#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zla s HIS 439 N 0.00 2.80 -0.29 6.00 2.46 -1.26 -5.06 115.29 119.94 1zla s HIS 439 Ca 0.00 1.51 -0.03 0.00 0.47 0.00 0.00 55.06 57.01 1zla s HIS 439 Cb 0.00 -3.01 0.19 0.00 -0.13 0.00 0.00 32.58 29.63 1zla s HIS 439 CO 0.00 -1.52 0.82 0.50 -2.47 0.00 0.00 174.74 172.07 1zla s ARG 440 N -4.70 0.36 0.27 2.88 3.52 -1.26 -5.14 118.95 114.87 1zla s ARG 440 Ca 0.61 0.40 -0.30 0.00 -0.13 0.00 0.00 55.73 56.31 1zla s ARG 440 Cb -0.17 0.19 -0.11 0.00 -1.56 0.00 0.00 34.95 33.30 1zla s ARG 440 CO 0.51 -0.62 1.60 0.71 -0.81 0.00 0.00 175.30 176.69 1zla s TYR 441 N 2.89 2.81 0.61 5.12 1.51 -1.26 -4.96 117.35 124.07 1zla s TYR 441 Ca 0.17 0.71 -0.18 0.00 -1.01 0.00 0.00 57.07 56.77 1zla s TYR 441 Cb -0.07 -4.06 -0.03 0.00 -0.11 0.00 0.00 41.96 37.69 1zla s TYR 441 CO -0.23 -3.65 1.17 1.03 -1.11 0.00 0.00 175.55 172.76 1zla s ARG 442 N -0.13 2.95 0.25 -0.62 0.52 -1.26 -4.88 118.95 115.78 1zla s ARG 442 Ca 0.65 1.68 -0.28 0.00 -0.52 0.00 0.00 55.73 57.26 1zla s ARG 442 Cb -0.48 -1.94 -0.16 0.00 0.52 0.00 0.00 34.95 32.89 1zla s ARG 442 CO 0.44 -1.19 0.68 -2.30 0.02 0.00 0.00 175.30 172.96 1zla n PRO 443 N -1.80 0.50 -0.05 3.54 -0.02 -1.26 -1.64 135.00 134.27 1zla n PRO 443 Ca 0.12 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1zla n PRO 443 Cb 0.50 -1.32 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 1zla n PRO 443 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zla n GLY 444 N 1.72 2.47 0.17 -1.23 0.00 -1.26 -4.88 105.19 102.19 1zla n GLY 444 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1zla n GLY 444 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1zla h THR 445 N 0.00 1.29 0.10 2.61 2.02 -1.65 -2.81 112.91 114.47 1zla h THR 445 Ca 0.00 -2.46 -0.26 0.00 0.77 0.00 0.00 66.41 64.46 1zla h THR 445 Cb 0.00 2.67 0.01 0.00 -1.74 0.00 0.00 68.15 69.09 1zla h THR 445 CO 0.00 0.75 -1.16 0.58 0.37 0.00 0.00 175.52 176.06 1zla h VAL 446 N 0.28 1.44 -0.77 3.16 2.07 -1.90 -2.05 116.25 118.48 1zla h VAL 446 Ca -0.18 -2.79 -0.02 0.00 0.82 0.00 0.00 66.70 64.53 1zla h VAL 446 Cb 1.90 2.76 -0.04 0.00 -1.52 0.00 0.00 31.29 34.39 1zla h VAL 446 CO 0.23 0.82 0.41 0.00 0.02 0.00 0.00 177.57 179.06 1zla h ALA 447 N 0.58 1.27 -0.23 1.67 0.00 -1.94 0.44 119.26 121.04 1zla h ALA 447 Ca -0.13 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1zla h ALA 447 Cb 1.85 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1zla h ALA 447 CO 0.20 0.59 -0.26 1.25 0.00 0.00 0.00 179.25 181.02 1zla h LEU 448 N 1.08 0.45 -0.08 0.00 5.85 -1.47 0.86 115.31 122.00 1zla h LEU 448 Ca 0.27 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1zla h LEU 448 Cb 0.05 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 1zla h LEU 448 CO -0.04 0.71 0.00 -0.09 -0.34 0.00 0.00 178.44 178.68 1zla h ARG 449 N 0.40 0.15 -0.56 1.25 2.43 -0.15 -2.32 114.38 115.58 1zla h ARG 449 Ca 0.06 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1zla h ARG 449 Cb 0.68 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1zla h ARG 449 CO 0.05 0.40 0.24 0.93 -1.51 0.00 0.00 179.97 180.08 1zla h GLU 450 N -0.12 0.82 -0.58 0.20 5.08 0.04 -0.46 114.58 119.55 1zla h GLU 450 Ca 0.02 -0.14 0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1zla h GLU 450 Cb 0.33 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.38 1zla h GLU 450 CO 0.00 0.70 0.21 0.82 -1.00 0.00 0.00 179.01 179.74 1zla h ILE 451 