#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pdr s THR 461 N 0.00 2.21 -2.67 9.51 2.01 -1.26 -4.91 115.64 120.52 1pdr s THR 461 Ca 0.00 0.20 0.26 0.00 0.31 0.00 0.00 61.69 62.46 1pdr s THR 461 Cb 0.00 -3.13 0.32 0.00 0.01 0.00 0.00 72.50 69.70 1pdr s THR 461 CO 0.00 0.05 1.46 0.54 -0.69 0.00 0.00 174.62 175.97 1pdr n ARG 462 N 0.69 1.92 -3.04 4.92 5.12 -1.26 -4.14 116.66 120.87 1pdr n ARG 462 Ca 0.01 -1.41 -0.37 0.00 -1.93 0.00 0.00 57.85 54.15 1pdr n ARG 462 Cb 0.40 -1.47 -0.06 0.00 -1.16 0.00 0.00 32.46 30.16 1pdr n ARG 462 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1pdr s GLU 463 N -2.06 4.38 0.37 5.56 8.01 -1.26 -4.62 118.70 129.08 1pdr s GLU 463 Ca 0.31 1.00 -0.27 0.00 0.01 0.00 0.00 54.97 56.03 1pdr s GLU 463 Cb 0.20 -2.99 -0.12 0.00 -4.31 0.00 0.00 34.13 26.91 1pdr s GLU 463 CO 0.34 0.44 1.15 -2.30 0.01 0.00 0.00 175.26 174.91 1pdr n PRO 464 N 1.00 1.73 -4.60 0.39 -0.02 -1.26 -4.72 135.00 127.52 1pdr n PRO 464 Ca -0.03 0.61 -0.26 0.00 -2.02 0.00 0.00 63.50 61.80 1pdr n PRO 464 Cb 0.50 -2.16 -0.14 0.00 -0.02 0.00 0.00 33.50 31.68 1pdr n PRO 464 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1pdr s ARG 465 N -1.91 1.40 -0.19 -0.52 0.52 0.25 -4.95 118.95 113.54 1pdr s ARG 465 Ca 0.59 -1.03 -0.09 0.00 -0.52 0.00 0.00 55.73 54.68 1pdr s ARG 465 Cb -0.58 -1.57 -0.05 0.00 0.52 0.00 0.00 34.95 33.27 1pdr s ARG 465 CO 0.60 0.39 0.11 0.21 0.02 0.00 0.00 175.30 176.63 1pdr s LYS 466 N -1.38 4.10 -0.06 3.54 2.20 -1.26 -0.91 119.74 125.97 1pdr s LYS 466 Ca 0.08 -0.25 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 1pdr s LYS 466 Cb -0.09 -3.36 0.02 0.00 -1.51 0.00 0.00 37.83 32.89 1pdr s LYS 466 CO 0.03 0.32 -0.05 0.08 -0.36 0.00 0.00 175.35 175.37 1pdr s VAL 467 N 0.29 0.64 -0.26 4.02 1.01 0.16 -4.99 120.40 121.28 1pdr s VAL 467 Ca 0.07 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 1pdr s VAL 467 Cb -0.11 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 1pdr s VAL 467 CO -0.01 0.27 0.05 -0.69 0.00 0.00 0.00 175.10 174.72 1pdr s VAL 468 N 1.29 4.04 -0.02 2.92 1.01 -1.26 -0.35 120.40 128.02 1pdr s VAL 468 Ca -0.05 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1pdr s VAL 468 Cb -0.14 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1pdr s VAL 468 CO -0.02 0.28 -0.06 -0.76 0.00 0.00 0.00 175.10 174.54 1pdr s LEU 469 N 1.56 3.22 -0.07 3.92 1.43 0.03 -4.95 118.68 123.82 1pdr s LEU 469 Ca 0.05 -0.09 0.03 0.00 -1.03 0.00 0.00 54.13 53.10 1pdr s LEU 469 Cb -0.16 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 1pdr s LEU 469 CO 0.02 0.31 -0.17 -1.00 0.23 0.00 0.00 176.35 175.74 1pdr s HIS 470 N -0.95 2.65 0.02 0.29 3.76 -1.26 -0.68 115.29 119.12 1pdr s HIS 470 Ca 0.16 -0.44 0.03 0.00 -0.15 0.00 0.00 55.06 54.66 1pdr s HIS 470 Cb -0.11 -1.67 -0.01 0.00 1.11 0.00 0.00 32.58 31.89 1pdr s HIS 470 CO 0.06 -0.03 -0.09 -0.98 -0.85 0.00 0.00 174.74 172.85 1pdr s ARG 471 N -0.30 0.64 0.00 1.40 1.70 -0.43 -4.78 118.95 117.19 1pdr s ARG 471 Ca 0.02 -0.50 0.18 0.00 -0.47 0.00 0.00 55.73 54.95 1pdr s ARG 471 Cb -0.13 -0.57 -0.18 0.00 -0.57 0.00 0.00 34.95 33.50 1pdr s ARG 471 CO 0.03 0.14 0.76 0.41 -1.08 0.00 0.00 175.30 175.56 1pdr n GLY 472 N 2.30 -0.63 3.23 3.88 0.00 -1.26 -4.67 105.19 108.04 1pdr n GLY 472 Ca -0.17 