#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dq8 s ARG 440 N 0.00 3.72 0.00 -0.52 1.70 -1.26 -4.82 118.95 117.77 1dq8 s ARG 440 Ca 0.00 -0.36 0.00 0.00 -0.47 0.00 0.00 55.73 54.90 1dq8 s ARG 440 Cb 0.00 -3.10 0.00 0.00 -0.57 0.00 0.00 34.95 31.28 1dq8 s ARG 440 CO 0.00 0.38 0.00 0.39 -1.08 0.00 0.00 175.30 174.99 1dq8 n GLU 441 N 3.17 0.00 -0.70 3.89 -0.58 -1.26 -5.12 120.64 120.04 1dq8 n GLU 441 Ca -0.17 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.26 1dq8 n GLU 441 Cb 0.53 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.34 1dq8 n GLU 441 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1dq8 n PRO 442 N 0.00 0.00 -2.31 3.49 -0.02 -1.26 -4.99 135.00 129.91 1dq8 n PRO 442 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.17 1dq8 n PRO 442 Cb 0.00 -0.72 -0.02 0.00 -0.02 0.00 0.00 33.50 32.74 1dq8 n PRO 442 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1dq8 s ARG 443 N 2.31 3.77 0.66 -0.52 0.52 -1.26 -5.03 118.95 119.40 1dq8 s ARG 443 Ca 0.55 0.75 -0.17 0.00 -0.52 0.00 0.00 55.73 56.34 1dq8 s ARG 443 Cb -0.72 -2.17 -0.01 0.00 0.52 0.00 0.00 34.95 32.57 1dq8 s ARG 443 CO 0.35 -0.33 1.21 -2.30 0.02 0.00 0.00 175.30 174.24 1dq8 n PRO 444 N -1.99 0.94 -0.28 3.54 -0.02 -1.26 -4.77 135.00 131.16 1dq8 n PRO 444 Ca 0.05 0.38 0.04 0.00 -2.02 0.00 0.00 63.50 61.95 1dq8 n PRO 444 Cb 0.54 -2.44 0.18 0.00 -0.02 0.00 0.00 33.50 31.76 1dq8 n PRO 444 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1dq8 h ASN 445 N 0.32 0.58 -0.53 2.55 2.35 -1.97 -1.52 115.58 117.36 1dq8 h ASN 445 Ca -0.50 0.06 0.05 0.00 -0.55 0.00 0.00 56.30 55.37 1dq8 h ASN 445 Cb 1.34 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 39.62 1dq8 h ASN 445 CO 0.51 0.31 0.26 -0.08 -1.65 0.00 0.00 177.43 176.78 1dq8 h GLU 446 N 0.70 0.48 -0.03 0.81 4.81 -2.00 -1.99 114.58 117.35 1dq8 h GLU 446 Ca 0.41 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.47 1dq8 h GLU 446 Cb 0.45 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1dq8 h GLU 446 CO -0.29 0.32 -0.61 0.93 -0.73 0.00 0.00 179.01 178.63 1dq8 h GLU 447 N 0.49 0.11 0.00 1.92 5.08 -1.84 -3.07 114.58 117.28 1dq8 h GLU 447 Ca 0.24 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1dq8 h GLU 447 Cb 0.17 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1dq8 h GLU 447 CO -0.18 0.69 0.00 0.00 -1.00 0.00 0.00 179.01 178.52 1dq8 n LEU 449 N -2.06 1.94 0.00 0.00 4.77 -1.14 -4.86 117.00 115.65 1dq8 n LEU 449 Ca -0.00 -0.78 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 1dq8 n LEU 449 Cb 0.07 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 39.61 1dq8 n LEU 449 CO 0.10 -1.86 0.00 0.00 -1.33 0.00 0.00 177.39 174.30 1dq8 n GLN 450 N 8.82 0.00 -1.88 3.23 10.64 -1.26 -5.13 117.38 131.80 1dq8 n GLN 450 Ca 0.43 0.00 -0.22 0.00 -1.83 0.00 0.00 57.00 55.37 1dq8 n GLN 450 Cb 0.47 -0.06 -0.07 0.00 -0.86 0.00 0.00 30.24 29.72 1dq8 n GLN 450 CO 0.00 0.00 0.00 0.96 -1.83 0.00 0.00 177.06 176.19 1dq8 s ILE 451 N 0.00 3.32 0.00 -0.39 -4.36 -1.26 -5.09 121.20 113.42 1dq8 s ILE 451 Ca 0.00 -0.42 0.00 0.00 -0.26 0.00 0.00 60.65 59.97 1dq8 s ILE 451 Cb 0.00 -4.02 0.00 0.00 1.25 0.00 0.00 42.46 39.69 1dq8 s ILE 451 CO 0.00 -0.62 0.00 0.29 0.24 0.00 0.00 174.94 174.85 1dq8 n LYS 460 N 8.52 0.00 -1.91 0.37 5.02 -1.26 -5.29 118.16 123.60 1dq8 n LYS 460 Ca 0.43 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.30 1dq8 n LYS 460 Cb 0.46 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.44 1dq8 n LYS 460 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1dq8 s PHE 461 N 0.00 1.76 0.38 2.13 0.40 -1.26 -4.81 117.98 116.58 1dq8 s PHE 461 Ca 0.00 0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.52 1dq8 s PHE 461 Cb 0.00 -4.01 0.00 0.00 0.51 0.00 0.00 43.02 39.52 1dq8 s PHE 461 CO 0.00 -3.99 0.00 1.28 0.70 0.00 0.00 175.22 173.21 1dq8 n LEU 462 N 8.18 -0.73 -4.95 -0.37 4.77 -1.26 -4.96 117.00 117.69 1dq8 n LEU 462 Ca 0.20 1.64 -0.20 0.00 -0.03 0.00 0.00 56.01 57.62 1dq8 n LEU 462 Cb 0.43 -4.09 -0.01 0.00 -2.33 0.00 0.00 43.42 37.42 1dq8 n LEU 462 CO 0.65 -3.04 0.01 -0.94 -1.33 0.00 0.00 177.39 172.73 1dq8 s SER 463 N -6.85 5.87 0.15 -1.43 1.04 -1.26 -5.00 113.70 106.22 1dq8 s SER 463 Ca 0.00 -0.21 -0.17 0.00 0.48 0.00 0.00 55.95 56.05 1dq8 s SER 463 Cb 0.00 -1.28 0.06 0.00 0.10 0.00 0.00 66.02 64.90 1dq8 s SER 463 CO 0.00 -0.34 1.73 0.44 0.98 0.00 0.00 173.24 176.05 1dq8 h ASP 464 N 1.03 0.00 -0.95 7.02 3.32 -2.00 -2.10 116.42 122.75 1dq8 h ASP 464 Ca -0.47 0.06 0.15 0.00 0.02 0.00 0.00 57.03 56.79 1dq8 h ASP 464 Cb 1.25 0.08 -0.08 0.00 0.22 0.00 0.00 39.33 40.80 1dq8 h ASP 464 CO 0.55 0.04 0.60 0.00 -1.72 0.00 0.00 179.24 178.72 1dq8 h ALA 465 N 1.26 1.74 -0.14 3.45 0.00 -1.99 -0.10 119.26 123.49 1dq8 h ALA 465 Ca 0.16 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 1dq8 h ALA 465 Cb 0.18 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1dq8 h ALA 465 CO -0.22 -0.01 -0.79 0.93 0.00 0.00 0.00 179.25 179.16 1dq8 h GLU 466 N 0.77 0.74 -0.53 0.00 5.08 -1.80 -0.99 114.58 117.86 1dq8 h GLU 466 Ca 0.49 -0.62 -0.07 0.00 -1.00 0.00 0.00 59.36 58.16 1dq8 h GLU 466 Cb 0.73 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1dq8 h GLU 466 CO -0.26 1.23 0.05 0.82 -1.00 0.00 0.00 179.01 179.85 1dq8 h ILE 467 N 0.50 1.26 -0.54 3.13 2.04 -0.77 -0.34 117.51 122.78 1dq8 h ILE 467 Ca -0.06 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.79 1dq8 h ILE 467 Cb 1.42 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.34 1dq8 h ILE 467 CO 0.16 0.36 0.33 0.40 0.00 0.00 0.00 178.15 179.41 1dq8 h ILE 468 N 0.79 1.16 -0.48 -0.67 2.04 -0.99 -0.16 117.51 119.19 1dq8 h ILE 468 Ca 0.16 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1dq8 h ILE 468 Cb 0.46 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1dq8 h ILE 468 CO 0.02 0.16 0.27 -0.61 0.00 0.00 0.00 178.15 177.99 1dq8 h GLN 469 N 0.73 0.67 -0.54 2.37 4.15 -0.80 -0.24 115.11 121.44 1dq8 h GLN 469 Ca 0.20 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.52 1dq8 h GLN 469 Cb -0.02 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 1dq8 h GLN 469 CO -0.04 0.52 0.29 -0.07 -1.93 0.00 0.00 178.83 177.60 1dq8 h LEU 470 N 0.64 0.68 -0.45 -2.39 3.38 -0.70 0.11 115.31 116.58 1dq8 h LEU 470 Ca 0.17 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1dq8 h LEU 470 Cb 0.05 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1dq8 h LEU 470 CO -0.03 0.59 0.26 0.58 0.09 0.00 0.00 178.44 179.93 1dq8 h VAL 471 N 0.72 1.15 -0.14 1.22 2.07 -0.64 -1.22 116.25 119.41 1dq8 h VAL 471 Ca 0.19 -0.37 -0.08 0.00 0.82 0.00 0.00 66.70 67.27 1dq8 h VAL 471 Cb 0.07 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1dq8 h VAL 471 CO -0.03 0.16 -0.20 0.78 0.02 0.00 0.00 177.57 178.29 1dq8 h ASN 472 N 0.59 0.43 0.33 0.57 2.35 -0.84 -3.23 115.58 115.78 1dq8 h ASN 472 Ca 0.16 -0.52 -0.01 0.00 -0.55 0.00 0.00 56.30 55.37 1dq8 h ASN 472 Cb 0.02 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.27 1dq8 h ASN 472 CO -0.03 0.86 -0.20 0.00 -1.65 0.00 0.00 177.43 176.42 1dq8 h ALA 473 N 0.58 -1.06 -3.81 -0.83 0.00 -0.74 -3.43 119.26 109.98 1dq8 h ALA 473 Ca 0.01 -0.10 -0.31 0.00 0.00 0.00 0.00 54.91 54.52 1dq8 h ALA 473 Cb 0.77 0.30 0.11 0.00 0.00 0.00 0.00 17.79 18.97 1dq8 h ALA 473 CO 0.05 -1.04 0.26 1.63 0.00 0.00 0.00 179.25 180.15 1dq8 n LYS 474 N -3.51 -0.76 -3.41 0.00 5.02 -0.47 -5.01 118.16 110.02 1dq8 n LYS 474 Ca -0.06 -1.51 -0.28 0.00 -2.02 0.00 0.00 58.31 54.44 1dq8 n LYS 474 Cb 0.20 -0.89 -0.08 0.00 -0.02 0.00 0.00 35.03 34.25 1dq8 n LYS 474 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1dq8 