 0.00 0.00 0.00 53.44 53.69 2rok n ALA 460 Cb 0.69 -1.06 0.06 0.00 0.00 0.00 0.00 19.45 19.14 2rok n ALA 460 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2rok n PHE 461 N -1.80 0.10 -1.25 0.00 3.72 -0.70 -5.12 117.46 112.41 2rok n PHE 461 Ca -0.01 -0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 2rok n PHE 461 Cb 0.06 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 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 0.37 -0.41 3.74 1.37 0.00 -0.90 -4.71 105.19 104.65 2rok n GLY 462 Ca 0.06 -1.63 -0.36 0.00 0.00 0.00 0.00 46.02 44.08 2rok n GLY 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rok s ASN 463 N -4.00 4.72 0.34 1.61 4.22 -1.26 -4.57 114.94 116.01 2rok s ASN 463 Ca 0.00 2.50 0.02 0.00 -2.14 0.00 0.00 52.86 53.24 2rok s ASN 463 Cb 0.00 -2.61 -0.01 0.00 1.28 0.00 0.00 41.25 39.91 2rok s ASN 463 CO 0.00 -1.92 0.40 0.27 -2.04 0.00 0.00 177.10 173.81 2rok s ILE 464 N -1.56 0.00 0.01 0.54 -4.36 -1.26 -4.52 121.20 110.04 2rok s ILE 464 Ca 0.79 -1.76 0.01 0.00 -0.26 0.00 0.00 60.65 59.43 2rok s ILE 464 Cb -0.34 -2.60 -0.01 0.00 1.25 0.00 0.00 42.46 40.76 2rok s ILE 464 CO 0.38 0.00 -0.04 -1.58 0.24 0.00 0.00 174.94 173.95 2rok s GLN 465 N -3.16 0.29 -0.06 0.37 0.74 -1.10 -5.00 119.66 111.74 2rok s GLN 465 Ca 0.35 -0.30 0.03 0.00 0.05 0.00 0.00 55.36 55.48 2rok s GLN 465 Cb 0.01 -0.17 0.01 0.00 1.10 0.00 0.00 33.01 33.96 2rok s GLN 465 CO 0.24 0.04 -0.14 0.42 -0.55 0.00 0.00 175.29 175.29 2rok s ILE 466 N -0.54 1.27 -0.30 -2.34 1.01 -1.26 -0.81 121.20 118.22 2rok s ILE 466 Ca -0.04 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.02 2rok s ILE 466 Cb -0.04 -1.13 0.10 0.00 0.01 0.00 0.00 42.46 41.40 2rok s ILE 466 CO -0.00 0.38 0.13 -0.44 0.00 0.00 0.00 174.94 175.01 2rok s SER 467 N 0.52 3.63 0.71 3.58 0.01 -0.38 -5.02 113.70 116.74 2rok s SER 467 Ca -0.13 -1.49 -0.16 0.00 1.31 0.00 0.00 55.95 55.48 2rok s SER 467 Cb -0.15 -0.51 0.01 0.00 0.21 0.00 0.00 66.02 65.58 2rok s SER 467 CO 0.04 -0.42 1.10 0.79 0.41 0.00 0.00 173.24 175.16 2rok n TRP 468 N 5.00 1.15 0.00 2.43 7.02 -1.26 -0.67 117.44 131.12 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 0.41 -2.14 0.00 0.00 -2.42 0.00 0.00 31.31 27.16 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 -2.42 0.00 -3.95 -0.99 -5.35 -0.95 -4.82 119.36 100.89 2rok n ILE 469 Ca 0.14 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.50 2rok n ILE 469 Cb 0.49 0.05 -0.01 0.00 -1.74 0.00 0.00 39.64 38.43 2rok n ILE 469 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2rok s ASP 470 N -0.83 0.43 0.27 7.28 -1.08 -0.67 -4.99 116.67 117.09 2rok s ASP 470 Ca 0.00 -1.29 0.22 0.00 -0.52 0.00 0.00 52.55 50.96 2rok s ASP 470 Cb 0.00 0.75 1.03 0.00 -1.46 0.00 0.00 42.92 43.24 2rok s ASP 470 CO 0.00 -1.48 1.68 -0.67 0.52 0.00 0.00 175.17 175.22 2rok n ASP 471 N -1.36 0.61 0.00 -0.34 2.03 -1.26 -3.28 116.55 112.95 2rok n ASP 471 Ca -0.04 0.70 0.00 0.00 0.52 0.00 0.00 54.79 55.97 2rok n ASP 471 Cb 0.61 -0.81 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 2rok n ASP 471 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2rok n THR 472 N -2.23 0.29 -3.58 5.18 -2.24 -1.26 -4.37 114.28 106.07 2rok n THR 472 Ca 0.01 -0.33 -0.15 0.00 -2.27 0.00 0.00 64.05 61.31 2rok n THR 472 Cb 0.15 0.98 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 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 -0.29 -0.49 0.15 3.42 1.04 -1.21 -1.36 113.70 114.97 2rok s SER 473 Ca 0.00 0.39 -0.16 0.00 0.48 0.00 0.00 55.95 56.66 2rok s SER 473 Cb 0.00 0.48 0.03 0.00 0.10 0.00 0.00 66.02 66.63 2rok s SER 473 CO 0.00 -0.63 0.43 0.00 0.98 0.00 0.00 173.24 174.02 2rok s ALA 474 N -1.74 -0.85 0.17 5.32 0.00 -0.73 -1.67 121.76 122.25 2rok s ALA 474 Ca -0.09 -0.18 -0.05 0.00 0.00 0.00 0.00 51.96 51.64 2rok s ALA 474 Cb -0.01 0.77 -0.06 0.00 0.00 0.00 0.00 23.12 23.82 2rok s ALA 474 CO 0.04 -0.70 0.42 -0.06 0.00 0.00 0.00 175.76 175.46 2rok s PHE 475 N -3.84 3.47 -0.13 0.00 0.08 0.15 -0.70 117.98 117.01 2rok s PHE 475 Ca 0.06 0.60 -0.04 0.00 0.12 0.00 0.00 56.93 57.68 2rok s PHE 475 Cb 0.01 -2.04 0.05 0.00 -0.57 0.00 0.00 43.02 40.46 2rok s PHE 475 CO -0.08 0.39 0.07 0.08 -0.10 0.00 0.00 175.22 175.58 2rok s VAL 476 N -1.73 0.02 0.18 -0.44 1.01 -0.20 -1.25 120.40 117.98 2rok s VAL 476 Ca 0.42 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 62.09 2rok s VAL 476 Cb -0.12 -0.50 -0.08 0.00 0.00 0.00 0.00 36.38 35.69 2rok s VAL 476 CO 0.25 -0.09 1.07 -0.44 0.00 0.00 0.00 175.10 175.88 2rok s SER 477 N 2.10 7.33 0.33 3.32 0.01 0.01 -0.72 113.70 126.08 2rok s SER 477 Ca 0.03 2.05 0.10 0.00 1.31 0.00 0.00 55.95 59.43 2rok s SER 477 Cb -0.15 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.42 2rok s SER 477 CO -0.07 -0.16 -0.08 -0.76 0.41 0.00 0.00 173.24 172.58 2rok s LEU 478 N -0.44 2.80 0.48 2.44 1.43 -0.39 -2.72 118.68 122.28 2rok s LEU 478 Ca 0.48 -1.09 0.27 0.00 -1.03 0.00 0.00 54.13 52.76 2rok s LEU 478 Cb -0.28 -1.15 1.13 0.00 0.03 0.00 0.00 46.19 45.92 2rok s LEU 478 CO 0.34 -0.17 1.91 0.28 0.23 0.00 0.00 176.35 178.95 2rok h SER 479 N 1.99 0.00 -4.57 2.29 0.02 -1.83 -3.45 113.55 108.00 2rok h SER 479 Ca -0.42 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.40 2rok h SER 479 Cb 1.25 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.57 2rok h SER 479 CO 0.67 0.17 -0.35 -1.10 -1.14 0.00 0.00 176.83 175.08 2rok s GLN 480 N -3.78 0.52 0.53 3.45 -0.21 -1.26 -5.04 119.66 113.86 2rok s GLN 480 Ca -0.00 -0.01 0.24 0.00 0.02 0.00 0.00 55.36 55.60 2rok s GLN 480 Cb 0.11 0.23 1.37 0.00 1.00 0.00 0.00 33.01 35.72 2rok s GLN 480 CO 0.61 -0.12 2.03 -1.35 -2.12 0.00 0.00 175.29 174.33 2rok h PRO 481 N 4.59 0.00 -0.69 2.91 0.11 -1.87 -1.84 132.00 135.21 2rok h PRO 481 Ca -0.29 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.82 2rok h PRO 481 Cb 1.18 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2rok h PRO 481 CO 0.37 0.00 0.40 0.93 -0.21 0.00 0.00 178.00 179.49 2rok h GLU 482 N 0.00 0.93 -0.23 1.05 3.07 -1.96 -0.98 114.58 116.46 2rok h GLU 482 Ca 0.20 -0.09 -0.15 0.00 -0.50 0.00 0.00 59.36 58.83 2rok h GLU 482 Cb 0.82 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.53 2rok h GLU 482 CO -0.00 0.66 -0.46 1.96 -1.40 0.00 0.00 179.01 179.77 2rok h GLN 483 N 0.95 0.59 -0.26 2.33 4.20 -1.76 -2.21 115.11 118.96 2rok h GLN 483 Ca 0.25 -0.33 0.02 0.00 0.06 0.00 0.00 58.65 58.64 2rok h GLN 483 Cb -0.02 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2rok h GLN 483 CO -0.04 0.93 0.13 0.28 -0.67 0.00 0.00 178.83 179.46 2rok h VAL 484 N 0.48 1.00 -0.88 -0.54 2.07 -1.26 -1.01 116.25 116.10 2rok h VAL 484 Ca 0.03 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.47 2rok h VAL 484 Cb 0.99 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 2rok h VAL 484 CO 0.09 0.05 0.58 1.56 0.02 0.00 0.00 177.57 179.87 2rok h GLN 485 N 0.28 1.14 0.05 1.57 4.20 -1.05 -0.60 115.11 120.70 2rok h GLN 485 Ca 0.11 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2rok h GLN 485 Cb 0.03 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.55 2rok h GLN 485 CO -0.07 0.75 -0.02 0.82 -0.67 0.00 0.00 178.83 179.64 2rok h ILE 486 N 1.17 1.04 -0.52 2.54 2.04 -1.23 -1.88 117.51 120.68 2rok h ILE 486 Ca 0.33 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 2rok h ILE 486 Cb -0.11 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 2rok h ILE 486 CO -0.08 0.07 0.17 0.00 0.00 0.00 0.00 178.15 178.31 2rok h ALA 487 N 0.75 1.33 -0.60 1.87 0.00 -0.86 -0.52 119.26 121.22 2rok h ALA 487 Ca -0.01 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 2rok h ALA 487 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2rok h ALA 487 CO 0.01 0.49 0.08 0.28 0.00 0.00 0.00 179.25 180.11 2rok h VAL 488 N 0.75 1.26 -0.33 0.00 2.07 -1.10 -2.49 116.25 116.41 2rok h VAL 488 Ca 0.17 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 2rok h VAL 488 Cb 0.21 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2rok h VAL 488 CO -0.01 0.38 0.10 -1.13 0.02 0.00 0.00 177.57 176.92 2rok h ASN 489 N 0.91 0.48 1.08 0.57 -1.24 -0.65 -3.21 115.58 113.53 2rok h ASN 489 Ca 0.18 -0.21 -0.03 0.00 0.71 0.00 0.00 56.30 56.96 2rok h ASN 489 Cb 0.45 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.37 2rok h ASN 489 CO 0.01 0.56 -0.13 0.71 -1.29 0.00 0.00 177.43 177.30 2rok h THR 490 N 0.37 0.30 0.00 -3.57 1.35 -1.11 -3.10 112.91 107.16 2rok h THR 490 Ca 0.11 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 2rok h THR 490 Cb 0.26 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 