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 1pdr n GLY 472 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pdr s SER 473 N -2.64 0.61 0.45 1.61 1.04 -1.26 -5.06 113.70 108.45 1pdr s SER 473 Ca 0.07 -1.48 0.21 0.00 0.48 0.00 0.00 55.95 55.23 1pdr s SER 473 Cb 0.13 0.41 1.18 0.00 0.10 0.00 0.00 66.02 67.85 1pdr s SER 473 CO 0.71 -0.89 1.88 0.74 0.98 0.00 0.00 173.24 176.66 1pdr h THR 474 N 2.48 0.66 -3.41 2.02 2.02 -1.98 -3.43 112.91 111.27 1pdr h THR 474 Ca -0.33 -0.10 -0.52 0.00 0.77 0.00 0.00 66.41 66.22 1pdr h THR 474 Cb 1.25 0.34 0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1pdr h THR 474 CO 0.49 0.05 0.59 -0.83 0.37 0.00 0.00 175.52 176.20 1pdr s GLY 475 N -3.87 2.56 -0.01 2.16 0.00 -1.26 -4.94 107.32 101.95 1pdr s GLY 475 Ca -0.07 1.00 0.21 0.00 0.00 0.00 0.00 44.72 45.86 1pdr s GLY 475 CO 0.78 1.96 0.72 1.04 0.00 0.00 0.00 173.10 177.59 1pdr n LEU 476 N 2.70 0.60 0.00 0.66 4.77 -1.26 -4.76 117.00 119.72 1pdr n LEU 476 Ca 0.06 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1pdr n LEU 476 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1pdr n LEU 476 CO 0.56 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 1pdr n GLY 477 N 1.41 0.87 3.32 -0.72 0.00 -1.26 -0.78 105.19 108.03 1pdr n GLY 477 Ca 0.01 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 1pdr n GLY 477 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pdr s PHE 478 N -2.00 0.31 -0.04 1.61 -0.12 -1.26 -0.71 117.98 115.76 1pdr s PHE 478 Ca 0.00 -0.68 0.06 0.00 -0.05 0.00 0.00 56.93 56.25 1pdr s PHE 478 Cb 0.00 -0.03 -0.02 0.00 -0.63 0.00 0.00 43.02 42.34 1pdr s PHE 478 CO 0.00 -0.70 -0.21 1.21 -0.05 0.00 0.00 175.22 175.47 1pdr s ASN 479 N -2.94 3.43 0.04 1.98 3.84 0.54 -4.95 114.94 116.88 1pdr s ASN 479 Ca 0.14 -0.38 0.06 0.00 0.21 0.00 0.00 52.86 52.89 1pdr s ASN 479 Cb 0.03 -0.69 -0.03 0.00 -0.55 0.00 0.00 41.25 40.01 1pdr s ASN 479 CO -0.03 0.30 -0.15 0.27 -2.79 0.00 0.00 177.10 174.71 1pdr s ILE 480 N -0.50 3.05 0.41 -5.21 -4.36 -1.26 -0.23 121.20 113.10 1pdr s ILE 480 Ca 0.06 -1.10 0.04 0.00 -0.26 0.00 0.00 60.65 59.39 1pdr s ILE 480 Cb -0.11 -2.31 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 1pdr s ILE 480 CO 0.01 0.32 0.13 0.68 0.24 0.00 0.00 174.94 176.32 1pdr s VAL 481 N -0.98 0.60 0.00 8.37 -7.23 0.13 -4.88 120.40 116.42 1pdr s VAL 481 Ca 0.16 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.33 1pdr s VAL 481 Cb -0.11 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.48 1pdr s VAL 481 CO 0.07 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 1pdr n GLY 482 N -0.91 -1.82 2.08 2.32 0.00 -1.26 -1.52 105.19 104.08 1pdr n GLY 482 Ca -0.06 -1.66 -0.02 0.00 0.00 0.00 0.00 46.02 44.28 1pdr n GLY 482 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdr n GLY 483 N 0.00 0.56 0.08 -0.02 0.00 -0.91 -4.26 105.19 100.64 1pdr n GLY 483 Ca 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 1pdr n GLY 483 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1pdr h GLU 484 N 0.13 -0.08 -1.98 1.61 5.08 -1.86 -1.64 114.58 115.84 1pdr h GLU 484 Ca -0.04 0.01 -0.52 0.00 -1.00 0.00 0.00 59.36 57.80 1pdr h GLU 484 Cb 0.16 0.02 -0.39 0.00 0.50 0.00 0.00 28.75 29.04 1pdr h GLU 484 CO 0.07 0.10 -1.14 -3.47 -1.00 0.00 0.00 179.01 173.57 