n HIS 475 N -3.16 3.61 -2.91 2.13 8.25 -1.26 -4.65 115.22 117.23 1dq8 n HIS 475 Ca 0.12 -4.10 -0.43 0.00 -0.26 0.00 0.00 57.72 53.05 1dq8 n HIS 475 Cb 0.41 -0.59 -0.04 0.00 1.12 0.00 0.00 29.99 30.89 1dq8 n HIS 475 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1dq8 s ILE 476 N -2.50 4.44 0.51 1.59 1.09 -1.22 -5.02 121.20 120.09 1dq8 s ILE 476 Ca 0.40 -0.42 -0.23 0.00 -1.10 0.00 0.00 60.65 59.30 1dq8 s ILE 476 Cb 0.14 -4.62 -0.07 0.00 -1.06 0.00 0.00 42.46 36.86 1dq8 s ILE 476 CO -0.01 -1.34 1.28 -2.65 -0.10 0.00 0.00 174.94 172.13 1dq8 n PRO 477 N 7.38 1.70 -0.36 2.79 -0.02 -1.26 -4.83 135.00 140.40 1dq8 n PRO 477 Ca -0.04 0.62 0.37 0.00 -2.02 0.00 0.00 63.50 62.42 1dq8 n PRO 477 Cb 0.45 -2.46 0.75 0.00 -0.02 0.00 0.00 33.50 32.22 1dq8 n PRO 477 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dq8 h ALA 478 N 1.58 3.17 0.00 3.55 0.00 -1.95 -2.51 119.26 123.09 1dq8 h ALA 478 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1dq8 h ALA 478 Cb 1.31 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1dq8 h ALA 478 CO 0.57 -1.54 0.00 2.48 0.00 0.00 0.00 179.25 180.77 1dq8 n TYR 479 N -4.17 0.28 1.03 0.00 0.18 -1.26 -2.78 117.16 110.45 1dq8 n TYR 479 Ca 0.27 0.12 0.12 0.00 1.88 0.00 0.00 57.90 60.29 1dq8 n TYR 479 Cb 1.31 -0.69 0.25 0.00 -0.38 0.00 0.00 39.34 39.83 1dq8 n TYR 479 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 1dq8 n LYS 480 N -1.76 2.14 -0.25 -3.48 4.76 -0.95 -4.62 118.16 114.01 1dq8 n LYS 480 Ca 0.02 -1.67 0.05 0.00 -2.87 0.00 0.00 58.31 53.84 1dq8 n LYS 480 Cb 0.16 -1.47 0.16 0.00 -1.84 0.00 0.00 35.03 32.03 1dq8 n LYS 480 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1dq8 h LEU 481 N 3.86 -0.24 -2.34 -0.35 3.38 -1.72 -1.07 115.31 116.83 1dq8 h LEU 481 Ca 0.00 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1dq8 h LEU 481 Cb 0.83 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1dq8 h LEU 481 CO 0.00 -0.14 0.11 -0.33 0.09 0.00 0.00 178.44 178.17 1dq8 h GLU 482 N 0.14 0.00 0.35 1.13 3.07 -1.87 -1.91 114.58 115.49 1dq8 h GLU 482 Ca 0.40 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.24 1dq8 h GLU 482 Cb 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1dq8 h GLU 482 CO -0.60 0.00 -0.17 1.15 -1.40 0.00 0.00 179.01 177.99 1dq8 h THR 483 N 0.00 0.63 0.10 1.13 2.02 -1.54 -3.36 112.91 111.89 1dq8 h THR 483 Ca 0.00 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1dq8 h THR 483 Cb 0.22 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1dq8 h THR 483 CO 0.00 0.10 -0.05 -0.07 0.37 0.00 0.00 175.52 175.87 1dq8 h LEU 484 N -0.78 -0.12 -9.77 2.58 3.38 -1.53 -3.46 115.31 105.62 1dq8 h LEU 484 Ca -0.05 -0.44 -0.53 0.00 0.09 0.00 0.00 57.88 56.95 1dq8 h LEU 484 Cb 0.52 0.03 0.07 0.00 0.09 0.00 0.00 40.66 41.37 1dq8 h LEU 484 CO 0.08 0.44 0.86 -0.63 0.09 0.00 0.00 178.44 179.28 1dq8 s ILE 485 N -3.70 2.24 0.43 1.22 -1.09 -0.78 -4.93 121.20 114.59 1dq8 s ILE 485 Ca -0.14 0.20 0.11 0.00 -2.23 0.00 0.00 60.65 58.59 1dq8 s ILE 485 Cb 0.01 -3.13 0.30 0.00 -1.58 0.00 0.00 42.46 38.06 1dq8 s ILE 485 CO 0.57 0.03 2.02 1.05 -1.23 0.00 0.00 174.94 177.38 1dq8 h GLU 486 N 5.16 0.44 -5.98 2.79 9.09 -1.89 -3.43 114.58 120.75 1dq8 h GLU 486 Ca -0.46 -0.03 -0.53 0.00 0.05 0.00 0.00 59.36 58.40 1dq8 h GLU 486 Cb 1.22 -0.10 -0.21 0.00 -1.65 0.00 0.00 28.75 28.01 1dq8 h GLU 486 CO 0.81 0.29 -0.81 0.95 0.05 0.00 0.00 179.01 180.30 1dq8 s THR 487 N -5.42 1.62 0.18 -1.06 -4.23 -1.26 -5.04 115.64 100.43 1dq8 s THR 487 Ca -0.08 -1.56 -0.10 0.00 -1.18 0.00 0.00 61.69 58.77 1dq8 s THR 487 Cb 0.19 -1.52 0.08 0.00 1.34 0.00 0.00 72.50 72.58 1dq8 s THR 487 CO 0.74 -0.13 1.67 0.45 -0.54 0.00 0.00 174.62 176.80 1dq8 h HIS 488 N 3.98 1.11 -0.78 3.99 3.86 -1.92 -2.96 115.15 122.44 1dq8 h HIS 488 Ca -0.45 -0.16 0.01 0.00 -1.16 0.00 0.00 60.37 58.61 1dq8 h HIS 488 Cb 1.19 -0.30 -0.04 0.00 1.06 0.00 0.00 27.41 29.31 1dq8 h HIS 488 CO 0.63 0.95 0.51 1.49 0.86 0.00 0.00 177.93 182.37 1dq8 h GLU 489 N 0.95 1.03 -0.08 2.45 4.81 -1.96 -1.38 114.58 120.40 1dq8 h GLU 489 Ca 0.19 -0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 59.20 1dq8 h GLU 489 Cb 0.45 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1dq8 h GLU 489 CO 0.01 0.68 -0.63 -0.09 -0.73 0.00 0.00 179.01 178.25 1dq8 h ARG 490 N 1.06 0.29 -0.68 1.92 2.43 -1.96 -0.35 114.38 117.09 1dq8 h ARG 490 Ca 0.28 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 1dq8 h ARG 490 Cb -0.12 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 1dq8 h ARG 490 CO -0.06 0.83 0.19 0.78 -1.51 0.00 0.00 179.97 180.20 1dq8 h GLY 491 N 1.43 1.13 0.81 2.80 0.00 -1.22 -0.23 103.07 107.79 1dq8 h GLY 491 Ca -0.01 -0.67 -0.03 0.00 0.00 0.00 0.00 47.33 46.62 1dq8 h GLY 491 CO 0.10 0.63 0.00 -2.08 0.00 0.00 0.00 176.54 175.19 1dq8 h VAL 492 N 1.01 1.25 -0.92 4.60 2.07 -1.04 -1.75 116.25 121.46 1dq8 h VAL 492 Ca 0.22 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 66.95 1dq8 h VAL 492 Cb 0.32 1.46 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 1dq8 h VAL 492 CO -0.00 0.26 0.60 -1.28 0.02 0.00 0.00 177.57 177.16 1dq8 h SER 493 N 0.07 0.92 -0.21 0.57 0.87 -0.78 -1.28 113.55 113.71 1dq8 h SER 493 Ca 0.05 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.50 1dq8 h SER 493 Cb 0.38 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1dq8 h SER 493 CO 0.01 0.59 -0.33 0.40 -0.53 0.00 0.00 176.83 176.97 1dq8 h ILE 494 N 1.05 1.33 -0.95 2.23 2.04 -0.81 -1.91 117.51 120.48 1dq8 h ILE 494 Ca 0.40 -1.54 0.02 0.00 1.00 0.00 0.00 64.86 64.74 1dq8 h ILE 494 Cb 0.21 1.80 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 1dq8 h ILE 494 CO -0.15 0.48 0.62 -0.09 0.00 0.00 0.00 178.15 179.01 1dq8 h ARG 495 N 0.28 1.21 -0.82 2.37 2.43 -0.98 0.16 114.38 119.03 1dq8 h ARG 495 Ca 0.02 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1dq8 h ARG 495 Cb 0.91 -0.27 -0.04 0.00 -0.42 0.00 0.00 29.97 30.15 1dq8 h ARG 495 CO 0.08 0.80 0.47 0.00 -1.51 0.00 0.00 179.97 179.81 1dq8 h ARG 496 N 1.25 1.13 -0.44 0.20 3.08 -1.14 0.33 114.38 118.79 1dq8 h ARG 496 Ca 0.36 -0.12 -0.15 0.00 0.07 0.00 0.00 59.98 60.14 1dq8 h ARG 496 Cb -0.09 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.72 1dq8 h ARG 496 CO -0.09 0.82 -0.30 1.96 -1.07 0.00 0.00 179.97 181.29 1dq8 h GLN 497 N 1.13 0.98 -0.76 0.04 4.20 -0.32 -1.33 115.11 119.06 1dq8 h GLN 497 Ca 0.29 -0.46 -0.06 0.00 0.06 0.00 0.00 58.65 58.48 1dq8 h GLN 497 Cb -0.00 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1dq8 h GLN 497 CO -0.05 1.13 0.25 -0.07 -0.67 0.00 0.00 178.83 179.42 1dq8 h LEU 498 N 0.82 1.09 -0.13 1.46 4.07 -0.17 -3.15 115.31 119.30 1dq8 h LEU 498 Ca 0.09 -0.20 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 1dq8 h LEU 498 Cb 0.89 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 42.34 1dq8 h LEU 498 CO 0.08 1.00 0.02 0.25 -1.08 0.00 0.00 178.44 178.72 1dq8 h LEU 499 N 1.12 0.21 -0.85 1.67 5.85 -0.10 -3.17 115.31 120.04 1dq8 h LEU 499 Ca 0.25 -0.25 0.21 0.00 0.84 0.00 0.00 57.88 58.93 1dq8 h LEU 499 Cb 0.29 -0.06 -0.15 0.00 0.37 0.00 0.00 40.66 41.12 1dq8 h LEU 499 CO -0.01 0.41 0.08 0.28 -0.34 0.00 0.00 178.44 178.86 1dq8 h SER 500 N 0.00 -0.26 0.01 1.25 0.02 -1.20 0.27 113.55 113.64 1dq8 h SER 500 Ca 0.04 0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1dq8 h SER 500 Cb 0.29 0.35 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 1dq8 h SER 500 CO 0.00 -0.21 -0.00 0.11 -1.14 0.00 0.00 176.83 175.59 1dq8 h LYS 501 N 0.12 0.00 -0.03 3.45 1.57 -1.58 -1.54 116.57 118.56 1dq8 h LYS 501 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1dq8 