N 0.76 0.79 -0.10 3.13 1.08 -0.75 0.23 117.51 122.65 1zla h ILE 451 Ca 0.19 -0.13 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 1zla h ILE 451 Cb 0.17 0.36 -0.03 0.00 -3.07 0.00 0.00 36.82 34.25 1zla h ILE 451 CO -0.02 0.07 -0.07 0.03 -0.69 0.00 0.00 178.15 177.47 1zla h ARG 452 N 0.39 -0.07 0.17 2.37 2.47 -0.82 -2.37 114.38 116.52 1zla h ARG 452 Ca 0.29 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 59.01 1zla h ARG 452 Cb 0.34 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 1zla h ARG 452 CO -0.29 -0.05 -0.20 -0.09 0.56 0.00 0.00 179.97 179.90 1zla h ARG 453 N -0.08 -0.37 0.00 0.04 2.43 0.59 -3.10 114.38 113.90 1zla h ARG 453 Ca 0.06 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1zla h ARG 453 Cb 0.17 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1zla h ARG 453 CO -0.14 -0.25 -0.00 1.88 -1.51 0.00 0.00 179.97 179.95 1zla h TYR 454 N -0.38 0.00 -0.01 2.20 -1.99 -0.65 -0.35 116.97 115.79 1zla h TYR 454 Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1zla h TYR 454 Cb 0.34 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.07 1zla h TYR 454 CO -0.18 0.00 -0.01 1.04 -0.00 0.00 0.00 178.16 179.02 1zla n GLN 455 N -3.16 1.27 -0.12 4.88 6.02 -0.89 -3.65 117.38 121.72 1zla n GLN 455 Ca -0.02 -0.42 -0.18 0.00 -0.01 0.00 0.00 57.00 56.36 1zla n GLN 455 Cb 0.11 -1.49 -0.12 0.00 1.02 0.00 0.00 30.24 29.76 1zla n GLN 455 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1zla n LYS 456 N -0.50 0.66 -2.34 -1.09 4.81 -0.16 -5.01 118.16 114.54 1zla n LYS 456 Ca 0.21 0.16 -0.26 0.00 -0.87 0.00 0.00 58.31 57.55 1zla n LYS 456 Cb 0.22 -1.53 0.13 0.00 0.02 0.00 0.00 35.03 33.88 1zla n LYS 456 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1zla s SER 457 N -6.57 3.93 0.00 3.14 1.04 -1.12 -5.06 113.70 109.06 1zla s SER 457 Ca -0.34 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 55.98 1zla s SER 457 Cb 0.09 -0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.04 1zla s SER 457 CO 0.61 -2.16 0.00 0.35 0.98 0.00 0.00 173.24 173.02 1zla n THR 458 N -3.17 0.00 -1.61 2.02 -2.24 -1.26 -4.97 114.28 103.06 1zla n THR 458 Ca 0.15 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.38 1zla n THR 458 Cb 0.60 0.62 0.02 0.00 -2.10 0.00 0.00 70.33 69.47 1zla n THR 458 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1zla n GLU 459 N -0.90 1.27 -1.89 -0.78 -0.00 -1.26 -4.94 120.64 112.15 1zla n GLU 459 Ca 0.00 0.46 -0.37 0.00 -0.00 0.00 0.00 57.16 57.25 1zla n GLU 459 Cb 0.00 -2.05 0.04 0.00 -0.00 0.00 0.00 31.44 29.42 1zla n GLU 459 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1zla s LEU 460 N -0.69 3.79 0.00 -1.84 1.43 -1.26 -4.94 118.68 115.16 1zla s LEU 460 Ca 0.65 2.60 0.14 0.00 -1.03 0.00 0.00 54.13 56.49 1zla s LEU 460 Cb -0.53 -4.40 -0.01 0.00 0.03 0.00 0.00 46.19 41.28 1zla s LEU 460 CO 0.55 -1.56 0.76 0.18 0.23 0.00 0.00 176.35 176.51 1zla n LEU 461 N -1.22 1.42 -4.79 1.79 4.77 -1.26 -4.92 117.00 112.79 1zla n LEU 461 Ca 0.12 -0.75 -0.36 0.00 -0.03 0.00 0.00 56.01 54.99 1zla n LEU 461 Cb 0.47 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 1zla n LEU 461 CO 0.49 0.28 -0.18 -0.63 -1.33 0.00 0.00 177.39 176.02 1zla s ILE 462 N -1.72 5.43 0.21 -0.08 1.01 -1.26 -5.04 121.20 119.74 1zla s ILE 462 Ca 0.11 0.19 -0.32 0.00 0.00 0.00 0.00 60.65 60.63 1zla s ILE 462 Cb 0.11 -3.43 -0.12 0.00 0.01 0.00 0.00 42.46 39.03 1zla s ILE 462 CO 0.36 0.51 1.70 -0.13 0.00 0.00 