1pdr n ASP 485 N -4.81 0.41 -2.12 1.42 2.03 -1.26 -4.95 116.55 107.27 1pdr n ASP 485 Ca -0.03 -2.83 -0.16 0.00 0.52 0.00 0.00 54.79 52.29 1pdr n ASP 485 Cb 0.11 -0.61 -0.03 0.00 -0.72 0.00 0.00 41.12 39.87 1pdr n ASP 485 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pdr n GLY 486 N 0.95 0.15 0.07 0.27 0.00 -1.26 -4.84 105.19 100.53 1pdr n GLY 486 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1pdr n GLY 486 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1pdr n GLU 487 N -2.64 0.26 0.00 1.61 0.00 -1.26 -4.80 120.64 113.81 1pdr n GLU 487 Ca -0.18 -0.15 0.00 0.00 0.00 0.00 0.00 57.16 56.83 1pdr n GLU 487 Cb 0.61 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.55 1pdr n GLU 487 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1pdr n GLY 488 N 1.45 2.33 3.72 -1.84 0.00 -1.23 -4.93 105.19 104.69 1pdr n GLY 488 Ca 0.08 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 43.81 1pdr n GLY 488 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pdr s ILE 489 N -2.85 5.28 0.19 -0.61 1.09 -1.26 -2.13 121.20 120.91 1pdr s ILE 489 Ca 0.00 0.14 0.08 0.00 -1.10 0.00 0.00 60.65 59.77 1pdr s ILE 489 Cb 0.00 -3.39 -0.04 0.00 -1.06 0.00 0.00 42.46 37.96 1pdr s ILE 489 CO 0.00 0.46 -0.17 -0.36 -0.10 0.00 0.00 174.94 174.78 1pdr s PHE 490 N 0.23 1.81 -0.32 3.97 0.40 -0.57 -0.84 117.98 122.64 1pdr s PHE 490 Ca 0.08 -0.50 -0.17 0.00 -0.60 0.00 0.00 56.93 55.73 1pdr s PHE 490 Cb -0.11 -0.86 -0.01 0.00 0.51 0.00 0.00 43.02 42.54 1pdr s PHE 490 CO -0.01 0.38 0.48 0.42 0.70 0.00 0.00 175.22 177.19 1pdr s ILE 491 N -2.51 5.06 -0.11 0.64 1.01 -0.17 -0.69 121.20 124.44 1pdr s ILE 491 Ca 0.20 0.43 0.16 0.00 0.00 0.00 0.00 60.65 61.44 1pdr s ILE 491 Cb -0.03 -3.89 -0.13 0.00 0.01 0.00 0.00 42.46 38.41 1pdr s ILE 491 CO 0.07 -0.10 0.87 0.77 0.00 0.00 0.00 174.94 176.55 1pdr h SER 492 N 8.35 0.00 -4.25 3.58 4.64 -0.94 -1.49 113.55 123.44 1pdr h SER 492 Ca -0.29 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.06 1pdr h SER 492 Cb 1.13 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.00 1pdr h SER 492 CO 0.74 0.64 0.40 0.72 -0.87 0.00 0.00 176.83 178.46 1pdr s PHE 493 N -2.88 -0.50 -0.12 4.77 -0.12 -1.22 -4.83 117.98 113.08 1pdr s PHE 493 Ca -0.02 0.94 -0.05 0.00 -0.05 0.00 0.00 56.93 57.74 1pdr s PHE 493 Cb 0.09 0.41 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 1pdr s PHE 493 CO 0.81 -0.41 0.08 0.42 -0.05 0.00 0.00 175.22 176.06 1pdr s ILE 494 N -0.85 4.96 -0.15 -4.49 -1.09 -1.26 -0.34 121.20 117.97 1pdr s ILE 494 Ca -0.04 0.00 -0.13 0.00 -2.23 0.00 0.00 60.65 58.25 1pdr s ILE 494 Cb -0.01 -3.14 -0.05 0.00 -1.58 0.00 0.00 42.46 37.68 1pdr s ILE 494 CO 0.03 0.59 0.28 -0.76 -1.23 0.00 0.00 174.94 173.85 1pdr s LEU 495 N -0.76 4.27 0.31 2.97 1.43 0.11 -4.97 118.68 122.04 1pdr s LEU 495 Ca 0.13 0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 53.44 1pdr s LEU 495 Cb -0.12 -2.34 -0.11 0.00 0.03 0.00 0.00 46.19 43.65 1pdr s LEU 495 CO 0.03 0.15 1.58 0.00 0.23 0.00 0.00 176.35 178.34 1pdr n ALA 496 N 3.31 2.57 0.00 4.21 0.00 -1.26 -2.64 120.51 126.70 1pdr n ALA 496 Ca -0.13 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1pdr n ALA 496 Cb 0.52 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1pdr n ALA 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdr n GLY 497 N 1.84 2.91 3.89 0.00 0.00 -1.26 -5.02 105.19 107.54 1pdr n GLY 497 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1pdr n GLY 497 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pdr s GLY 498 N -1.51 1.61 0.23 -0.02 0.00 -1.08 -4.72 107.32 101.82 1pdr s GLY 498 Ca 0.00 -0.48 -0.15 0.00 0.00 0.00 0.00 44.72 44.09 1pdr s GLY 498 CO 0.00 -0.05 1.57 -2.55 0.00 0.00 0.00 173.10 172.07 1pdr h PRO 499 N -0.86 -0.04 -0.24 2.90 0.11 -1.86 -0.03 132.00 131.99 1pdr h PRO 499 Ca -0.46 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.70 1pdr h PRO 499 Cb 1.29 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.37 1pdr h PRO 499 CO 0.65 -0.02 -0.02 0.00 -0.21 0.00 0.00 178.00 178.39 1pdr h ALA 500 N 1.52 0.19 0.16 -0.75 0.00 -1.19 -1.02 119.26 118.18 1pdr h ALA 500 Ca 0.36 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 1pdr h ALA 500 Cb 0.61 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1pdr h ALA 500 CO -0.88 -0.44 -0.12 0.22 0.00 0.00 0.00 179.25 178.02 1pdr h ASP 501 N 0.04 -0.32 -0.90 0.00 3.58 -1.31 -2.81 116.42 114.71 1pdr h ASP 501 Ca 0.11 0.03 0.11 0.00 0.42 0.00 0.00 57.03 57.70 1pdr h ASP 501 Cb 0.16 0.11 -0.07 0.00 1.72 0.00 0.00 39.33 41.25 1pdr h ASP 501 CO -0.21 -0.20 0.58 -0.07 -2.88 0.00 0.00 179.24 176.46 1pdr h LEU 502 N -0.29 0.77 -0.54 2.28 3.38 -0.72 -2.01 115.31 118.18 1pdr h LEU 502 Ca -0.01 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1pdr h LEU 502 Cb 0.26 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1pdr h LEU 502 CO -0.01 0.43 0.04 0.77 0.09 0.00 0.00 178.44 179.76 1pdr h SER 503 N 0.84 0.89 0.00 -0.43 4.64 -1.00 -3.47 113.55 115.02 1pdr h SER 503 Ca 0.43 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1pdr h SER 503 Cb 0.50 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1pdr h SER 503 CO -0.19 0.95 0.00 0.61 -0.87 0.00 0.00 176.83 177.33 1pdr n GLY 504 N -0.46 0.57 0.12 -0.77 0.00 -0.76 -4.91 105.19 98.98 1pdr n GLY 504 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 1pdr n GLY 504 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pdr n GLU 505 N -2.85 0.63 -2.77 1.61 1.02 -1.26 -4.97 120.64 112.05 1pdr n GLU 505 Ca 0.00 0.13 -0.38 0.00 -0.02 0.00 0.00 57.16 56.88 1pdr n GLU 505 Cb 0.00 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 29.87 1pdr n GLU 505 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1pdr s LEU 506 N -6.32 4.45 0.24 -4.62 1.43 -1.26 -4.99 118.68 107.62 1pdr s LEU 506 Ca -0.30 1.88 -0.09 0.00 -1.03 0.00 0.00 54.13 54.59 1pdr s LEU 506 Cb 0.08 -3.87 -0.02 0.00 0.03 0.00 0.00 46.19 42.42 1pdr s LEU 506 CO 0.58 0.02 0.37 0.00 0.23 0.00 0.00 176.35 177.54 1pdr s ARG 507 N -1.73 1.45 0.16 1.70 1.70 -1.26 -4.89 118.95 116.08 1pdr s ARG 507 Ca 0.47 -1.39 -0.31 0.00 -0.47 0.00 0.00 55.73 54.02 1pdr s ARG 507 Cb -0.21 0.41 -0.09 0.00 -0.57 0.00 0.00 34.95 34.48 1pdr s ARG 507 CO 0.27 -0.57 1.50 0.21 -1.08 0.00 0.00 175.30 175.63 1pdr s LYS 508 N -4.02 4.25 0.00 3.89 2.20 -1.26 -2.21 119.74 122.59 1pdr s LYS 508 Ca 0.28 2.26 0.00 0.00 -0.36 0.00 0.00 55.97 58.15 1pdr s LYS 508 Cb 0.02 -3.18 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1pdr s LYS 508 CO 0.10 -0.54 0.00 0.41 -0.36 0.00 0.00 175.35 174.97 1pdr n