2rok h THR 490 CO -0.00 0.12 0.00 0.77 -0.25 0.00 0.00 175.52 176.16 2rok h SER 491 N 0.00 0.00 -0.21 5.36 4.64 -1.44 -2.18 113.55 119.71 2rok h SER 491 Ca -0.00 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.38 2rok h SER 491 Cb 0.70 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 2rok h SER 491 CO 0.02 0.00 0.41 0.50 -0.87 0.00 0.00 176.83 176.88 2rok h LYS 492 N 0.00 0.00 0.00 4.77 3.64 -1.72 -2.53 116.57 120.73 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 0.01 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2rok h LYS 492 CO 0.00 0.00 -0.12 0.66 -2.27 0.00 0.00 179.45 177.72 2rok n TYR 493 N -3.30 0.00 -0.17 1.91 4.01 -0.82 -4.85 117.16 113.94 2rok n TYR 493 Ca 0.03 -0.83 -0.04 0.00 -0.16 0.00 0.00 57.90 56.90 2rok n TYR 493 Cb 0.52 -0.14 0.16 0.00 -0.31 0.00 0.00 39.34 39.57 2rok n TYR 493 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2rok h ALA 494 N 0.05 1.16 0.00 -0.72 0.00 -1.57 -3.47 119.26 114.71 2rok h ALA 494 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2rok h ALA 494 Cb 1.08 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2rok h ALA 494 CO 0.00 0.58 0.00 0.39 0.00 0.00 0.00 179.25 180.22 2rok n GLU 495 N -4.27 0.00 0.00 0.00 -0.58 -1.26 -4.18 120.64 110.35 2rok n GLU 495 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2rok n GLU 495 Cb 0.23 -2.19 0.00 0.00 -0.57 0.00 0.00 31.44 28.90 2rok n GLU 495 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2rok n SER 496 N 0.00 0.26 -3.12 1.62 7.64 -1.26 -5.10 113.62 113.65 2rok n SER 496 Ca 0.00 -1.07 -0.10 0.00 1.01 0.00 0.00 58.87 58.71 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 -0.07 0.36 0.01 1.43 1.13 -1.26 -4.45 117.35 114.50 2rok s TYR 497 Ca 0.00 -0.89 -0.06 0.00 -1.41 0.00 0.00 57.07 54.71 2rok s TYR 497 Cb 0.00 0.55 -0.00 0.00 -1.10 0.00 0.00 41.96 41.41 2rok s TYR 497 CO 0.00 -1.41 0.10 0.50 -2.51 0.00 0.00 175.55 172.24 2rok s ARG 498 N -2.70 0.46 0.04 -3.49 6.06 -0.24 -4.75 118.95 114.32 2rok s ARG 498 Ca 0.19 -0.46 0.05 0.00 -2.50 0.00 0.00 55.73 53.01 2rok s ARG 498 Cb -0.04 0.19 -0.02 0.00 0.06 0.00 0.00 34.95 35.14 2rok s ARG 498 CO 0.13 -0.10 -0.15 0.42 -2.50 0.00 0.00 175.30 173.10 2rok s ILE 499 N -1.46 1.16 0.21 4.11 1.01 -1.26 -1.07 121.20 123.90 2rok s ILE 499 Ca -0.15 -1.00 -0.02 0.00 0.00 0.00 0.00 60.65 59.49 2rok s ILE 499 Cb -0.08 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2rok s ILE 499 CO 0.01 0.04 0.17 -1.10 0.00 0.00 0.00 174.94 174.05 2rok s GLN 500 N -1.10 1.25 0.71 2.79 -0.21 0.08 -4.95 119.66 118.23 2rok s GLN 500 Ca 0.02 -1.60 -0.11 0.00 0.02 0.00 0.00 55.36 53.69 2rok s GLN 500 Cb -0.08 0.29 0.01 0.00 1.00 0.00 0.00 33.01 34.24 2rok s GLN 500 CO 0.01 -0.42 1.09 0.95 -2.12 0.00 0.00 175.29 174.80 2rok s THR 501 N -4.13 3.59 0.23 -0.19 -4.23 -1.26 -0.50 115.64 