0.00 174.94 177.38 1zla s ARG 463 N -0.19 4.13 0.17 2.79 3.00 -1.26 -4.91 118.95 122.67 1zla s ARG 463 Ca 0.11 2.59 -0.17 0.00 0.00 0.00 0.00 55.73 58.25 1zla s ARG 463 Cb -0.11 -3.08 0.09 0.00 0.00 0.00 0.00 34.95 31.85 1zla s ARG 463 CO 0.00 -0.73 1.66 0.87 0.00 0.00 0.00 175.30 177.10 1zla h LYS 464 N 6.63 -0.03 -0.39 3.54 1.57 -1.97 -2.74 116.57 123.19 1zla h LYS 464 Ca -0.43 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.31 1zla h LYS 464 Cb 1.20 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 1zla h LYS 464 CO 0.94 -0.02 0.11 1.25 -0.57 0.00 0.00 179.45 181.16 1zla h LEU 465 N -0.03 0.58 -0.25 2.94 5.85 -1.97 0.51 115.31 122.94 1zla h LEU 465 Ca 0.19 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1zla h LEU 465 Cb 0.32 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1zla h LEU 465 CO -0.42 0.65 0.13 -0.65 -0.34 0.00 0.00 178.44 177.81 1zla h PRO 466 N 0.49 0.27 -0.06 5.25 0.11 -1.95 0.53 132.00 136.64 1zla h PRO 466 Ca 0.12 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.25 1zla h PRO 466 Cb 0.28 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 31.29 1zla h PRO 466 CO -0.00 0.18 -0.19 0.35 -0.21 0.00 0.00 178.00 178.13 1zla h PHE 467 N 0.28 -0.49 -0.82 0.65 3.57 -1.23 -0.25 116.94 118.65 1zla h PHE 467 Ca 0.10 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.82 1zla h PHE 467 Cb 0.02 0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1zla h PHE 467 CO -0.09 -0.27 0.56 0.37 -2.23 0.00 0.00 178.31 176.65 1zla h GLN 468 N -0.28 0.28 -0.02 1.11 4.15 0.62 0.09 115.11 121.06 1zla h GLN 468 Ca 0.08 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.44 1zla h GLN 468 Cb 0.38 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.01 1zla h GLN 468 CO -0.22 0.19 -0.12 0.00 -1.93 0.00 0.00 178.83 176.75 1zla h ARG 469 N 0.29 0.12 -1.00 1.69 3.08 0.61 -3.01 114.38 116.17 1zla h ARG 469 Ca 0.41 -0.10 0.10 0.00 0.07 0.00 0.00 59.98 60.47 1zla h ARG 469 Cb 1.17 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 31.16 1zla h ARG 469 CO -0.11 0.76 0.64 1.25 -1.07 0.00 0.00 179.97 181.43 1zla h LEU 470 N -0.49 0.96 0.54 3.04 5.85 0.18 0.08 115.31 125.46 1zla h LEU 470 Ca -0.01 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1zla h LEU 470 Cb 0.79 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.66 1zla h LEU 470 CO 0.02 0.55 -0.26 0.58 -0.34 0.00 0.00 178.44 178.99 1zla h VAL 471 N 1.05 0.40 -0.74 1.05 2.07 -1.08 -1.86 116.25 117.13 1zla h VAL 471 Ca 0.47 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.78 1zla h VAL 471 Cb 0.39 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1zla h VAL 471 CO -0.23 0.04 0.42 0.03 0.02 0.00 0.00 177.57 177.85 1zla h ARG 472 N -0.92 0.74 -0.24 1.57 3.08 -1.35 -0.62 114.38 116.65 1zla h ARG 472 Ca -0.07 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 59.98 1zla h ARG 472 Cb 0.62 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.46 1zla h ARG 472 CO 0.12 0.49 -0.07 1.49 -1.07 0.00 0.00 179.97 180.93 1zla h GLU 473 N 0.76 -0.02 -0.55 0.04 4.81 -0.92 0.19 114.58 118.89 1zla h GLU 473 Ca 0.34 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.50 1zla h GLU 473 Cb 0.23 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1zla h GLU 473 CO -0.20 -0.01 0.07 0.82 -0.73 0.00 0.00 179.01 178.95 1zla h ILE 474 N -0.02 1.24 -0.06 2.32 2.04 -0.76 -2.85 117.51 119.42 1zla h ILE 474 Ca 0.12 -0.96 -0.14 0.00 1.00 0.00 0.00 