GLY 509 N 3.55 2.07 3.77 5.54 0.00 -0.56 -4.93 105.19 114.63 1pdr n GLY 509 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1pdr n GLY 509 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pdr s ASP 510 N -1.64 6.70 -0.08 1.61 1.01 -0.94 -2.63 116.67 120.70 1pdr s ASP 510 Ca 0.00 2.45 0.00 0.00 0.71 0.00 0.00 52.55 55.71 1pdr s ASP 510 Cb 0.00 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 1pdr s ASP 510 CO 0.00 -0.56 -0.06 -0.60 0.21 0.00 0.00 175.17 174.16 1pdr s ARG 511 N -2.01 2.91 -0.47 8.23 3.52 0.17 -1.00 118.95 130.30 1pdr s ARG 511 Ca 0.53 -0.54 -0.19 0.00 -0.13 0.00 0.00 55.73 55.39 1pdr s ARG 511 Cb -0.34 -2.65 0.04 0.00 -1.56 0.00 0.00 34.95 30.45 1pdr s ARG 511 CO 0.44 0.59 0.61 0.42 -0.81 0.00 0.00 175.30 176.54 1pdr s ILE 512 N -0.60 4.88 0.03 4.11 1.01 -0.02 -0.77 121.20 129.83 1pdr s ILE 512 Ca 0.09 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.29 1pdr s ILE 512 Cb -0.12 -4.23 -0.17 0.00 0.01 0.00 0.00 42.46 37.95 1pdr s ILE 512 CO 0.02 -0.68 1.24 0.40 0.00 0.00 0.00 174.94 175.92 1pdr h ILE 513 N 5.85 1.39 -3.18 2.92 1.08 -1.14 -3.39 117.51 121.04 1pdr h ILE 513 Ca -0.27 -1.66 -0.03 0.00 -0.39 0.00 0.00 64.86 62.52 1pdr h ILE 513 Cb 1.10 2.16 -0.12 0.00 -3.07 0.00 0.00 36.82 36.89 1pdr h ILE 513 CO 0.92 0.49 0.09 -0.94 -0.69 0.00 0.00 178.15 178.01 1pdr s SER 514 N -6.42 -0.40 -0.20 1.72 1.04 -1.17 -0.55 113.70 107.71 1pdr s SER 514 Ca -0.14 -0.20 -0.03 0.00 0.48 0.00 0.00 55.95 56.06 1pdr s SER 514 Cb 0.05 0.56 0.07 0.00 0.10 0.00 0.00 66.02 66.79 1pdr s SER 514 CO 0.79 -0.96 0.06 -0.69 0.98 0.00 0.00 173.24 173.42 1pdr s VAL 515 N -3.79 0.36 -1.06 5.02 1.01 -0.90 -1.78 120.40 119.26 1pdr s VAL 515 Ca 0.03 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.36 1pdr s VAL 515 Cb -0.00 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 1pdr s VAL 515 CO -0.10 -0.29 0.84 0.59 0.00 0.00 0.00 175.10 176.14 1pdr n ASN 516 N 5.10 -6.14 0.00 3.32 4.13 -0.00 -2.50 115.26 119.17 1pdr n ASN 516 Ca -0.08 -0.80 0.00 0.00 1.68 0.00 0.00 54.58 55.38 1pdr n ASN 516 Cb 0.47 -4.34 0.00 0.00 -1.54 0.00 0.00 39.78 34.37 1pdr n ASN 516 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1pdr n SER 517 N -2.85 0.00 -4.64 6.41 3.41 -1.26 -4.92 113.62 109.77 1pdr n SER 517 Ca -0.08 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.11 1pdr n SER 517 Cb 0.60 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1pdr n SER 517 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1pdr s VAL 518 N 0.00 3.12 -0.16 -3.33 1.01 -1.04 -4.92 120.40 115.08 1pdr s VAL 518 Ca 0.00 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 1pdr s VAL 518 Cb 0.00 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 1pdr s VAL 518 CO 0.00 -0.04 1.38 -0.62 0.00 0.00 0.00 175.10 175.82 1pdr s ASP 519 N 5.68 6.81 0.00 3.32 2.15 -1.26 -2.12 116.67 131.25 1pdr s ASP 519 Ca 0.90 1.74 0.13 0.00 0.43 0.00 0.00 52.55 55.75 1pdr s ASP 519 Cb -0.37 -2.54 0.31 0.00 -0.30 0.00 0.00 42.92 40.02 1pdr s ASP 519 CO 0.37 -0.87 1.21 0.18 -0.17 0.00 0.00 175.17 175.90 1pdr n LEU 520 N 6.99 2.88 -0.06 -1.34 4.77 0.28 -4.64 117.00 125.88 1pdr n LEU 520 Ca 0.15 -1.74 -0.11 0.00 -0.03 0.00 0.00 56.01 54.28 1pdr n LEU 520 Cb 0.45 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1pdr