h LYS 501 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1dq8 h LYS 501 CO -0.72 0.00 -0.04 1.63 -0.57 0.00 0.00 179.45 179.75 1dq8 n LYS 502 N -3.16 2.07 -3.74 3.15 5.02 0.94 -4.94 118.16 117.50 1dq8 n LYS 502 Ca -0.03 -1.62 -0.32 0.00 -2.02 0.00 0.00 58.31 54.32 1dq8 n LYS 502 Cb 0.07 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1dq8 n LYS 502 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1dq8 s LEU 503 N -2.05 4.31 0.43 -0.35 1.43 -0.58 -4.99 118.68 116.88 1dq8 s LEU 503 Ca 0.29 0.51 0.23 0.00 -1.03 0.00 0.00 54.13 54.14 1dq8 s LEU 503 Cb 0.20 -3.12 0.78 0.00 0.03 0.00 0.00 46.19 44.08 1dq8 s LEU 503 CO 0.33 0.11 1.76 0.77 0.23 0.00 0.00 176.35 179.56 1dq8 h SER 504 N 3.09 0.00 -3.35 2.29 4.64 -1.92 -3.30 113.55 114.99 1dq8 h SER 504 Ca -0.46 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.24 1dq8 h SER 504 Cb 1.17 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.85 1dq8 h SER 504 CO 0.72 0.23 -0.68 -0.70 -0.87 0.00 0.00 176.83 175.53 1dq8 s GLU 505 N -3.51 1.90 0.51 4.77 2.12 -1.26 -4.99 118.70 118.24 1dq8 s GLU 505 Ca 0.02 -2.74 0.37 0.00 0.36 0.00 0.00 54.97 52.97 1dq8 s GLU 505 Cb 0.09 -2.89 1.52 0.00 0.26 0.00 0.00 34.13 33.11 1dq8 s GLU 505 CO 0.65 -1.24 1.72 -1.35 -0.54 0.00 0.00 175.26 174.50 1dq8 h PRO 506 N 5.94 0.06 -0.46 4.30 0.11 -1.76 -0.12 132.00 140.07 1dq8 h PRO 506 Ca 0.08 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1dq8 h PRO 506 Cb 0.84 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1dq8 h PRO 506 CO 0.61 0.04 0.00 -1.13 -0.21 0.00 0.00 178.00 177.31 1dq8 n SER 507 N -4.25 2.26 0.26 -2.05 3.41 -1.26 -4.36 113.62 107.64 1dq8 n SER 507 Ca 0.31 -2.10 0.12 0.00 -0.26 0.00 0.00 58.87 56.94 1dq8 n SER 507 Cb 1.40 -0.32 0.72 0.00 -0.26 0.00 0.00 64.21 65.75 1dq8 n SER 507 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1dq8 h SER 508 N 2.12 0.00 0.86 4.04 4.64 -1.42 -2.04 113.55 121.75 1dq8 h SER 508 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dq8 h SER 508 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1dq8 h SER 508 CO 0.05 0.11 0.00 0.18 -0.87 0.00 0.00 176.83 176.30 1dq8 n LEU 509 N -3.84 0.07 -0.32 5.97 4.77 -1.26 -4.15 117.00 118.23 1dq8 n LEU 509 Ca -0.02 0.51 0.13 0.00 -0.03 0.00 0.00 56.01 56.60 1dq8 n LEU 509 Cb 0.20 -0.49 0.28 0.00 -2.33 0.00 0.00 43.42 41.08 1dq8 n LEU 509 CO 0.31 -0.11 0.83 -0.61 -1.33 0.00 0.00 177.39 176.48 1dq8 h GLN 510 N 0.00 0.05 -0.25 3.23 4.15 -1.70 -0.03 115.11 120.56 1dq8 h GLN 510 Ca 0.00 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1dq8 h GLN 510 Cb 0.43 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.11 1dq8 h GLN 510 CO 0.00 0.03 0.00 0.66 -1.93 0.00 0.00 178.83 177.59 1dq8 n TYR 511 N -5.43 0.31 -2.97 3.99 4.02 -1.26 -4.79 117.16 111.04 1dq8 n TYR 511 Ca 0.22 -0.16 -0.43 0.00 -0.01 0.00 0.00 57.90 57.52 1dq8 n TYR 511 Cb 0.72 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.99 1dq8 n TYR 511 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1dq8 s LEU 512 N -1.60 4.41 0.77 7.72 1.98 -0.03 -5.03 118.68 126.91 1dq8 s LEU 512 Ca 0.35 -0.48 -0.14 0.00 -2.89 0.00 0.00 54.13 50.97 1dq8 s LEU 512 Cb 0.20 -2.73 0.06 0.00 0.66 0.00 0.00 46.19 44.39 1dq8 s LEU 512 CO 0.29 -1.05 1.18 -2.84 -1.89 0.00 0.00 176.35 172.05 1dq8 s PRO 513 N 3.37 1.91 0.00 0.98 0.02 -1.26 -4.87 135.00 135.15 1dq8 s PRO 513 Ca 0.25 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.94 1dq8 s PRO 513 Cb -0.15 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.56 1dq8 s PRO 513 CO 0.18 -1.99 0.00 2.48 -0.33 0.00 0.00 177.00 177.33 1dq8 n TYR 514 N -3.10 0.00 -2.36 6.54 0.18 -1.26 -1.68 117.16 115.48 1dq8 n TYR 514 Ca 0.13 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.57 1dq8 n TYR 514 Cb 0.51 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.45 1dq8 n TYR 514 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1dq8 s ARG 515 N -0.61 3.60 -1.13 -3.48 0.52 -1.26 -4.27 118.95 112.31 1dq8 s ARG 515 Ca 0.00 1.35 -0.05 0.00 -0.52 0.00 0.00 55.73 56.51 1dq8 s ARG 515 Cb 0.00 -2.06 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 1dq8 s ARG 515 CO 0.00 -0.60 0.91 -0.25 0.02 0.00 0.00 175.30 175.38 1dq8 n ASP 516 N -1.32 -4.65 -3.82 0.23 9.92 -1.26 -5.03 116.55 110.63 1dq8 n ASP 516 Ca 0.09 -0.73 -0.13 0.00 -0.53 0.00 0.00 54.79 53.50 1dq8 n ASP 516 Cb 0.52 -4.88 -0.14 0.00 -0.64 0.00 0.00 41.12 35.98 1dq8 n ASP 516 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1dq8 s TYR 517 N -3.42 -0.05 -0.82 1.24 5.04 -1.26 -5.09 117.35 112.98 1dq8 s TYR 517 Ca 0.28 0.19 -0.25 0.00 -2.44 0.00 0.00 57.07 54.86 1dq8 s TYR 517 Cb -0.05 -0.06 -0.00 0.00 0.35 0.00 0.00 41.96 42.20 1dq8 s TYR 517 CO 0.76 -0.06 1.67 1.21 -1.34 0.00 0.00 175.55 177.78 1dq8 s ASN 518 N 0.45 5.71 0.25 4.32 3.84 -1.26 -4.78 114.94 123.46 1dq8 s ASN 518 Ca -0.04 -0.56 0.25 0.00 0.21 0.00 0.00 52.86 52.73 1dq8 s ASN 518 Cb -0.05 -2.55 0.66 0.00 -0.55 0.00 0.00 41.25 38.75 1dq8 s ASN 518 CO -0.02 -2.17 1.69 1.88 -2.79 0.00 0.00 177.10 175.69 1dq8 h TYR 519 N 11.61 0.00 -0.42 0.43 -1.99 -1.97 -3.31 116.97 121.32 1dq8 h TYR 519 Ca -0.05 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.65 1dq8 h TYR 519 Cb 1.06 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.76 1dq8 h TYR 519 CO 1.17 0.00 0.13 0.66 -0.00 0.00 0.00 178.16 180.12 1dq8 h SER 520 N 0.00 0.55 1.06 3.88 4.64 -1.93 0.14 113.55 121.89 1dq8 h SER 520 Ca 0.00 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.16 1dq8 h SER 520 Cb 0.80 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 1dq8 h SER 520 CO 0.00 0.54 -0.43 -0.07 -0.87 0.00 0.00 176.83 175.99 1dq8 h LEU 521 N 0.60 0.00 0.00 5.97 4.07 -1.97 -3.31 115.31 120.66 1dq8 h LEU 521 Ca 0.14 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.06 1dq8 h LEU 521 Cb 0.19 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 1dq8 h LEU 521 CO -0.01 0.43 -0.26 0.58 -1.08 0.00 0.00 178.44 178.11 1dq8 h VAL 522 N 0.00 1.51 -2.32 1.22 2.07 -1.41 -3.42 116.25 113.91 1dq8 h VAL 522 Ca -0.00 -2.23 -0.57 0.00 0.82 0.00 0.00 66.70 64.71 1dq8 h VAL 522 Cb 1.08 2.96 0.05 0.00 -1.52 0.00 0.00 31.29 33.86 1dq8 h VAL 522 CO 0.06 0.51 0.89 0.23 0.02 0.00 0.00 177.57 179.28 1dq8 n MET 523 N -4.58 2.30 -0.99 1.57 2.81 0.38 -0.75 117.12 117.86 1dq8 n MET 523 Ca -0.14 0.83 0.00 0.00 -1.81 0.00 0.00 57.70 56.58 1dq8 n MET 523 Cb 0.49 -2.63 0.00 0.00 -0.71 0.00 0.00 33.22 30.37 1dq8 n MET 523 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1dq8 n GLY 524 N 3.68 0.59 0.00 3.03 0.00 -1.26 -4.74 105.19 106.49 1dq8 n GLY 524 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1dq8 n GLY 524 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dq8 n ALA 525 N 1.00 0.62 0.00 4.61 0.00 -0.86 -5.02 120.51 120.87 1dq8 n ALA 525 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1dq8 n ALA 525 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1dq8 n ALA 525 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dq8 s GLU 528 N -0.76 1.86 -1.39 0.00 8.01 -1.26 -4.40 118.70 120.75 1dq8 s GLU 528 Ca -0.01 -1.75 -0.04 0.00 0.01 0.00 0.00 54.97 53.18 1dq8 s GLU 528 Cb -0.02 -1.84 0.02 0.00 -4.31 0.00 0.00 34.13 27.99 1dq8 s GLU 528 CO 0.00 0.27 0.69 -1.71 0.01 0.00 0.00 175.26 174.52 1dq8 n ASN 529 N -0.74 -1.77 -4.71 -0.19 2.85 -1.26 -4.87 115.26 104.56 1dq8 n ASN 529 Ca -0.05 -0.86 -0.42 0.00 -0.11 0.00 0.00 54.58 53.14 1dq8 n ASN 529 Cb 0.61 -3.74 -0.03 0.00 1.24 0.00 0.00 39.78 37.86 1dq8 n ASN 529 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1dq8 s VAL 530 N -3.65 3.35 -0.05 3.44 1.01 -1.26 -4.92 120.40 118.33 1dq8 s VAL 530 Ca 0.16 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.11 1dq8 s VAL 530 Cb -0.08 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.69 1dq8 s VAL 530 CO 0.84 0.07 0.91 2.30 0.00 0.00 0.00 175.10 179.22 1dq8 n ILE 531 N 4.00 0.80 -0.14 2.22 -5.35 -1.26 -4.63 119.36 115.01 1dq8 n ILE 531 Ca 0.12 -0.90 0.00 0.00 -0.27 0.00 0.00 62.75 61.69 1dq8 n ILE 531 Cb 0.42 0.60 0.00 0.00 -1.74 0.00 0.00 39.64 38.93 1dq8 n ILE 531 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dq8 n GLY 532 N -0.36 0.40 3.21 3.28 0.00 -1.26 -4.82 105.19 105.64 1dq8 n GLY 532 Ca 0.00 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.51 1dq8 n GLY 532 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1dq8 s TYR 533 N -3.88 -0.08 -0.32 1.61 -0.85 -0.68 -4.96 117.35 108.19 1dq8 s TYR 533 Ca 0.00 0.03 -0.07 0.00 -0.52 0.00 0.00 57.07 56.51 1dq8 s TYR 533 Cb 0.00 0.05 0.03 0.00 0.38 0.00 0.00 41.96 42.41 1dq8 s TYR 533 CO 0.00 -0.41 0.10 1.41 -1.52 0.00 0.00 175.55 175.13 1dq8 s MET 534 N -1.85 2.84 -0.08 -3.49 -2.45 -1.26 -4.17 119.30 108.85 1dq8 s MET 534 Ca -0.10 -1.03 -0.30 0.00 -1.25 0.00 0.00 55.69 53.01 1dq8 s MET 534 Cb -0.04 -3.44 -0.03 0.00 1.25 0.00 0.00 34.83 32.58 1dq8 s MET 534 CO 0.01 -0.57 1.17 -2.14 1.05 0.00 0.00 175.02 174.53 1dq8 s PRO 535 N 1.46 4.35 -0.20 4.11 0.02 -1.26 -5.02 135.00 138.45 1dq8 s PRO 535 Ca 0.00 1.62 -0.03 0.00 0.02 0.00 0.00 61.00 62.61 1dq8 s PRO 535 Cb -0.18 -3.57 -0.00 0.00 0.02 0.00 0.00 34.50 30.76 1dq8 s PRO 535 CO 0.03 -0.45 -0.08 0.42 -0.33 0.00 0.00 177.00 176.59 1dq8 s ILE 536 N 2.31 3.14 0.27 2.83 -1.09 -1.26 -5.09 121.20 122.31 1dq8 s ILE 536 Ca 0.54 -0.58 -0.30 0.00 -2.23 0.00 0.00 60.65 58.08 1dq8 s ILE 536 Cb -0.23 -2.41 -0.13 0.00 -1.58 0.00 0.00 42.46 38.11 1dq8 s ILE 536 CO 0.20 0.45 1.29 -2.65 -1.23 0.00 0.00 174.94 173.00 1dq8 n PRO 537 N 4.63 1.87 -4.25 2.79 -0.02 -1.25 -4.75 135.00 134.03 1dq8 n PRO 537 Ca -0.19 0.66 -0.33 0.00 -2.02 0.00 0.00 63.50 61.62 1dq8 n PRO 537 Cb 0.51 -2.24 -0.16 0.00 -0.02 0.00 0.00 33.50 31.59 1dq8 n PRO 537 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dq8 s VAL 538 N -0.51 2.45 0.42 -1.45 1.01 -1.26 -0.77 120.40 120.29 1dq8 s VAL 538 Ca 0.64 -0.82 0.07 0.00 0.00 0.00 0.00 61.98 61.87 1dq8 s VAL 538 Cb -0.65 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.63 1dq8 s VAL 538 CO 0.55 0.51 0.16 -0.83 0.00 0.00 0.00 175.10 175.49 1dq8 s GLY 539 N 1.15 2.38 -0.03 4.51 0.00 0.53 -4.91 107.32 110.96 1dq8 s GLY 539 Ca 0.01 -2.08 0.04 0.00 0.00 0.00 0.00 44.72 42.69 1dq8 s GLY 539 CO -0.07 -1.95 -0.14 0.54 0.00 0.00 0.00 173.10 171.48 1dq8 s VAL 540 N -2.63 1.17 -0.13 1.40 0.11 -1.26 -0.11 120.40 118.94 1dq8 s VAL 540 Ca 0.39 -0.59 0.03 0.00 -2.93 0.00 0.00 61.98 58.88 1dq8 s VAL 540 Cb 0.05 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.90 1dq8 s VAL 540 CO 0.21 0.34 -0.22 0.00 -3.33 0.00 0.00 175.10 172.11 1dq8 s ALA 541 N -0.01 2.26 0.00 1.54 0.00 -0.20 -4.90 121.76 120.45 1dq8 s ALA 541 Ca -0.01 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1dq8 s ALA 541 Cb -0.09 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 22.04 1dq8 s ALA 541 CO 0.01 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.21 1dq8 n GLY 542 N 3.97 -0.25 3.77 0.00 0.00 -1.26 -1.02 105.19 110.40 1dq8 n GLY 542 Ca -0.20 -1.03 -0.38 0.00 0.00 0.00 0.00 46.02 44.42 1dq8 n GLY 542 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1dq8 s PRO 543 N -2.00 4.63 -0.35 1.61 0.04 -1.26 -4.93 135.00 132.74 1dq8 s PRO 543 Ca 0.00 1.38 -0.18 0.00 0.04 0.00 0.00 61.00 62.24 1dq8 s PRO 543 Cb 0.00 -2.89 -0.01 0.00 0.04 0.00 0.00 34.50 31.64 1dq8 s PRO 543 CO 0.00 0.31 0.50 -1.17 0.04 0.00 0.00 177.00 176.68 1dq8 s LEU 544 N -1.89 4.35 -0.68 -3.56 2.96 0.42 -4.66 118.68 115.63 1dq8 s LEU 544 Ca 0.48 -0.04 -0.22 0.00 -0.22 0.00 0.00 54.13 54.14 1dq8 s LEU 544 Cb -0.20 -2.56 0.08 0.00 0.50 0.00 0.00 46.19 44.01 1dq8 s LEU 544 CO 0.26 -0.46 0.94 0.00 -1.32 0.00 0.00 176.35 175.77 1dq8 s LEU 546 N 3.71 1.47 -1.48 0.00 2.96 -0.68 -0.23 118.68 124.43 1dq8 s LEU 546 Ca 0.22 -0.37 -0.06 0.00 -0.22 0.00 0.00 54.13 53.69 1dq8 s LEU 546 Cb -0.17 -0.97 0.05 0.00 0.50 0.00 0.00 46.19 45.60 1dq8 s LEU 546 CO 0.07 -0.06 0.63 0.47 -1.32 0.00 0.00 176.35 176.14 1dq8 n ASP 547 N 4.61 -1.77 -0.02 3.68 8.00 0.60 -1.39 116.55 130.26 1dq8 n ASP 547 Ca -0.16 -0.95 -0.00 0.00 0.71 0.00 0.00 54.79 54.39 1dq8 n ASP 547 Cb 0.50 -3.26 -0.00 0.00 -0.02 0.00 0.00 41.12 38.34 1dq8 n ASP 547 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1dq8 n GLU 548 N -4.42 -0.83 -4.59 -1.24 1.02 -1.26 -4.99 120.64 104.33 1dq8 n GLU 548 Ca -0.17 0.23 -0.29 0.00 -0.02 0.00 0.00 57.16 56.91 1dq8 n GLU 548 Cb 0.62 -3.87 -0.09 0.00 -0.02 0.00 0.00 31.44 28.08 1dq8 n GLU 548 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1dq8 s LYS 549 N -0.91 2.08 -0.10 3.49 1.02 -0.48 -5.14 119.74 119.70 1dq8 s LYS 549 Ca 0.00 -2.18 -0.01 0.00 0.02 0.00 0.00 55.97 53.80 1dq8 s LYS 549 Cb 0.00 -1.66 0.03 0.00 -0.52 0.00 0.00 37.83 35.68 1dq8 s LYS 549 CO 0.00 -0.19 -0.05 -1.21 -0.92 0.00 0.00 175.35 172.98 1dq8 s GLU 550 N -3.81 1.23 0.04 1.68 2.02 -1.26 -1.69 118.70 116.91 1dq8 s GLU 550 Ca 0.25 -0.14 0.05 0.00 0.02 0.00 0.00 54.97 55.16 1dq8 s GLU 550 Cb 0.06 -1.38 -0.03 0.00 0.10 0.00 0.00 34.13 32.87 1dq8 s GLU 550 CO 0.13 -0.27 -0.10 -0.06 0.02 0.00 0.00 175.26 174.98 1dq8 s PHE 551 N 1.76 2.77 -0.40 1.61 0.40 -0.22 -4.87 117.98 119.03 1dq8 s PHE 551 Ca 0.04 -0.13 -0.06 0.00 -0.60 0.00 0.00 56.93 56.19 1dq8 s PHE 551 Cb -0.13 -1.53 0.08 0.00 0.51 0.00 0.00 43.02 41.96 1dq8 s PHE 551 CO -0.07 0.35 0.21 -0.65 0.70 0.00 0.00 175.22 175.76 1dq8 s GLN 552 N -1.61 2.41 -0.34 0.44 -1.52 -1.26 -0.43 119.66 117.34 1dq8 s GLN 552 Ca 0.18 -1.54 -0.22 0.00 -1.95 0.00 0.00 55.36 51.82 1dq8 s GLN 552 Cb -0.11 -3.64 0.00 0.00 -0.22 0.00 0.00 33.01 29.04 1dq8 s GLN 552 CO 0.08 -0.95 0.71 0.08 -0.25 0.00 0.00 175.29 174.97 1dq8 s VAL 553 N 1.32 4.83 0.19 1.09 1.01 -0.19 -4.63 120.40 124.01 1dq8 s VAL 553 Ca 0.03 0.83 -0.30 0.00 0.00 0.00 0.00 61.98 62.55 1dq8 s VAL 553 Cb -0.23 -4.12 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 1dq8 s VAL 553 CO -0.00 -0.32 0.99 -2.16 0.00 0.00 0.00 175.10 173.61 1dq8 s PRO 554 N 2.87 4.74 -0.07 2.72 0.04 -1.26 -1.04 135.00 143.00 1dq8 s PRO 554 Ca 0.28 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.84 1dq8 s PRO 554 Cb -0.14 -3.31 0.03 0.00 0.04 0.00 0.00 34.50 31.12 1dq8 s PRO 554 CO 0.15 0.31 0.01 -1.64 0.04 0.00 0.00 177.00 175.87 1dq8 s MET 555 N -0.63 0.50 -0.34 4.56 -1.94 0.84 -4.34 119.30 117.96 1dq8 s MET 555 Ca 0.45 0.15 -0.16 0.00 -1.71 0.00 0.00 55.69 54.42 1dq8 s MET 555 Cb -0.26 -0.90 -0.01 0.00 2.01 0.00 0.00 34.83 35.67 1dq8 s MET 555 CO 0.32 -0.30 0.41 0.00 -0.01 0.00 0.00 175.02 175.44 1dq8 s ALA 556 N 1.99 3.50 0.23 3.03 0.00 -0.39 -0.34 121.76 129.77 1dq8 s ALA 556 Ca 0.05 -1.10 -0.19 0.00 0.00 0.00 0.00 51.96 50.72 1dq8 s ALA 556 Cb -0.12 -2.87 0.03 0.00 0.00 0.00 0.00 23.12 20.15 1dq8 s ALA 556 CO -0.05 -1.07 0.60 -0.08 0.00 0.00 0.00 175.76 175.17 1dq8 s THR 557 N 2.14 0.01 0.00 0.00 -1.32 0.05 -4.27 115.64 112.25 1dq8 s THR 557 Ca 0.14 -0.83 0.00 0.00 -1.21 0.00 0.00 61.69 59.79 1dq8 s THR 557 Cb -0.16 -1.73 0.00 0.00 -1.51 0.00 0.00 72.50 69.10 1dq8 s THR 557 CO 0.12 -0.04 0.67 0.35 -2.21 0.00 0.00 174.62 173.50 1dq8 n THR 558 N -0.40 0.42 -3.11 5.08 -2.24 -1.26 -3.90 114.28 108.87 1dq8 n THR 558 Ca -0.08 -0.62 -0.42 0.00 -2.27 0.00 0.00 64.05 60.66 1dq8 