64.86 64.88 1zla h ILE 474 Cb 0.20 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1zla h ILE 474 CO -0.26 0.35 -0.58 0.00 0.00 0.00 0.00 178.15 177.67 1zla h ALA 475 N 1.23 0.91 0.00 1.87 0.00 -0.47 -2.88 119.26 119.92 1zla h ALA 475 Ca 0.17 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1zla h ALA 475 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1zla h ALA 475 CO 0.01 0.71 0.19 0.37 0.00 0.00 0.00 179.25 180.54 1zla h GLN 476 N 0.15 0.00 -0.01 0.00 5.75 -0.39 0.61 115.11 121.22 1zla h GLN 476 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1zla h GLN 476 Cb 1.06 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.61 1zla h GLN 476 CO 0.09 0.00 -0.15 -0.25 -2.65 0.00 0.00 178.83 175.87 1zla n ASP 477 N -2.53 0.77 -0.04 -0.69 10.43 -1.09 -3.91 116.55 119.50 1zla n ASP 477 Ca -0.02 -0.80 -0.03 0.00 2.57 0.00 0.00 54.79 56.51 1zla n ASP 477 Cb 0.23 0.02 -0.08 0.00 1.84 0.00 0.00 41.12 43.12 1zla n ASP 477 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1zla n PHE 478 N -0.72 0.00 -3.64 1.24 3.01 0.21 -4.99 117.46 112.56 1zla n PHE 478 Ca 0.14 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.54 1zla n PHE 478 Cb 0.31 -0.47 -0.07 0.00 -0.01 0.00 0.00 39.48 39.24 1zla n PHE 478 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1zla s LYS 479 N -2.33 0.64 0.63 -1.08 2.20 -0.92 -5.16 119.74 113.72 1zla s LYS 479 Ca -0.05 1.12 -0.14 0.00 -0.36 0.00 0.00 55.97 56.54 1zla s LYS 479 Cb 0.04 0.14 -0.02 0.00 -1.51 0.00 0.00 37.83 36.47 1zla s LYS 479 CO 0.43 -0.14 1.05 0.95 -0.36 0.00 0.00 175.35 177.28 1zla s THR 480 N 1.60 3.98 -0.37 3.43 -4.23 -1.26 -4.22 115.64 114.57 1zla s THR 480 Ca -0.10 0.81 -0.28 0.00 -1.18 0.00 0.00 61.69 60.94 1zla s THR 480 Cb -0.05 -3.43 0.04 0.00 1.34 0.00 0.00 72.50 70.40 1zla s THR 480 CO -0.19 -0.68 0.53 -0.67 -0.54 0.00 0.00 174.62 173.07 1zla n ASP 481 N -2.45 -6.16 -4.53 3.99 2.03 -1.26 -5.01 116.55 103.16 1zla n ASP 481 Ca 0.08 0.10 -0.25 0.00 0.52 0.00 0.00 54.79 55.24 1zla n ASP 481 Cb 0.53 -2.38 -0.11 0.00 -0.72 0.00 0.00 41.12 38.45 1zla n ASP 481 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1zla s LEU 482 N -2.22 2.71 0.01 -2.67 1.43 -1.26 -5.15 118.68 111.53 1zla s LEU 482 Ca 0.29 -1.21 0.02 0.00 -1.03 0.00 0.00 54.13 52.20 1zla s LEU 482 Cb -0.04 -0.95 -0.01 0.00 0.03 0.00 0.00 46.19 45.22 1zla s LEU 482 CO 0.72 -0.23 -0.05 -0.13 0.23 0.00 0.00 176.35 176.88 1zla s ARG 483 N -3.63 0.41 -0.12 1.70 0.52 -1.26 -5.14 118.95 111.43 1zla s ARG 483 Ca 0.32 -0.34 0.03 0.00 -0.52 0.00 0.00 55.73 55.22 1zla s ARG 483 Cb 0.03 -0.32 0.00 0.00 0.52 0.00 0.00 34.95 35.19 1zla s ARG 483 CO 0.16 0.08 -0.23 -0.06 0.02 0.00 0.00 175.30 175.27 1zla s PHE 484 N -0.51 2.59 0.56 -0.53 0.40 -1.26 -5.10 117.98 114.13 1zla s PHE 484 Ca -0.02 -1.17 -0.21 0.00 -0.60 0.00 0.00 56.93 54.93 1zla s PHE 484 Cb -0.04 -1.75 -0.04 0.00 0.51 0.00 0.00 43.02 41.70 1zla s PHE 484 CO -0.00 -0.50 1.32 -0.65 0.70 0.00 0.00 175.22 176.09 1zla s GLN 485 N 0.55 3.06 0.65 0.44 -0.21 -1.26 -4.80 119.66 118.07 1zla s GLN 485 Ca -0.14 2.14 0.40 0.00 0.02 0.00 0.00 55.36 57.78 1zla s GLN 485 Cb -0.17 -2.16 2.21 0.00 1.00 0.00 0.00 33.01 33.89 1zla s GLN 485 CO 0.04 -1.23 2.31 0.66 -2.12 0.00 0.00 175.29 174.96 1zla h SER 486 N 1.28 0.00 0.08 5.90 4.64 -2.01 -1.46 113.55 121.99 1zla h SER 486 Ca -0.51 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.54 1zla h SER 486 Cb 1.30 