n LEU 520 CO 0.59 0.68 0.58 0.03 -1.33 0.00 0.00 177.39 177.94 1pdr h ARG 521 N 2.56 -0.39 -0.65 3.23 3.08 -1.72 -2.24 114.38 118.25 1pdr h ARG 521 Ca 0.00 0.03 -0.39 0.00 0.07 0.00 0.00 59.98 59.69 1pdr h ARG 521 Cb 0.73 0.09 -0.23 0.00 0.08 0.00 0.00 29.97 30.64 1pdr h ARG 521 CO 0.00 -0.26 0.12 0.00 -1.07 0.00 0.00 179.97 178.75 1pdr n ALA 522 N -3.00 5.04 -1.94 0.04 0.00 -1.26 -3.54 120.51 115.85 1pdr n ALA 522 Ca -0.02 -3.26 -0.30 0.00 0.00 0.00 0.00 53.44 49.86 1pdr n ALA 522 Cb 0.36 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.83 1pdr n ALA 522 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pdr s ALA 523 N -3.42 3.08 0.26 0.00 0.00 -0.84 -4.75 121.76 116.09 1pdr s ALA 523 Ca 0.52 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1pdr s ALA 523 Cb 0.44 -2.95 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1pdr s ALA 523 CO 0.02 -0.83 0.44 -1.54 0.00 0.00 0.00 175.76 173.85 1pdr s SER 524 N -4.25 6.35 0.28 0.00 1.04 -1.26 -4.48 113.70 111.37 1pdr s SER 524 Ca 0.55 0.39 0.02 0.00 0.48 0.00 0.00 55.95 57.39 1pdr s SER 524 Cb -0.11 -2.00 0.63 0.00 0.10 0.00 0.00 66.02 64.64 1pdr s SER 524 CO 0.51 -0.13 1.75 -0.74 0.98 0.00 0.00 173.24 175.61 1pdr h HIS 525 N 1.48 0.80 -0.48 5.02 2.76 -1.47 0.64 115.15 123.90 1pdr h HIS 525 Ca -0.49 0.04 0.01 0.00 -2.20 0.00 0.00 60.37 57.72 1pdr h HIS 525 Cb 1.20 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.92 1pdr h HIS 525 CO 0.53 0.13 0.32 1.49 -1.30 0.00 0.00 177.93 179.09 1pdr h GLU 526 N 0.59 0.61 0.07 5.26 4.81 -1.93 -0.64 114.58 123.35 1pdr h GLU 526 Ca 0.51 -0.04 -0.28 0.00 -0.13 0.00 0.00 59.36 59.43 1pdr h GLU 526 Cb 0.82 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 30.08 1pdr h GLU 526 CO -0.41 0.40 -1.15 1.96 -0.73 0.00 0.00 179.01 179.08 1pdr h GLN 527 N 0.63 0.62 -0.53 1.92 4.20 -1.31 -2.27 115.11 118.36 1pdr h GLN 527 Ca 0.18 -0.76 -0.00 0.00 0.06 0.00 0.00 58.65 58.13 1pdr h GLN 527 Cb -0.05 0.24 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 1pdr h GLN 527 CO -0.04 1.33 0.33 0.00 -0.67 0.00 0.00 178.83 179.78 1pdr h ALA 528 N 0.39 0.68 -0.77 3.87 0.00 -0.63 -0.23 119.26 122.57 1pdr h ALA 528 Ca -0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1pdr h ALA 528 Cb 1.81 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 19.35 1pdr h ALA 528 CO 0.22 0.16 0.44 0.00 0.00 0.00 0.00 179.25 180.07 1pdr h ALA 529 N 1.17 0.98 -0.46 0.00 0.00 -1.12 -1.69 119.26 118.14 1pdr h ALA 529 Ca 0.19 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 1pdr h ALA 529 Cb -0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1pdr h ALA 529 CO -0.04 0.47 -0.26 0.00 0.00 0.00 0.00 179.25 179.42 1pdr h ALA 530 N 1.23 0.65 -0.15 0.00 0.00 -0.97 -1.05 119.26 118.98 1pdr h ALA 530 Ca 0.27 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pdr h ALA 530 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1pdr h ALA 530 CO -0.05 0.67 0.09 0.00 0.00 0.00 0.00 179.25 179.96 1pdr h ALA 531 N 0.84 0.19 -0.42 0.00 0.00 -0.70 -2.04 119.26 117.13 1pdr h ALA 531 Ca 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1pdr h ALA 531 Cb 0.85 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1pdr h ALA 531 CO 0.08 -0.30 0.21 -0.07 0.00 0.00 0.00 179.25 179.17 1pdr h