n THR 558 Cb 0.61 0.88 -0.07 0.00 -2.10 0.00 0.00 70.33 69.66 1dq8 n THR 558 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1dq8 s GLU 559 N -0.42 3.46 0.44 -0.78 2.12 -1.26 -5.04 118.70 117.22 1dq8 s GLU 559 Ca 0.00 -0.18 -0.26 0.00 0.36 0.00 0.00 54.97 54.90 1dq8 s GLU 559 Cb 0.00 -3.89 -0.09 0.00 0.26 0.00 0.00 34.13 30.42 1dq8 s GLU 559 CO 0.00 -0.89 1.41 0.20 -0.54 0.00 0.00 175.26 175.44 1dq8 s GLY 560 N 1.91 2.92 0.00 -1.50 0.00 -1.26 -2.79 107.32 106.60 1dq8 s GLY 560 Ca 0.23 1.43 0.00 0.00 0.00 0.00 0.00 44.72 46.39 1dq8 s GLY 560 CO 0.17 2.04 0.00 0.00 0.00 0.00 0.00 173.10 175.32 1dq8 h LEU 562 N 0.00 0.28 -0.30 0.00 5.85 -1.95 0.24 115.31 119.43 1dq8 h LEU 562 Ca 0.00 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 1dq8 h LEU 562 Cb 0.00 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1dq8 h LEU 562 CO 0.00 0.22 -0.05 0.58 -0.34 0.00 0.00 178.44 178.85 1dq8 h VAL 563 N 0.32 1.27 -0.63 1.05 2.07 -1.90 -0.67 116.25 117.76 1dq8 h VAL 563 Ca 0.09 -1.05 0.04 0.00 0.82 0.00 0.00 66.70 66.60 1dq8 h VAL 563 Cb -0.02 1.35 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 1dq8 h VAL 563 CO -0.02 0.34 0.37 0.00 0.02 0.00 0.00 177.57 178.28 1dq8 h ALA 564 N 0.81 0.83 -0.33 1.67 0.00 -1.89 0.18 119.26 120.52 1dq8 h ALA 564 Ca 0.08 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1dq8 h ALA 564 Cb 0.52 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1dq8 h ALA 564 CO 0.02 0.09 -0.08 1.03 0.00 0.00 0.00 179.25 180.31 1dq8 h SER 565 N 0.72 0.65 -0.31 0.00 0.87 -0.37 -0.58 113.55 114.53 1dq8 h SER 565 Ca 0.27 -0.37 -0.08 0.00 -1.23 0.00 0.00 61.79 60.38 1dq8 h SER 565 Cb 0.08 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1dq8 h SER 565 CO -0.13 0.87 -0.09 0.74 -0.53 0.00 0.00 176.83 177.69 1dq8 h THR 566 N 0.43 1.25 -0.28 2.23 2.02 -0.74 -1.51 112.91 116.31 1dq8 h THR 566 Ca 0.08 -1.10 -0.08 0.00 0.77 0.00 0.00 66.41 66.08 1dq8 h THR 566 Cb 0.58 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1dq8 h THR 566 CO 0.03 0.37 -0.18 -1.13 0.37 0.00 0.00 175.52 174.99 1dq8 h ASN 567 N 0.66 0.49 -0.38 4.18 -0.00 -0.45 -0.77 115.58 119.31 1dq8 h ASN 567 Ca 0.12 -0.14 -0.14 0.00 -0.00 0.00 0.00 56.30 56.14 1dq8 h ASN 567 Cb 0.54 -0.13 -0.01 0.00 -0.00 0.00 0.00 38.32 38.72 1dq8 h ASN 567 CO 0.03 0.68 -0.30 -0.09 -0.00 0.00 0.00 177.43 177.76 1dq8 h ARG 568 N 0.45 0.87 -0.61 6.67 2.43 -0.60 -1.82 114.38 121.76 1dq8 h ARG 568 Ca 0.08 -0.43 -0.06 0.00 -0.81 0.00 0.00 59.98 58.76 1dq8 h ARG 568 Cb 0.57 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 1dq8 h ARG 568 CO 0.04 1.07 0.15 0.78 -1.51 0.00 0.00 179.97 180.50 1dq8 h GLY 569 N 0.68 1.06 0.66 2.80 0.00 -0.98 -2.22 103.07 105.06 1dq8 h GLY 569 Ca 0.07 -0.66 0.08 0.00 0.00 0.00 0.00 47.33 46.81 1dq8 h GLY 569 CO 0.08 0.62 0.55 0.00 0.00 0.00 0.00 176.54 177.79 1dq8 h ARG 571 N 0.98 0.88 -0.55 0.00 9.65 -0.77 0.88 114.38 125.45 1dq8 h ARG 571 Ca 0.40 -0.06 -0.11 0.00 -1.10 0.00 0.00 59.98 59.12 1dq8 h ARG 571 Cb 0.24 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 28.61 1dq8 h ARG 571 CO -0.20 0.59 -0.08 0.00 2.80 0.00 0.00 179.97 183.09 1dq8 h ALA 572 N 1.24 0.83 -0.47 2.80 0.00 -0.88 -1.95 119.26 120.83 1dq8 h ALA 572 Ca 0.24 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1dq8 h ALA 572 Cb -0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1dq8 h ALA 572 CO -0.05 0.66 0.04 0.82 0.00 0.00 0.00 179.25 180.72 1dq8 h ILE 573 N 0.90 1.25 -0.32 0.00 2.04 -0.78 -2.45 117.51 118.16 1dq8 h ILE 573 Ca 0.15 -0.97 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 1dq8 h ILE 573 Cb 0.63 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1dq8 h ILE 573 CO 0.04 0.34 0.18 1.23 0.00 0.00 0.00 178.15 179.94 1dq8 h GLY 574 N 0.65 0.49 1.92 5.37 0.00 -0.65 -1.14 103.07 109.71 1dq8 h GLY 574 Ca 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1dq8 h GLY 574 CO 0.02 0.21 0.00 1.04 0.00 0.00 0.00 176.54 177.81 1dq8 n LEU 575 N -4.79 0.00 -1.06 3.11 4.77 -0.75 -2.32 117.00 115.97 1dq8 n LEU 575 Ca -0.01 0.46 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 1dq8 n LEU 575 Cb 0.08 -0.46 0.27 0.00 -2.33 0.00 0.00 43.42 40.97 1dq8 n LEU 575 CO 0.35 -0.16 0.73 0.61 -1.33 0.00 0.00 177.39 177.59 1dq8 n GLY 576 N 0.43 1.58 0.83 -0.72 0.00 -0.86 -4.85 105.19 101.59 1dq8 n GLY 576 Ca 0.05 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1dq8 n GLY 576 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dq8 n GLY 577 N 1.44 0.77 0.00 -0.02 0.00 -0.98 -4.70 105.19 101.70 1dq8 n GLY 577 Ca 0.19 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1dq8 n GLY 577 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dq8 n GLY 578 N -2.42 -1.46 3.65 -0.02 0.00 -0.49 -5.02 105.19 99.43 1dq8 n GLY 578 Ca 0.00 -1.57 -0.25 0.00 0.00 0.00 0.00 46.02 44.20 1dq8 n GLY 578 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dq8 s ALA 579 N -2.36 3.18 0.04 4.61 0.00 0.68 -4.63 121.76 123.27 1dq8 s ALA 579 Ca 0.00 -1.49 0.06 0.00 0.00 0.00 0.00 51.96 50.53 1dq8 s ALA 579 Cb 0.00 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 1dq8 s ALA 579 CO 0.00 0.39 -0.17 -1.12 0.00 0.00 0.00 175.76 174.85 1dq8 s SER 580 N -3.25 2.06 0.09 0.00 0.01 -0.73 -0.29 113.70 111.58 1dq8 s SER 580 Ca 0.29 -0.48 -0.00 0.00 1.31 0.00 0.00 55.95 57.06 1dq8 s SER 580 Cb -0.08 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 1dq8 s SER 580 CO 0.19 0.10 -0.01 -0.94 0.41 0.00 0.00 173.24 172.99 1dq8 s SER 581 N -1.12 0.60 -0.06 2.44 1.04 -1.26 -1.04 113.70 114.30 1dq8 s SER 581 Ca 0.05 -1.07 -0.09 0.00 0.48 0.00 0.00 55.95 55.32 1dq8 s SER 581 Cb -0.08 0.20 0.02 0.00 0.10 0.00 0.00 66.02 66.26 1dq8 s SER 581 CO 0.01 -0.61 0.22 -0.13 0.98 0.00 0.00 173.24 173.71 1dq8 s ARG 582 N -3.94 0.37 -0.28 4.02 1.81 -0.61 -5.00 118.95 115.31 1dq8 s ARG 582 Ca 0.14 0.09 -0.14 0.00 -1.72 0.00 0.00 55.73 54.10 1dq8 s ARG 582 Cb 0.07 0.17 -0.04 0.00 -0.45 0.00 0.00 34.95 34.70 1dq8 s ARG 582 CO -0.05 -0.07 0.31 0.08 -0.68 0.00 0.00 175.30 174.90 1dq8 s VAL 583 N -0.41 5.22 -0.05 3.52 1.01 -1.26 -1.46 120.40 126.97 1dq8 s VAL 583 Ca -0.05 0.36 0.13 0.00 0.00 0.00 0.00 61.98 62.42 1dq8 s VAL 583 Cb -0.03 -3.67 -0.18 0.00 0.00 0.00 0.00 36.38 32.50 1dq8 s VAL 583 CO 0.01 0.15 0.86 -0.07 0.00 0.00 0.00 175.10 176.05 1dq8 h LEU 584 N 8.55 0.00 -7.00 3.92 3.38 -0.59 -3.49 115.31 120.09 1dq8 h LEU 584 Ca -0.32 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.66 1dq8 h LEU 584 Cb 1.17 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.78 1dq8 h LEU 584 CO 0.62 0.83 0.30 0.00 0.09 0.00 0.00 178.44 180.28 1dq8 s ALA 585 N -2.74 -1.68 -0.24 1.53 0.00 -1.19 -4.96 121.76 112.46 1dq8 s ALA 585 Ca -0.03 0.73 -0.03 0.00 0.00 0.00 0.00 51.96 52.63 1dq8 s ALA 585 Cb 0.08 0.65 0.13 0.00 0.00 0.00 0.00 23.12 23.98 1dq8 s ALA 585 CO 0.81 -0.70 0.40 0.34 0.00 0.00 0.00 175.76 176.61 1dq8 s ASP 586 N -2.51 0.04 -0.30 0.00 2.15 -1.25 -1.43 116.67 113.37 1dq8 s ASP 586 Ca 0.01 0.37 -0.18 0.00 0.43 0.00 0.00 52.55 53.17 1dq8 s ASP 586 Cb -0.01 1.23 0.19 0.00 -0.30 0.00 0.00 42.92 44.03 1dq8 s ASP 586 CO -0.10 -0.29 1.23 -0.83 -0.17 0.00 0.00 175.17 175.02 1dq8 s GLY 587 N 2.58 0.18 0.61 2.66 0.00 0.24 -4.41 107.32 109.17 1dq8 s GLY 587 Ca 0.12 3.52 -0.14 0.00 0.00 0.00 0.00 44.72 48.23 1dq8 s GLY 587 CO -0.16 3.40 1.03 -0.29 0.00 0.00 0.00 173.10 177.09 1dq8 s MET 588 N 2.18 3.44 0.13 2.90 1.75 -0.38 -0.62 119.30 128.71 1dq8 s MET 588 Ca -0.00 0.98 0.02 0.00 -1.25 0.00 0.00 55.69 55.44 1dq8 s MET 588 Cb -0.02 -2.06 -0.04 0.00 2.84 0.00 0.00 34.83 35.55 1dq8 