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.42 1zla h SER 486 CO 0.56 0.00 -1.11 0.77 -0.87 0.00 0.00 176.83 176.19 1zla h SER 487 N 0.00 0.83 -0.56 4.97 4.64 -1.99 -2.87 113.55 118.57 1zla h SER 487 Ca 0.00 -0.80 0.01 0.00 -0.47 0.00 0.00 61.79 60.53 1zla h SER 487 Cb 0.05 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 61.86 1zla h SER 487 CO -0.00 1.54 0.37 0.00 -0.87 0.00 0.00 176.83 177.88 1zla h ALA 488 N 0.30 1.61 -0.14 5.18 0.00 -1.61 0.15 119.26 124.74 1zla h ALA 488 Ca -0.16 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1zla h ALA 488 Cb 1.79 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1zla h ALA 488 CO 0.21 0.36 -0.13 0.28 0.00 0.00 0.00 179.25 179.98 1zla h VAL 489 N 0.76 1.35 -0.95 0.00 2.07 -1.55 -0.98 116.25 116.94 1zla h VAL 489 Ca 0.21 -1.28 0.03 0.00 0.82 0.00 0.00 66.70 66.47 1zla h VAL 489 Cb -0.08 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 1zla h VAL 489 CO -0.05 0.37 0.63 0.24 0.02 0.00 0.00 177.57 178.79 1zla h MET 490 N -0.04 1.20 0.10 1.57 2.86 -1.16 0.28 114.93 119.75 1zla h MET 490 Ca 0.02 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1zla h MET 490 Cb 0.66 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1zla h MET 490 CO 0.03 0.79 -0.05 0.00 1.06 0.00 0.00 176.91 178.75 1zla h ALA 491 N 1.43 -0.13 -0.84 6.32 0.00 -0.65 -0.58 119.26 124.80 1zla h ALA 491 Ca 0.37 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.29 1zla h ALA 491 Cb -0.05 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 1zla h ALA 491 CO -0.10 -0.49 0.46 1.25 0.00 0.00 0.00 179.25 180.37 1zla h LEU 492 N -0.31 0.62 -0.57 0.00 5.85 -0.34 0.04 115.31 120.60 1zla h LEU 492 Ca -0.01 0.07 -0.15 0.00 0.84 0.00 0.00 57.88 58.63 1zla h LEU 492 Cb 0.26 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1zla h LEU 492 CO 0.02 0.32 -0.45 -0.61 -0.34 0.00 0.00 178.44 177.38 1zla h GLN 493 N 0.72 0.63 -0.58 1.25 4.15 -0.18 -2.39 115.11 118.72 1zla h GLN 493 Ca 0.43 -0.35 -0.04 0.00 0.77 0.00 0.00 58.65 59.46 1zla h GLN 493 Cb 0.49 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 1zla h GLN 493 CO -0.30 0.95 0.19 0.93 -1.93 0.00 0.00 178.83 178.68 1zla h GLU 494 N 0.51 0.89 -0.44 1.69 4.39 0.02 -0.84 114.58 120.80 1zla h GLU 494 Ca 0.03 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1zla h GLU 494 Cb 0.98 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.48 1zla h GLU 494 CO 0.09 0.79 0.20 0.00 -1.16 0.00 0.00 179.01 178.93 1zla h ALA 495 N 1.05 0.57 -0.17 3.43 0.00 -0.93 -2.68 119.26 120.54 1zla h ALA 495 Ca 0.19 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1zla h ALA 495 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1zla h ALA 495 CO -0.01 0.15 0.05 0.77 0.00 0.00 0.00 179.25 180.22 1zla h SER 496 N 0.57 0.25 -0.55 0.00 0.02 -1.23 -0.55 113.55 112.07 1zla h SER 496 Ca 0.15 -0.21 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 1zla h SER 496 Cb 0.15 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 1zla h SER 496 CO -0.02 0.39 0.21 -0.33 -1.14 0.00 0.00 176.83 175.95 1zla h GLU 497 N 0.10 0.83 -0.37 3.45 5.08 -1.16 0.19 114.58 122.71 1zla h GLU 497 Ca 0.06 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1zla h GLU 497 Cb 0.23 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1zla h GLU 497 CO -0.00 0.73 0.09 0.00 -1.00 0.00 0.00 179.01 178.83 1zla h ALA 498 N 1.06 1.48 0.34 3.43 0.00 -1.42 0.17 119.26 124.33 1zla h ALA 