LEU 532 N 0.16 0.54 -1.32 0.00 3.38 -1.28 -2.09 115.31 114.69 1pdr h LEU 532 Ca 0.05 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.00 1pdr h LEU 532 Cb 0.03 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 1pdr h LEU 532 CO -0.01 0.50 0.52 0.50 0.09 0.00 0.00 178.44 180.04 1pdr h LYS 533 N 0.54 0.75 -0.65 1.13 3.64 -0.91 -2.67 116.57 118.41 1pdr h LYS 533 Ca 0.15 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1pdr h LYS 533 Cb 0.09 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1pdr h LYS 533 CO -0.02 0.50 0.00 0.09 -2.27 0.00 0.00 179.45 177.75 1pdr n ASN 534 N -4.50 3.77 0.00 4.20 3.02 -0.79 -4.51 115.26 116.45 1pdr n ASN 534 Ca 0.13 -2.02 0.05 0.00 -0.03 0.00 0.00 54.58 52.71 1pdr n ASN 534 Cb 0.30 -0.44 0.22 0.00 -0.61 0.00 0.00 39.78 39.26 1pdr n ASN 534 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pdr n ALA 535 N 1.37 1.50 0.00 5.41 0.00 -0.81 -4.98 120.51 123.00 1pdr n ALA 535 Ca 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1pdr n ALA 535 Cb 0.59 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1pdr n ALA 535 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdr n GLY 536 N -0.44 -1.13 0.08 0.00 0.00 -1.26 -4.27 105.19 98.16 1pdr n GLY 536 Ca 0.03 -1.26 -0.07 0.00 0.00 0.00 0.00 46.02 44.72 1pdr n GLY 536 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1pdr h GLN 537 N 0.00 0.00 -4.60 1.61 4.20 -1.94 -3.43 115.11 110.95 1pdr h GLN 537 Ca 0.00 0.00 -0.71 0.00 0.06 0.00 0.00 58.65 58.00 1pdr h GLN 537 Cb 0.00 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 27.53 1pdr h GLN 537 CO 0.00 0.61 -0.53 0.00 -0.67 0.00 0.00 178.83 178.24 1pdr s ALA 538 N -2.68 3.23 -0.25 3.87 0.00 -1.26 -1.31 121.76 123.36 1pdr s ALA 538 Ca -0.03 -1.74 -0.06 0.00 0.00 0.00 0.00 51.96 50.14 1pdr s ALA 538 Cb 0.09 -2.54 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 1pdr s ALA 538 CO 0.82 -1.39 0.02 0.08 0.00 0.00 0.00 175.76 175.29 1pdr s VAL 539 N 1.52 3.79 -0.50 0.00 1.01 0.14 -4.96 120.40 121.41 1pdr s VAL 539 Ca 0.01 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 1pdr s VAL 539 Cb -0.19 -2.81 0.09 0.00 0.00 0.00 0.00 36.38 33.47 1pdr s VAL 539 CO 0.06 0.30 0.46 -0.89 0.00 0.00 0.00 175.10 175.03 1pdr s THR 540 N 1.52 5.18 -0.13 3.92 2.01 -1.26 -0.79 115.64 126.09 1pdr s THR 540 Ca 0.05 -1.12 -0.06 0.00 0.31 0.00 0.00 61.69 60.87 1pdr s THR 540 Cb -0.15 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 1pdr s THR 540 CO 0.00 -0.70 0.08 -0.63 -0.69 0.00 0.00 174.62 172.68 1pdr s ILE 541 N 1.77 5.01 -0.31 1.82 1.01 0.52 -0.82 121.20 130.19 1pdr s ILE 541 Ca 0.05 0.03 -0.04 0.00 0.00 0.00 0.00 60.65 60.69 1pdr s ILE 541 Cb -0.25 -3.19 0.04 0.00 0.01 0.00 0.00 42.46 39.07 1pdr s ILE 541 CO 0.06 0.57 0.05 -0.69 0.00 0.00 0.00 174.94 174.93 1pdr s VAL 542 N -0.59 3.37 0.22 2.92 1.01 -0.73 0.39 120.40 126.99 1pdr s VAL 542 Ca 0.11 -1.23 0.10 0.00 0.00 0.00 0.00 61.98 60.96 1pdr s VAL 542 Cb -0.12 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 1pdr s VAL 542 CO 0.02 -0.12 -0.10 0.00 0.00 0.00 0.00 175.10 174.90 1pdr s ALA 543 N 1.33 2.92 -0.06 5.51 0.00 -0.09 -0.55 121.76 130.83 1pdr s ALA 543 Ca -0.03 -1.59 -0.01 0.00 0.00 0.00 0.00 51.96 50.33 1pdr s ALA 543 Cb -0.19 