s MET 588 CO -0.16 -0.69 -0.05 0.95 -0.65 0.00 0.00 175.02 174.42 1dq8 s THR 589 N -2.81 0.79 -0.10 10.11 -4.23 -1.26 -1.18 115.64 116.96 1dq8 s THR 589 Ca 0.59 -1.98 -0.04 0.00 -1.18 0.00 0.00 61.69 59.08 1dq8 s THR 589 Cb -0.13 -1.86 0.05 0.00 1.34 0.00 0.00 72.50 71.91 1dq8 s THR 589 CO 0.44 -0.72 0.22 -0.60 -0.54 0.00 0.00 174.62 173.42 1dq8 s ARG 590 N -3.84 0.15 -0.77 3.99 6.06 -0.91 -4.89 118.95 118.73 1dq8 s ARG 590 Ca 0.17 0.55 0.03 0.00 -2.50 0.00 0.00 55.73 53.98 1dq8 s ARG 590 Cb 0.05 -0.13 0.19 0.00 0.06 0.00 0.00 34.95 35.12 1dq8 s ARG 590 CO -0.01 -0.21 0.62 0.41 -2.50 0.00 0.00 175.30 173.61 1dq8 n GLY 591 N 4.60 4.12 3.75 8.12 0.00 -1.26 -1.01 105.19 123.52 1dq8 n GLY 591 Ca -0.19 -2.61 -0.35 0.00 0.00 0.00 0.00 46.02 42.87 1dq8 n GLY 591 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1dq8 s PRO 592 N -1.53 2.80 -0.16 1.61 0.04 -1.09 -0.59 135.00 136.09 1dq8 s PRO 592 Ca 0.27 1.67 -0.05 0.00 0.04 0.00 0.00 61.00 62.93 1dq8 s PRO 592 Cb -0.04 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1dq8 s PRO 592 CO -0.15 -1.30 0.01 0.54 0.04 0.00 0.00 177.00 176.14 1dq8 s VAL 593 N -1.89 4.35 0.20 -0.36 0.11 -0.56 -2.13 120.40 120.12 1dq8 s VAL 593 Ca 0.74 -0.20 0.09 0.00 -2.93 0.00 0.00 61.98 59.67 1dq8 s VAL 593 Cb -0.27 -2.92 -0.04 0.00 -1.53 0.00 0.00 36.38 31.62 1dq8 s VAL 593 CO 0.37 0.49 -0.17 -0.69 -3.33 0.00 0.00 175.10 171.77 1dq8 s VAL 594 N 0.22 1.90 -0.01 2.04 1.01 -0.12 -2.28 120.40 123.15 1dq8 s VAL 594 Ca 0.01 -2.09 0.00 0.00 0.00 0.00 0.00 61.98 59.90 1dq8 s VAL 594 Cb -0.13 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1dq8 s VAL 594 CO 0.02 -0.42 -0.00 -0.60 0.00 0.00 0.00 175.10 174.10 1dq8 s ARG 595 N -3.19 0.09 0.33 2.72 3.52 0.90 -0.76 118.95 122.55 1dq8 s ARG 595 Ca 0.20 0.02 0.09 0.00 -0.13 0.00 0.00 55.73 55.91 1dq8 s ARG 595 Cb -0.04 -0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 33.14 1dq8 s ARG 595 CO 0.08 -0.03 0.04 -0.51 -0.81 0.00 0.00 175.30 174.07 1dq8 s LEU 596 N 0.30 3.09 0.42 -0.88 1.02 -0.60 0.77 118.68 122.81 1dq8 s LEU 596 Ca -0.03 -0.87 0.10 0.00 0.02 0.00 0.00 54.13 53.35 1dq8 s LEU 596 Cb -0.04 -1.52 0.93 0.00 0.02 0.00 0.00 46.19 45.58 1dq8 s LEU 596 CO -0.01 -0.21 2.03 -0.65 0.02 0.00 0.00 176.35 177.53 1dq8 h PRO 597 N 1.76 0.48 -4.13 1.29 0.11 -1.86 -3.45 132.00 126.19 1dq8 h PRO 597 Ca -0.43 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 1dq8 h PRO 597 Cb 1.25 -0.11 -0.15 0.00 0.11 0.00 0.00 31.00 32.11 1dq8 h PRO 597 CO 0.65 0.32 -0.58 1.03 -0.21 0.00 0.00 178.00 179.21 1dq8 s ARG 598 N -5.45 0.73 0.37 1.05 1.81 -1.26 -4.99 118.95 111.21 1dq8 s ARG 598 Ca -0.08 -1.17 0.10 0.00 -1.72 0.00 0.00 55.73 52.86 1dq8 s ARG 598 Cb 0.18 0.26 0.72 0.00 -0.45 0.00 0.00 34.95 35.66 1dq8 s ARG 598 CO 0.74 -0.18 1.86 0.00 -0.68 0.00 0.00 175.30 177.03 1dq8 h ALA 599 N 2.98 1.41 -0.04 2.13 0.00 -1.87 -1.17 119.26 122.71 1dq8 h ALA 599 Ca -0.34 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 1dq8 h ALA 599 Cb 1.17 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1dq8 h ALA 599 CO 0.62 0.42 -0.19 0.00 0.00 0.00 0.00 179.25 180.09 1dq8 h ASP 601 N 0.05 0.23 -0.69 0.00 3.32 -1.64 -2.08 116.42 115.61 1dq8 h ASP 601 Ca 0.01 -0.77 -0.01 0.00 0.02 0.00 0.00 57.03 56.28 1dq8 h ASP 601 Cb 0.37 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1dq8 h ASP 601 CO 0.03 0.97 0.40 0.77 -1.72 0.00 0.00 179.24 179.68 1dq8 h SER 602 N -0.48 0.86 -0.72 6.45 4.64 -1.16 -0.09 113.55 123.06 1dq8 h SER 602 Ca -0.03 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.19 1dq8 h SER 602 Cb 1.00 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.84 1dq8 h SER 602 CO 0.05 0.69 0.29 0.00 -0.87 0.00 0.00 176.83 176.98 1dq8 h ALA 603 N 1.46 0.93 -0.66 5.18 0.00 -0.88 -0.39 119.26 124.90 1dq8 h ALA 603 Ca 0.25 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1dq8 h ALA 603 Cb 0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1dq8 h ALA 603 CO -0.04 0.55 0.44 1.49 0.00 0.00 0.00 179.25 181.69 1dq8 h GLU 604 N 1.03 0.86 -0.69 0.00 4.81 -0.41 -0.21 114.58 119.96 1dq8 h GLU 604 Ca 0.24 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1dq8 h GLU 604 Cb 0.21 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1dq8 h GLU 604 CO -0.02 0.57 0.21 0.28 -0.73 0.00 0.00 179.01 179.32 1dq8 h VAL 605 N 0.88 1.25 -0.31 0.32 2.07 -0.50 -1.48 116.25 118.49 1dq8 h VAL 605 Ca 0.25 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.85 1dq8 h VAL 605 Cb -0.08 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1dq8 h VAL 605 CO -0.06 0.34 0.08 0.50 0.02 0.00 0.00 177.57 178.46 1dq8 h LYS 606 N 1.03 0.49 -0.47 1.57 3.64 -0.56 0.02 116.57 122.29 1dq8 h LYS 606 Ca 0.22 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1dq8 h LYS 606 Cb 0.30 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1dq8 h LYS 606 CO -0.01 0.55 0.30 0.00 -2.27 0.00 0.00 179.45 178.02 1dq8 h ALA 607 N 0.92 0.60 -0.21 5.00 0.00 -0.84 -1.93 119.26 122.80 1dq8 h ALA 607 Ca 0.10 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1dq8 h ALA 607 Cb 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1dq8 h ALA 607 CO -0.00 0.01 0.13 2.35 0.00 0.00 0.00 179.25 181.73 1dq8 h TRP 608 N 0.60 0.24 0.00 0.00 7.01 -1.10 -1.66 115.95 121.05 1dq8 h TRP 608 Ca 0.18 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 1dq8 h TRP 608 Cb -0.03 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 26.95 1dq8 h TRP 608 CO -0.06 0.15 -0.04 -0.07 -2.79 0.00 0.00 178.44 175.64 1dq8 h LEU 609 N 0.26 0.00 -0.34 0.65 3.38 -0.73 -1.28 115.31 117.26 1dq8 h LEU 609 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1dq8 h LEU 609 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1dq8 h LEU 609 CO -0.03 0.04 -0.18 -0.62 0.09 0.00 0.00 178.44 177.73 1dq8 n GLU 610 N -3.53 0.72 -3.12 1.13 1.02 -0.65 -4.01 120.64 112.22 1dq8 n GLU 610 Ca -0.02 -0.34 -0.35 0.00 -0.02 0.00 0.00 57.16 56.43 1dq8 n GLU 610 Cb 0.14 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 1dq8 n GLU 610 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1dq8 s THR 611 N -2.51 4.61 0.44 2.62 -4.23 -0.48 -4.94 115.64 111.15 1dq8 s THR 611 Ca 0.26 1.15 0.11 0.00 -1.18 0.00 0.00 61.69 62.04 1dq8 s THR 611 Cb 0.20 -3.76 0.29 0.00 1.34 0.00 0.00 72.50 70.56 1dq8 s THR 611 CO 0.50 0.06 2.05 0.77 -0.54 0.00 0.00 174.62 177.47 1dq8 h SER 612 N 2.98 0.33 0.94 3.99 4.64 -1.89 0.20 113.55 124.74 1dq8 h SER 612 Ca -0.48 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.79 1dq8 h SER 612 Cb 1.19 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 63.21 1dq8 h SER 612 CO 0.65 0.23 -0.45 -0.08 -0.87 0.00 0.00 176.83 176.31 1dq8 h GLU 613 N 0.38 -1.21 -0.56 4.77 4.57 -1.92 -2.02 114.58 118.58 1dq8 h GLU 613 Ca 0.16 0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.38 1dq8 h GLU 613 Cb 0.15 0.28 -0.03 0.00 -0.16 0.00 0.00 28.75 28.99 1dq8 h GLU 613 CO -0.04 -0.81 0.18 0.78 -1.18 0.00 0.00 179.01 177.95 1dq8 h GLY 614 N -1.31 0.90 0.92 1.92 0.00 -1.57 -2.89 103.07 101.04 1dq8 h GLY 614 Ca -0.13 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1dq8 h GLY 614 CO 0.21 0.46 0.10 -2.75 0.00 0.00 0.00 176.54 174.56 1dq8 h PHE 615 N 0.82 0.27 -0.73 5.60 3.57 -0.95 -2.50 116.94 123.03 1dq8 h PHE 615 Ca 0.19 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.75 1dq8 h PHE 615 Cb 0.23 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.82 1dq8 h PHE 615 CO 0.01 0.28 0.41 0.00 -2.23 0.00 0.00 178.31 176.79 1dq8 h ALA 616 N 0.97 1.00 -0.56 2.41 0.00 -1.18 0.29 119.26 122.18 1dq8 h ALA 616 Ca 