498 Ca 0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1zla h ALA 498 Cb 0.21 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1zla h ALA 498 CO -0.01 0.39 -0.16 -0.92 0.00 0.00 0.00 179.25 178.54 1zla h TYR 499 N 0.53 -0.42 -0.09 0.00 3.20 -0.21 -2.44 116.97 117.54 1zla h TYR 499 Ca 0.12 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.02 1zla h TYR 499 Cb 0.20 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 1zla h TYR 499 CO 0.01 -0.08 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.25 1zla h LEU 500 N -0.87 -0.39 -0.53 2.82 3.38 -0.34 -0.34 115.31 119.04 1zla h LEU 500 Ca -0.05 0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.10 1zla h LEU 500 Cb 0.53 0.18 -0.11 0.00 0.09 0.00 0.00 40.66 41.35 1zla h LEU 500 CO 0.08 -0.17 -0.18 0.58 0.09 0.00 0.00 178.44 178.83 1zla h VAL 501 N -0.17 0.39 -0.19 1.22 2.07 -0.71 0.30 116.25 119.16 1zla h VAL 501 Ca 0.07 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.54 1zla h VAL 501 Cb 0.28 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1zla h VAL 501 CO -0.19 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.26 1zla h ALA 502 N 1.40 1.41 0.00 1.67 0.00 -1.10 -2.15 119.26 120.49 1zla h ALA 502 Ca 0.25 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1zla h ALA 502 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1zla h ALA 502 CO -0.58 0.41 -0.43 1.25 0.00 0.00 0.00 179.25 179.90 1zla h LEU 503 N 0.29 0.00 -0.38 0.00 5.85 0.13 -2.61 115.31 118.59 1zla h LEU 503 Ca 0.06 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.59 1zla h LEU 503 Cb 0.43 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 1zla h LEU 503 CO 0.03 0.43 -0.65 -0.26 -0.34 0.00 0.00 178.44 177.65 1zla h PHE 504 N 0.00 0.80 -0.06 1.25 0.05 -0.34 -0.94 116.94 117.70 1zla h PHE 504 Ca -0.00 -0.32 0.02 0.00 3.82 0.00 0.00 57.97 61.49 1zla h PHE 504 Cb 0.84 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 38.63 1zla h PHE 504 CO 0.00 1.09 -0.06 0.93 -0.18 0.00 0.00 178.31 180.09 1zla h GLU 505 N 0.45 -0.07 -0.04 1.51 5.08 -1.06 0.37 114.58 120.81 1zla h GLU 505 Ca -0.02 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1zla h GLU 505 Cb 1.23 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1zla h GLU 505 CO 0.13 -0.05 -0.36 -0.44 -1.00 0.00 0.00 179.01 177.28 1zla h ASP 506 N -0.08 0.08 -0.26 1.42 5.19 -1.47 -1.93 116.42 119.37 1zla h ASP 506 Ca 0.05 -0.03 -0.08 0.00 -0.62 0.00 0.00 57.03 56.35 1zla h ASP 506 Cb 0.14 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.63 1zla h ASP 506 CO -0.11 0.44 -0.16 0.74 -3.12 0.00 0.00 179.24 177.03 1zla h THR 507 N 0.07 1.30 -0.91 0.35 2.02 -0.37 -1.74 112.91 113.63 1zla h THR 507 Ca 0.01 -1.27 0.03 0.00 0.77 0.00 0.00 66.41 65.95 1zla h THR 507 Cb 0.68 1.56 -0.05 0.00 -1.74 0.00 0.00 68.15 68.60 1zla h THR 507 CO 0.05 0.40 0.60 -1.13 0.37 0.00 0.00 175.52 175.81 1zla h ASN 508 N 0.30 0.99 -0.62 4.18 -1.24 -0.05 0.52 115.58 119.65 1zla h ASN 508 Ca 0.05 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.05 1zla h ASN 508 Cb 0.68 -0.23 -0.03 0.00 0.73 0.00 0.00 38.32 39.47 1zla h ASN 508 CO 0.04 0.68 0.36 -0.07 -1.29 0.00 0.00 177.43 177.16 1zla h LEU 509 N 1.15 0.75 -0.54 0.34 3.38 -1.01 0.97 115.31 120.36 1zla h LEU 509 Ca 0.36 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.20 1zla h LEU 509 Cb 0.00 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1zla h LEU 509 CO -0.11 0.60 0.09 