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.32 1pdr s ALA 543 CO 0.01 0.39 -0.00 -1.14 0.00 0.00 0.00 175.76 175.01 1pdr s GLN 544 N -3.11 0.60 -0.58 0.00 0.74 0.05 -0.58 119.66 116.78 1pdr s GLN 544 Ca 0.27 0.08 -0.28 0.00 0.05 0.00 0.00 55.36 55.48 1pdr s GLN 544 Cb -0.08 -0.91 0.02 0.00 1.10 0.00 0.00 33.01 33.14 1pdr s GLN 544 CO 0.16 -0.26 1.37 -0.47 -0.55 0.00 0.00 175.29 175.53 1pdr s TYR 545 N 1.77 2.34 -0.42 1.67 5.04 -1.26 -0.66 117.35 125.83 1pdr s TYR 545 Ca 0.02 0.43 0.03 0.00 -2.44 0.00 0.00 57.07 55.11 1pdr s TYR 545 Cb -0.13 -4.43 0.16 0.00 0.35 0.00 0.00 41.96 37.91 1pdr s TYR 545 CO -0.04 -1.91 0.31 -0.98 -1.34 0.00 0.00 175.55 171.58 1pdr s ARG 546 N 5.43 0.98 0.11 4.97 1.70 -1.08 -4.64 118.95 126.42 1pdr s ARG 546 Ca 0.50 -1.99 -0.16 0.00 -0.47 0.00 0.00 55.73 53.60 1pdr s ARG 546 Cb -0.10 -1.65 -0.04 0.00 -0.57 0.00 0.00 34.95 32.60 1pdr s ARG 546 CO 0.24 -1.31 1.58 -1.00 -1.08 0.00 0.00 175.30 173.74 1pdr h PRO 547 N 6.10 0.59 -0.58 3.89 0.13 -1.92 -2.86 132.00 137.35 1pdr h PRO 547 Ca 0.17 -0.16 0.12 0.00 -0.87 0.00 0.00 66.00 65.26 1pdr h PRO 547 Cb 0.91 -0.07 -0.10 0.00 0.13 0.00 0.00 31.00 31.87 1pdr h PRO 547 CO 0.38 0.67 -0.08 0.93 -0.23 0.00 0.00 178.00 179.67 1pdr h GLU 548 N 0.42 0.04 -0.54 0.86 3.07 -1.94 0.22 114.58 116.71 1pdr h GLU 548 Ca 0.11 -0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.87 1pdr h GLU 548 Cb 0.37 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 1pdr h GLU 548 CO 0.01 0.03 -0.02 1.49 -1.40 0.00 0.00 179.01 179.12 1pdr h GLU 549 N 0.05 0.98 -0.07 2.33 4.81 -1.96 0.19 114.58 120.91 1pdr h GLU 549 Ca 0.29 -0.32 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1pdr h GLU 549 Cb 0.45 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1pdr h GLU 549 CO -0.55 0.99 -0.04 -0.92 -0.73 0.00 0.00 179.01 177.76 1pdr h TYR 550 N 0.85 -0.10 0.23 0.92 3.20 -0.82 0.44 116.97 121.70 1pdr h TYR 550 Ca 0.15 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 1pdr h TYR 550 Cb 0.57 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.89 1pdr h TYR 550 CO 0.04 -0.07 -0.14 0.77 -1.64 0.00 0.00 178.16 177.13 1pdr h SER 551 N -0.04 -0.34 -1.70 -2.11 0.02 -0.46 0.39 113.55 109.30 1pdr h SER 551 Ca 0.04 0.02 0.51 0.00 -0.84 0.00 0.00 61.79 61.52 1pdr h SER 551 Cb 0.11 0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.66 1pdr h SER 551 CO -0.10 -0.21 1.21 -1.14 -1.14 0.00 0.00 176.83 175.45 1pdr n ARG 552 N -3.06 -0.01 -0.02 3.45 0.63 0.64 -0.80 116.66 117.50 1pdr n ARG 552 Ca -0.04 1.01 0.03 0.00 -0.92 0.00 0.00 57.85 57.94 1pdr n ARG 552 Cb 0.14 -2.27 -0.10 0.00 0.45 0.00 0.00 32.46 30.68 1pdr n ARG 552 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1pdr n GLN 553 N -3.89 0.82 0.00 -0.14 -0.06 0.13 -4.87 117.38 109.38 1pdr n GLN 553 Ca 0.40 -0.09 0.00 0.00 -2.00 0.00 0.00 57.00 55.31 1pdr n GLN 553 Cb 1.77 -1.31 0.00 0.00 -4.06 0.00 0.00 30.24 26.64 1pdr n GLN 553 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 1pdr n HIS 554 N -2.08 0.00 0.79 3.69 8.25 0.13 -5.07 115.22 120.93 1pdr n HIS 554 Ca -0.07 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.49 1pdr n HIS 554 Cb 0.48 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.67 1pdr n HIS 554 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98