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1dq8 h ALA 616 Cb 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1dq8 h ALA 616 CO -0.01 0.07 0.19 -0.39 0.00 0.00 0.00 179.25 179.12 1dq8 h VAL 617 N 0.73 1.23 -0.36 0.00 -1.51 -1.38 -0.39 116.25 114.57 1dq8 h VAL 617 Ca 0.34 -0.77 -0.05 0.00 -1.23 0.00 0.00 66.70 64.99 1dq8 h VAL 617 Cb 0.25 0.68 -0.01 0.00 -2.13 0.00 0.00 31.29 30.07 1dq8 h VAL 617 CO -0.21 0.29 0.04 0.40 -1.23 0.00 0.00 177.57 176.87 1dq8 h ILE 618 N 0.78 1.24 -0.18 7.19 1.08 -0.89 -2.22 117.51 124.51 1dq8 h ILE 618 Ca 0.18 -0.88 0.03 0.00 -0.39 0.00 0.00 64.86 63.80 1dq8 h ILE 618 Cb 0.26 1.12 -0.03 0.00 -3.07 0.00 0.00 36.82 35.10 1dq8 h ILE 618 CO -0.01 0.29 0.01 0.50 -0.69 0.00 0.00 178.15 178.26 1dq8 h LYS 619 N 0.43 0.07 -0.16 2.37 3.64 -0.26 -0.66 116.57 122.00 1dq8 h LYS 619 Ca 0.11 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1dq8 h LYS 619 Cb 0.39 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.12 1dq8 h LYS 619 CO 0.01 0.05 -0.44 1.49 -2.27 0.00 0.00 179.45 178.29 1dq8 h GLU 620 N 0.07 -0.47 -0.97 1.90 4.81 -0.79 0.14 114.58 119.27 1dq8 h GLU 620 Ca 0.08 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1dq8 h GLU 620 Cb 0.10 0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 1dq8 h GLU 620 CO -0.13 -0.32 0.64 0.00 -0.73 0.00 0.00 179.01 178.47 1dq8 h ALA 621 N 0.08 1.26 0.51 2.92 0.00 -1.19 -2.49 119.26 120.36 1dq8 h ALA 621 Ca 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1dq8 h ALA 621 Cb 0.63 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1dq8 h ALA 621 CO -0.42 0.55 -0.24 0.35 0.00 0.00 0.00 179.25 179.49 1dq8 h PHE 622 N 1.25 -0.63 0.00 0.00 3.57 -0.14 -3.16 116.94 117.84 1dq8 h PHE 622 Ca 0.38 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.86 1dq8 h PHE 622 Cb -0.05 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1dq8 h PHE 622 CO -0.01 -0.33 -0.01 -0.44 -2.23 0.00 0.00 178.31 175.29 1dq8 h ASP 623 N -0.83 0.00 0.65 0.41 3.32 -0.61 -2.38 116.42 116.98 1dq8 h ASP 623 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1dq8 h ASP 623 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1dq8 h ASP 623 CO 0.11 0.01 0.00 -1.54 -1.72 0.00 0.00 179.24 176.11 1dq8 n SER 624 N -3.24 0.49 0.19 6.45 3.41 -0.95 -2.87 113.62 117.11 1dq8 n SER 624 Ca -0.02 0.62 0.04 0.00 -0.26 0.00 0.00 58.87 59.25 1dq8 n SER 624 Cb 0.13 -0.73 0.39 0.00 -0.26 0.00 0.00 64.21 63.74 1dq8 n SER 624 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1dq8 h THR 625 N 0.00 1.13 -1.46 6.66 2.02 -1.56 -3.47 112.91 116.24 1dq8 h THR 625 Ca 0.00 -1.25 0.23 0.00 0.77 0.00 0.00 66.41 66.16 1dq8 h THR 625 Cb 0.33 1.70 -0.20 0.00 -1.74 0.00 0.00 68.15 68.23 1dq8 h THR 625 CO 0.00 0.34 0.80 -0.94 0.37 0.00 0.00 175.52 176.09 1dq8 s SER 626 N -6.76 -0.15 0.62 4.18 1.04 -1.14 -5.00 113.70 106.49 1dq8 s SER 626 Ca -0.02 0.04 0.36 0.00 0.48 0.00 0.00 55.95 56.80 1dq8 s SER 626 Cb 0.14 0.15 2.05 0.00 0.10 0.00 0.00 66.02 68.46 1dq8 s SER 626 CO 0.70 -0.23 2.29 0.03 0.98 0.00 0.00 173.24 177.02 1dq8 h ARG 627 N 2.05 0.00 0.00 4.02 3.08 -1.91 -2.51 114.38 119.11 1dq8 h ARG 627 Ca -0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.95 1dq8 h ARG 627 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.22 1dq8 h ARG 627 CO 0.24 0.01 -1.11 1.19 -1.07 0.00 0.00 179.97 179.22 1dq8 n PHE 628 N -3.51 0.24 -2.45 3.04 3.01 -1.26 -4.85 117.46 111.69 1dq8 n PHE 628 Ca -0.03 0.07 -0.43 0.00 1.01 0.00 0.00 57.45 58.07 1dq8 n PHE 628 Cb 0.09 -0.42 -0.02 0.00 -0.01 0.00 0.00 39.48 39.11 1dq8 n PHE 628 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1dq8 s ALA 629 N -3.22 3.10 -0.38 4.37 0.00 -0.95 -4.07 121.76 120.61 1dq8 s ALA 629 Ca 0.03 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.72 1dq8 s ALA 629 Cb 0.14 -3.92 0.13 0.00 0.00 0.00 0.00 23.12 19.47 1dq8 s ALA 629 CO 0.82 -2.33 0.20 1.03 0.00 0.00 0.00 175.76 175.48 1dq8 s ARG 630 N 4.73 0.87 -0.29 0.00 0.52 -1.26 -4.27 118.95 119.26 1dq8 s ARG 630 Ca 0.56 -1.54 -0.32 0.00 -0.52 0.00 0.00 55.73 53.91 1dq8 s ARG 630 Cb -0.11 -1.85 -0.09 0.00 0.52 0.00 0.00 34.95 33.42 1dq8 s ARG 630 CO 0.32 -1.14 2.20 -0.11 0.02 0.00 0.00 175.30 176.59 1dq8 n LEU 631 N 4.02 2.59 -0.07 2.53 7.94 -1.26 -3.61 117.00 129.14 1dq8 n LEU 631 Ca 0.07 0.33 -0.14 0.00 -1.11 0.00 0.00 56.01 55.17 1dq8 n LEU 631 Cb 0.37 -1.38 -0.13 0.00 0.53 0.00 0.00 43.42 42.81 1dq8 n LEU 631 CO 0.18 -0.71 0.39 1.56 -1.11 0.00 0.00 177.39 177.70 1dq8 h GLN 632 N 13.43 -0.00 -2.87 1.96 4.20 -1.22 -3.49 115.11 127.12 1dq8 h GLN 632 Ca -0.33 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.42 1dq8 h GLN 632 Cb 1.29 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.06 1dq8 h GLN 632 CO 0.99 0.96 0.35 0.21 -0.67 0.00 0.00 178.83 180.67 1dq8 s LYS 633 N -2.29 1.96 -0.05 1.46 2.47 -1.22 -5.05 119.74 117.02 1dq8 s LYS 633 Ca -0.19 -1.24 0.02 0.00 -1.56 0.00 0.00 55.97 53.00 1dq8 s LYS 633 Cb -0.03 0.56 0.02 0.00 -1.46 0.00 0.00 37.83 36.92 1dq8 s LYS 633 CO 0.68 -0.91 -0.07 -0.51 0.16 0.00 0.00 175.35 174.69 1dq8 s LEU 634 N -3.13 1.48 -0.16 5.43 1.02 -1.26 -2.61 118.68 119.45 1dq8 s LEU 634 Ca 0.16 -0.18 0.01 0.00 0.02 0.00 0.00 54.13 54.14 1dq8 s LEU 634 Cb -0.04 -0.57 0.02 0.00 0.02 0.00 0.00 46.19 45.61 1dq8 s LEU 634 CO 0.09 -0.02 -0.19 -2.28 0.02 0.00 0.00 176.35 173.98 1dq8 s HIS 635 N 0.76 2.56 0.07 0.29 5.65 -1.00 -4.98 115.29 118.65 1dq8 s HIS 635 Ca -0.12 -1.43 0.07 0.00 0.25 0.00 0.00 55.06 53.83 1dq8 s HIS 635 Cb -0.14 -1.79 -0.04 0.00 -1.18 0.00 0.00 32.58 29.43 1dq8 s HIS 635 CO 0.01 -0.70 -0.13 0.95 -0.65 0.00 0.00 174.74 174.22 1dq8 s THR 636 N 1.18 3.15 -0.01 0.89 -4.23 -1.26 -0.79 115.64 114.58 1dq8 s THR 636 Ca 0.01 -1.21 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 1dq8 s THR 636 Cb -0.14 -2.41 0.01 0.00 1.34 0.00 0.00 72.50 71.30 1dq8 s THR 636 CO -0.09 0.22 -0.01 -0.55 -0.54 0.00 0.00 174.62 173.65 1dq8 s SER 637 N -1.86 0.29 -0.04 3.99 0.15 -0.40 -4.99 113.70 110.83 1dq8 s SER 637 Ca 0.18 -0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.79 1dq8 s SER 637 Cb -0.11 -0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.07 1dq8 s SER 637 CO 0.10 -0.03 0.05 -0.63 1.20 0.00 0.00 173.24 173.92 1dq8 s ILE 638 N 0.42 4.57 -0.37 6.45 -1.09 -1.26 0.14 121.20 130.06 1dq8 s ILE 638 Ca -0.04 -0.32 0.01 0.00 -2.23 0.00 0.00 60.65 58.07 1dq8 s ILE 638 Cb -0.06 -3.02 0.15 0.00 -1.58 0.00 0.00 42.46 37.95 1dq8 s ILE 638 CO -0.01 0.47 0.26 0.00 -1.23 0.00 0.00 174.94 174.43 1dq8 s ALA 639 N -1.05 0.91 0.00 9.38 0.00 -0.73 -4.99 121.76 125.28 1dq8 s ALA 639 Ca 0.18 -1.94 0.00 0.00 0.00 0.00 0.00 51.96 50.20 1dq8 s ALA 639 Cb -0.12 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.36 1dq8 s ALA 639 CO 0.08 -2.08 0.00 0.41 0.00 0.00 0.00 175.76 174.18 1dq8 n GLY 640 N 3.71 3.64 0.13 0.00 0.00 -1.26 -1.30 105.19 110.11 1dq8 n GLY 640 Ca 0.17 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.28 1dq8 n GLY 640 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1dq8 n ARG 641 N 13.58 0.79 -3.17 1.61 1.85 -1.26 -4.31 116.66 125.75 1dq8 n ARG 641 Ca 0.00 -0.27 -0.32 0.00 -1.00 0.00 0.00 57.85 56.26 1dq8 n ARG 641 Cb 0.00 -1.49 -0.05 0.00 -1.05 0.00 0.00 32.46 29.86 1dq8 n ARG 641 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 1dq8 s ASN 642 N -2.40 6.68 -0.04 2.89 -0.87 -0.42 -1.55 114.94 119.22 1dq8 s ASN 642 Ca 0.31 1.14 -0.01 0.00 -1.57 0.00 0.00 52.86 52.73 1dq8 s ASN 642 Cb 0.20 -2.32 0.03 0.00 -0.02 0.00 0.00 41.25 39.14 1dq8 s ASN 642 CO 0.46 -0.21 0.03 -0.22 -2.57 0.00 0.00 177.10 174.59 1dq8 s