0.00 0.09 0.00 0.00 178.44 179.12 1zla h ALA 511 N 0.99 0.18 -0.36 0.00 0.00 -0.52 -1.41 119.26 118.13 1zla h ALA 511 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1zla h ALA 511 Cb 0.40 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1zla h ALA 511 CO 0.01 -0.33 0.11 0.82 0.00 0.00 0.00 179.25 179.86 1zla h ILE 512 N 0.19 1.16 -0.91 0.00 2.04 -0.59 -1.18 117.51 118.21 1zla h ILE 512 Ca 0.05 -0.54 0.07 0.00 1.00 0.00 0.00 64.86 65.45 1zla h ILE 512 Cb -0.02 0.77 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 1zla h ILE 512 CO -0.01 0.20 0.57 -0.74 0.00 0.00 0.00 178.15 178.17 1zla h HIS 513 N 0.52 1.05 -0.46 1.37 2.76 0.42 0.74 115.15 121.54 1zla h HIS 513 Ca 0.12 0.03 -0.25 0.00 -2.20 0.00 0.00 60.37 58.08 1zla h HIS 513 Cb 0.17 -0.34 -0.14 0.00 1.55 0.00 0.00 27.41 28.65 1zla h HIS 513 CO 0.01 0.51 0.31 0.00 -1.30 0.00 0.00 177.93 177.45 1zla n ALA 514 N -2.36 4.00 -3.42 5.26 0.00 -0.76 -4.85 120.51 118.38 1zla n ALA 514 Ca 0.14 -1.36 -0.25 0.00 0.00 0.00 0.00 53.44 51.97 1zla n ALA 514 Cb 0.22 -1.22 0.02 0.00 0.00 0.00 0.00 19.45 18.47 1zla n ALA 514 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1zla n LYS 515 N -0.24 -4.56 -4.42 0.00 5.02 0.25 -4.98 118.16 109.24 1zla n LYS 515 Ca 0.28 0.64 -0.31 0.00 -2.02 0.00 0.00 58.31 56.91 1zla n LYS 515 Cb 1.03 -5.46 -0.04 0.00 -0.02 0.00 0.00 35.03 30.53 1zla n LYS 515 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1zla s ARG 516 N -6.10 2.23 -0.01 1.97 0.52 -0.52 -5.01 118.95 112.04 1zla s ARG 516 Ca 0.45 -2.28 0.07 0.00 -0.52 0.00 0.00 55.73 53.44 1zla s ARG 516 Cb -0.22 -1.75 0.11 0.00 0.52 0.00 0.00 34.95 33.61 1zla s ARG 516 CO 0.56 -0.51 1.05 1.33 0.02 0.00 0.00 175.30 177.75 1zla n VAL 517 N -1.50 0.13 -4.41 3.52 0.24 -1.26 -3.73 118.33 111.31 1zla n VAL 517 Ca -0.13 -0.38 -0.28 0.00 -2.04 0.00 0.00 64.34 61.50 1zla n VAL 517 Cb 0.66 0.56 -0.17 0.00 -1.47 0.00 0.00 33.84 33.42 1zla n VAL 517 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1zla s HIS 518 N -0.19 1.95 -0.13 6.34 4.02 -1.26 -5.05 115.29 120.96 1zla s HIS 518 Ca 0.10 -0.93 -0.26 0.00 1.02 0.00 0.00 55.06 54.99 1zla s HIS 518 Cb 0.10 -1.42 -0.02 0.00 -1.02 0.00 0.00 32.58 30.23 1zla s HIS 518 CO -0.04 -0.48 0.85 0.96 1.02 0.00 0.00 174.74 177.05 1zla s ILE 519 N 1.04 4.89 0.36 0.60 -4.36 -1.26 -4.73 121.20 117.73 1zla s ILE 519 Ca -0.06 1.70 0.09 0.00 -0.26 0.00 0.00 60.65 62.12 1zla s ILE 519 Cb -0.15 -4.16 -0.06 0.00 1.25 0.00 0.00 42.46 39.34 1zla s ILE 519 CO -0.02 0.06 0.01 -0.04 0.24 0.00 0.00 174.94 175.19 1zla s MET 520 N 1.88 2.03 0.20 0.37 -1.94 -1.26 -5.00 119.30 115.58 1zla s MET 520 Ca 0.41 -1.84 -0.11 0.00 -1.71 0.00 0.00 55.69 52.44 1zla s MET 520 Cb -0.17 -1.86 0.26 0.00 2.01 0.00 0.00 34.83 35.07 1zla s MET 520 CO 0.15 0.09 1.72 -1.35 -0.01 0.00 0.00 175.02 175.61 1zla h PRO 521 N 1.80 0.28 -0.52 2.03 0.11 -2.00 0.23 132.00 133.94 1zla h PRO 521 Ca -0.43 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.69 1zla h PRO 521 Cb 1.25 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 1zla h PRO 521 CO 0.70 0.18 0.34 1.57 -0.21 0.00 0.00 178.00 180.58 1zla h LYS 522 N 0.29 0.62 -0.20 1.05 2.10 -1.98 0.10 116.57 118.55 1zla h LYS 522 Ca 0.29 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.90 1zla h LYS 522 Cb 0.40 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 31.58 1zla h LYS 522 CO -0.35 0.41 0.11 -0.44 -2.00 0.00 0.00 179.45 