109.14 2rok s THR 501 Ca 0.37 0.52 -0.07 0.00 -1.18 0.00 0.00 61.69 61.33 2rok s THR 501 Cb 0.06 -3.47 0.18 0.00 1.34 0.00 0.00 72.50 70.60 2rok s THR 501 CO 0.12 -0.67 1.81 0.22 -0.54 0.00 0.00 174.62 175.55 2rok h TYR 502 N -0.67 0.75 -0.45 3.99 3.20 -1.33 -2.57 116.97 119.89 2rok h TYR 502 Ca -0.45 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.32 2rok h TYR 502 Cb 1.25 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 2rok h TYR 502 CO 0.52 0.33 -0.20 0.00 -1.64 0.00 0.00 178.16 177.17 2rok h ALA 503 N 1.40 0.78 -0.76 1.82 0.00 -1.84 -1.00 119.26 119.67 2rok h ALA 503 Ca 0.34 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2rok h ALA 503 Cb 0.27 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2rok h ALA 503 CO -0.22 0.66 0.33 1.49 0.00 0.00 0.00 179.25 181.51 2rok h GLU 504 N 0.79 1.10 0.05 0.00 4.57 -1.92 -2.51 114.58 116.66 2rok h GLU 504 Ca 0.11 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2rok h GLU 504 Cb 0.75 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 2rok h GLU 504 CO 0.06 0.87 -0.02 -0.92 -1.18 0.00 0.00 179.01 177.82 2rok h TYR 505 N 1.08 -0.06 -0.92 0.92 3.20 -1.33 -3.34 116.97 116.53 2rok h TYR 505 Ca 0.26 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.29 2rok h TYR 505 Cb 0.16 0.02 -0.10 0.00 1.54 0.00 0.00 36.73 38.35 2rok h TYR 505 CO 0.02 0.32 0.51 0.28 -1.64 0.00 0.00 178.16 177.65 2rok h VAL 506 N -0.46 0.71 0.00 1.81 2.07 -0.99 -1.39 116.25 118.00 2rok h VAL 506 Ca -0.01 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2rok h VAL 506 Cb 0.41 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2rok h VAL 506 CO 0.01 0.12 0.00 0.61 0.02 0.00 0.00 177.57 178.33 2rok n GLY 507 N -1.33 -0.85 0.08 2.17 0.00 -0.96 -3.06 105.19 101.24 2rok n GLY 507 Ca 0.20 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2rok n GLY 507 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2rok n LYS 508 N -1.74 0.36 0.24 1.61 2.85 -0.63 -4.99 118.16 115.86 2rok n LYS 508 Ca 0.01 -0.74 0.08 0.00 -1.05 0.00 0.00 58.31 56.62 2rok n LYS 508 Cb 0.10 -0.58 0.43 0.00 -0.65 0.00 0.00 35.03 34.33 2rok n LYS 508 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 2rok h LYS 509 N 0.00 0.00 0.00 -1.58 2.10 -1.22 -0.59 116.57 115.28 2rok h LYS 509 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2rok h LYS 509 Cb 1.01 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.34 2rok h LYS 509 CO 0.00 0.00 -0.00 0.37 -2.00 0.00 0.00 179.45 177.82 2rok h GLN 510 N 0.00 0.00 0.00 0.07 4.15 -1.89 -3.45 115.11 114.00 2rok h GLN 510 Ca 0.00 0.00 -0.38 0.00 0.77 0.00 0.00 58.65 59.04 2rok h GLN 510 Cb 0.87 0.00 -0.10 0.00 0.21 0.00 0.00 27.48 28.46 2rok h GLN 510 CO 0.00 0.00 -0.37 0.36 -1.93 0.00 0.00 178.83 176.89 2rok n LYS 511 N -3.47 0.35 0.00 1.69 2.85 -0.23 -5.20 118.16 114.15 2rok n LYS 511 Ca -0.03 -2.69 0.00 0.00 -1.05 0.00 0.00 58.31 54.54 2rok n LYS 511 Cb 0.08 2.23 0.00 0.00 -0.65 0.00 0.00 35.03 36.69 2rok n LYS 511 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2rok n GLY 512 N -0.51 -0.80 3.73 2.58 0.00 -1.26 -4.90 105.19 104.03 2rok n GLY 512 Ca 0.06 -0.98 -0.36 0.00 0.00 0.00 0.00 46.02 44.74 2rok n GLY 512 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rok s LYS 513 N -2.00 2.48 0.00 1.61 2.47 -1.26 -5.08 119.74 117.97 2rok s LYS 513 Ca 0.00 1.95 -0.13 0.00 -1.56 0.00 0.00 55.97 56.22 2rok s LYS 513 Cb 0.00 -1.85 0.02 0.00 -1.46 0.00 0.00 37.83 34.54 2rok s LYS 513 CO 0.00 -1.62 0.28 -1.14 0.16 0.00 0.00 175.35 173.03 2rok s GLN 514 N -3.52 0.67 0.00 4.03 2.00 -1.26 -5.02 119.66 116.56 2rok s GLN 514 Ca 0.80 -0.31 0.00 0.00 -2.00 0.00 0.00 55.36 53.84 2rok s GLN 514 Cb -0.34 0.29 0.00 0.00 0.80 0.00 0.00 33.01 33.76 2rok s GLN 514 CO 0.40 -0.19 0.04 1.33 -0.50 0.00 0.00 175.29 176.37 2rok n VAL 515 N 1.12 0.00 0.24 1.34 0.24 -1.26 -4.77 118.33 115.23 2rok n VAL 515 Ca -0.21 -0.18 0.05 0.00 -2.04 0.00 0.00 64.34 61.96 2rok n VAL 515 Cb 0.57 1.13 0.22 0.00 -1.47 0.00 0.00 33.84 34.29 2rok n VAL 515 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2rok n LYS 516 N -0.28 0.03 0.00 7.34 2.85 -1.26 -4.17 118.16 122.67 2rok n LYS 516 Ca 0.00 0.41 0.00 0.00 -1.05 0.00 0.00 58.31 57.67 2rok n LYS 516 Cb 0.03 -1.58 0.00 0.00 -0.65 0.00 0.00 35.03 32.84 2rok n LYS 516 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2rok n SER 517 N -1.64 0.39 -3.37 -5.58 7.64 -1.26 -4.82 113.62 104.98 2rok n SER 517 Ca 0.01 -1.06 -0.08 0.00 1.01 0.00 0.00 58.87 58.75 2rok n SER 517 Cb 0.09 -0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 2rok n SER 517 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2rok s GLY 518 N -0.74 0.20 0.84 0.23 0.00 -1.26 -5.18 107.32 101.41 2rok s GLY 518 Ca 0.00 -0.58 -0.11 0.00 0.00 0.00 0.00 44.72 44.02 2rok s GLY 518 CO 0.00 -0.24 1.09 2.56 0.00 0.00 0.00 173.10 176.51 2rok s PRO 519 N -3.08 1.76 0.00 2.90 0.04 -1.26 -5.03 135.00 130.33 2rok s PRO 519 Ca 0.14 0.73 0.00 0.00 0.04 0.00 0.00 61.00 61.91 2rok s PRO 519 Cb -0.05 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.61 2rok s PRO 519 CO 0.10 -1.87 0.64 0.43 0.04 0.00 0.00 177.00 176.34 2rok n SER 520 N -3.62 0.58 0.15 6.66 7.64 -1.26 -4.86 113.62 118.92 2rok n SER 520 Ca 0.07 -1.29 0.13 0.00 1.01 0.00 0.00 58.87 58.79 2rok n SER 520 Cb 0.56 0.00 0.50 0.00 -1.01 0.00 0.00 64.21 64.26 2rok n SER 520 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2rok h SER 521 N 0.00 0.00 0.00 6.43 4.64 -2.07 -3.57 113.55 118.97 2rok h SER 521 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rok h SER 521 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2rok h SER 521 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57