177.18 1zla h ASP 523 N 0.64 0.24 -0.48 7.07 3.32 -0.94 0.20 116.42 126.48 1zla h ASP 523 Ca 0.20 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1zla h ASP 523 Cb 0.02 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1zla h ASP 523 CO -0.05 0.24 0.22 0.40 -1.72 0.00 0.00 179.24 178.33 1zla h ILE 524 N 0.23 1.19 0.19 0.35 1.08 -0.36 -2.17 117.51 118.01 1zla h ILE 524 Ca 0.07 -0.56 -0.01 0.00 -0.39 0.00 0.00 64.86 63.97 1zla h ILE 524 Cb 0.05 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 34.34 1zla h ILE 524 CO -0.01 0.23 -0.09 1.56 -0.69 0.00 0.00 178.15 179.14 1zla h GLN 525 N 0.74 -0.24 -0.92 2.37 4.20 0.02 -0.54 115.11 120.75 1zla h GLN 525 Ca 0.18 0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.98 1zla h GLN 525 Cb 0.12 0.06 -0.07 0.00 0.30 0.00 0.00 27.48 27.89 1zla h GLN 525 CO -0.02 0.01 0.57 1.25 -0.67 0.00 0.00 178.83 179.97 1zla h LEU 526 N -0.47 0.89 0.22 1.46 5.85 -0.51 0.11 115.31 122.85 1zla h LEU 526 Ca -0.03 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1zla h LEU 526 Cb 0.36 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1zla h LEU 526 CO 0.04 0.55 -0.11 0.00 -0.34 0.00 0.00 178.44 178.58 1zla h ALA 527 N 1.45 -0.29 -0.10 1.25 0.00 -1.25 -1.80 119.26 118.50 1zla h ALA 527 Ca 0.41 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 1zla h ALA 527 Cb 0.24 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1zla h ALA 527 CO -0.20 -0.55 -0.06 0.00 0.00 0.00 0.00 179.25 178.44 1zla h ARG 528 N -0.53 0.15 0.56 0.00 3.08 -0.76 -1.43 114.38 115.44 1zla h ARG 528 Ca -0.03 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1zla h ARG 528 Cb 0.40 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.43 1zla h ARG 528 CO 0.05 0.22 -0.27 -0.09 -1.07 0.00 0.00 179.97 178.81 1zla h ARG 529 N 0.14 -0.73 -0.32 0.04 9.65 -0.61 -1.77 114.38 120.79 1zla h ARG 529 Ca 0.03 0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.97 1zla h ARG 529 Cb 0.21 0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.94 1zla h ARG 529 CO 0.01 -0.45 0.21 0.82 2.80 0.00 0.00 179.97 183.37 1zla h ILE 530 N -0.86 1.06 0.00 1.20 2.04 -1.05 -0.09 117.51 119.81 1zla h ILE 530 Ca -0.08 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1zla h ILE 530 Cb 0.62 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1zla h ILE 530 CO 0.13 0.07 0.00 0.03 0.00 0.00 0.00 178.15 178.38 1zla h ARG 531 N 0.39 0.00 0.00 2.37 3.08 -1.10 -3.46 114.38 115.66 1zla h ARG 531 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1zla h ARG 531 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1zla h ARG 531 CO -0.03 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.28 1zla n GLY 532 N -0.50 0.76 0.12 0.04 0.00 -0.05 -4.94 105.19 100.62 1zla n GLY 532 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1zla n GLY 532 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1zla h GLU 533 N 3.13 0.00 0.00 1.61 5.08 -1.50 -3.43 114.58 119.48 1zla h GLU 533 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1zla h GLU 533 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1zla h GLU 533 CO 0.00 0.47 0.00 0.54 -1.00 0.00 0.00 179.01 179.02 1zla n ARG 534 N -3.11 0.00 0.00 2.33 1.74 -1.15 -4.99 116.66 111.48 1zla n ARG 534 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1zla n ARG 534 Cb 0.79 -0.31 0.00 0.00 -1.02 0.00 0.00 32.46 31.93 1zla n ARG 534 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11