LEU 643 N -3.12 0.63 -0.22 0.60 2.96 0.06 -1.77 118.68 117.82 1dq8 s LEU 643 Ca 0.52 0.01 -0.09 0.00 -0.22 0.00 0.00 54.13 54.35 1dq8 s LEU 643 Cb -0.10 -0.22 -0.04 0.00 0.50 0.00 0.00 46.19 46.32 1dq8 s LEU 643 CO 0.21 -0.18 0.10 -0.31 -1.32 0.00 0.00 176.35 174.85 1dq8 s TYR 644 N 1.67 3.24 -0.19 5.38 1.51 0.12 -0.95 117.35 128.13 1dq8 s TYR 644 Ca -0.01 0.03 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 1dq8 s TYR 644 Cb -0.13 -2.18 0.03 0.00 -0.11 0.00 0.00 41.96 39.57 1dq8 s TYR 644 CO -0.03 0.02 -0.17 0.42 -1.11 0.00 0.00 175.55 174.68 1dq8 s ILE 645 N 0.87 1.99 -0.49 2.71 1.01 -0.91 -1.28 121.20 125.11 1dq8 s ILE 645 Ca 0.05 -1.02 -0.17 0.00 0.00 0.00 0.00 60.65 59.51 1dq8 s ILE 645 Cb -0.13 -1.87 0.07 0.00 0.01 0.00 0.00 42.46 40.53 1dq8 s ILE 645 CO 0.03 0.41 0.49 -0.60 0.00 0.00 0.00 174.94 175.27 1dq8 s ARG 646 N 1.29 3.03 0.08 2.79 3.52 0.03 -2.68 118.95 127.02 1dq8 s ARG 646 Ca 0.02 -1.20 -0.22 0.00 -0.13 0.00 0.00 55.73 54.20 1dq8 s ARG 646 Cb -0.14 -4.13 -0.07 0.00 -1.56 0.00 0.00 34.95 29.05 1dq8 s ARG 646 CO -0.11 -1.12 0.67 -0.06 -0.81 0.00 0.00 175.30 173.86 1dq8 s PHE 647 N 2.03 3.80 -0.04 5.12 0.40 -0.18 -2.37 117.98 126.74 1dq8 s PHE 647 Ca 0.08 1.40 0.02 0.00 -0.60 0.00 0.00 56.93 57.83 1dq8 s PHE 647 Cb -0.23 -2.65 0.02 0.00 0.51 0.00 0.00 43.02 40.67 1dq8 s PHE 647 CO 0.08 0.47 -0.06 -1.14 0.70 0.00 0.00 175.22 175.27 1dq8 s GLN 648 N -0.78 0.95 0.05 0.44 0.74 -1.07 -2.14 119.66 117.85 1dq8 s GLN 648 Ca 0.33 -0.19 -0.23 0.00 0.05 0.00 0.00 55.36 55.32 1dq8 s GLN 648 Cb -0.21 -0.90 0.05 0.00 1.10 0.00 0.00 33.01 33.06 1dq8 s GLN 648 CO 0.21 -0.01 0.53 0.45 -0.55 0.00 0.00 175.29 175.92 1dq8 s SER 649 N 0.67 -0.45 0.90 6.67 0.15 -0.32 -0.57 113.70 120.75 1dq8 s SER 649 Ca -0.10 0.19 -0.11 0.00 0.70 0.00 0.00 55.95 56.63 1dq8 s SER 649 Cb -0.13 0.50 0.13 0.00 -1.71 0.00 0.00 66.02 64.81 1dq8 s SER 649 CO 0.01 -0.72 1.10 -0.13 1.20 0.00 0.00 173.24 174.69 1dq8 s ARG 650 N -2.44 1.17 -0.13 5.44 1.81 -1.24 -1.25 118.95 122.32 1dq8 s ARG 650 Ca -0.05 1.08 0.16 0.00 -1.72 0.00 0.00 55.73 55.20 1dq8 s ARG 650 Cb -0.01 -1.78 0.33 0.00 -0.45 0.00 0.00 34.95 33.05 1dq8 s ARG 650 CO -0.02 -2.38 1.18 -1.13 -0.68 0.00 0.00 175.30 172.28 1dq8 n SER 651 N -4.01 0.13 0.00 0.23 3.41 -1.26 -4.05 113.62 108.07 1dq8 n SER 651 Ca 0.08 -2.05 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 1dq8 n SER 651 Cb 0.54 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1dq8 n SER 651 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dq8 n GLY 652 N -0.28 3.46 0.98 5.00 0.00 -1.26 -1.45 105.19 111.64 1dq8 n GLY 652 Ca -0.07 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 45.90 1dq8 n GLY 652 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dq8 n ASP 653 N 4.01 2.98 -4.86 1.61 8.00 -1.26 -3.58 116.55 123.45 1dq8 n ASP 653 Ca 0.00 -1.93 -0.31 0.00 0.71 0.00 0.00 54.79 53.26 1dq8 n ASP 653 Cb 0.00 -0.15 -0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1dq8 n ASP 653 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dq8 s ALA 654 N -1.69 3.26 0.47 2.24 0.00 -0.53 -0.29 121.76 125.22 1dq8 s ALA 654 Ca 0.35 -0.02 0.13 0.00 0.00 0.00 0.00 51.96 52.42 1dq8 s ALA 654 Cb 0.21 -2.84 1.10 0.00 0.00 0.00 0.00 23.12 21.59 1dq8 s ALA 654 CO 0.31 0.03 2.10 1.98 0.00 0.00 0.00 175.76 180.18 1dq8 h MET 655 N 1.46 0.23 0.00 0.00 4.05 -1.76 -3.44 114.93 115.47 1dq8 h MET 655 Ca -0.47 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 58.93 1dq8 h MET 655 Cb 1.18 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1dq8 h MET 655 CO 0.63 0.15 0.00 0.41 0.23 0.00 0.00 176.91 178.34 1dq8 n GLY 656 N -1.52 1.01 0.37 1.39 0.00 -1.26 -4.75 105.19 100.43 1dq8 n GLY 656 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1dq8 n GLY 656 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1dq8 h MET 657 N 3.63 -0.41 -0.30 1.61 2.86 -1.94 -0.01 114.93 120.37 1dq8 h MET 657 Ca 0.00 0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1dq8 h MET 657 Cb 0.00 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1dq8 h MET 657 CO 0.00 -0.27 0.05 -0.91 1.06 0.00 0.00 176.91 176.84 1dq8 h ASN 658 N -0.42 0.47 -0.42 1.22 4.21 -2.00 -2.20 115.58 116.44 1dq8 h ASN 658 Ca 0.10 -0.25 0.05 0.00 1.21 0.00 0.00 56.30 57.40 1dq8 h ASN 658 Cb 0.59 -0.13 -0.04 0.00 -1.12 0.00 0.00 38.32 37.62 1dq8 h ASN 658 CO -0.41 0.61 0.17 -0.03 -1.29 0.00 0.00 177.43 176.47 1dq8 h MET 659 N 0.32 0.33 -0.50 0.81 4.05 -1.92 -1.87 114.93 116.15 1dq8 h MET 659 Ca 0.09 -0.02 -0.09 0.00 -0.28 0.00 0.00 59.70 59.40 1dq8 h MET 659 Cb 0.33 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 1dq8 h MET 659 CO 0.00 0.22 -0.06 0.82 0.23 0.00 0.00 176.91 178.13 1dq8 h ILE 660 N 0.34 1.26 -0.36 1.77 1.08 -0.97 -2.05 117.51 118.59 1dq8 h ILE 660 Ca 0.19 -1.14 -0.01 0.00 -0.39 0.00 0.00 64.86 63.51 1dq8 h ILE 660 Cb 0.16 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 34.83 1dq8 h ILE 660 CO -0.18 0.40 0.18 0.28 -0.69 0.00 0.00 178.15 178.13 1dq8 h SER 661 N 0.81 0.46 -0.23 1.72 0.02 -0.94 0.18 113.55 115.56 1dq8 h SER 661 Ca 0.14 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1dq8 h SER 661 Cb 0.56 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1dq8 h SER 661 CO 0.03 0.45 0.10 0.11 -1.14 0.00 0.00 176.83 176.38 1dq8 h LYS 662 N 0.44 0.34 -0.42 3.45 1.57 -1.27 -0.56 116.57 120.13 1dq8 h LYS 662 Ca 0.12 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1dq8 h LYS 662 Cb 0.11 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1dq8 h LYS 662 CO -0.02 0.39 0.20 0.78 -0.57 0.00 0.00 179.45 180.23 1dq8 h GLY 663 N 0.23 0.61 1.21 3.86 0.00 -1.18 -1.92 103.07 105.89 1dq8 h GLY 663 Ca 0.08 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 46.99 1dq8 h GLY 663 CO -0.01 0.26 -0.37 -0.84 0.00 0.00 0.00 176.54 175.58 1dq8 h THR 664 N 0.58 1.28 -0.50 4.70 2.02 -0.10 -2.10 112.91 118.78 1dq8 h THR 664 Ca 0.15 -1.54 -0.05 0.00 0.77 0.00 0.00 66.41 65.74 1dq8 h THR 664 Cb 0.06 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1dq8 h THR 664 CO -0.02 0.51 0.12 -0.08 0.37 0.00 0.00 175.52 176.42 1dq8 h GLU 665 N 0.71 0.75 -0.01 6.66 4.81 -0.38 -1.68 114.58 125.45 1dq8 h GLU 665 Ca 0.06 -0.15 -0.21 0.00 -0.13 0.00 0.00 59.36 58.94 1dq8 h GLU 665 Cb 0.95 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.20 1dq8 h GLU 665 CO 0.09 0.68 -0.87 0.87 -0.73 0.00 0.00 179.01 179.05 1dq8 h LYS 666 N 0.73 0.33 -0.44 1.92 1.57 -1.24 -2.35 116.57 117.09 1dq8 h LYS 666 Ca 0.16 -0.33 -0.14 0.00 -1.87 0.00 0.00 60.65 58.47 1dq8 h LYS 666 Cb 0.27 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1dq8 h LYS 666 CO -0.00 1.01 -0.28 0.00 -0.57 0.00 0.00 179.45 179.61 1dq8 h ALA 667 N 0.87 0.67 -0.38 3.86 0.00 -1.15 -1.75 119.26 121.39 1dq8 h ALA 667 Ca -0.06 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 1dq8 h ALA 667 Cb 1.49 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1dq8 h ALA 667 CO 0.14 0.67 -0.16 -0.07 0.00 0.00 0.00 179.25 179.84 1dq8 h LEU 668 N 0.81 0.69 -0.44 0.00 3.38 -1.32 0.13 115.31 118.56 1dq8 h LEU 668 Ca 0.09 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.86 1dq8 h LEU 668 Cb 0.86 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1dq8 h LEU 668 CO 0.08 0.86 0.26 -1.28 0.09 0.00 0.00 178.44 178.45 1dq8 h SER 669 N 0.62 0.43 -0.56 -0.43 0.87 -1.19 0.23 113.55 113.53 1dq8 h SER 669 Ca 0.10 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.55 1dq8 h SER 669 Cb 0.62 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1dq8 h SER 669 CO 0.04 0.31 -0.08 0.50 -0.53 0.00 0.00 176.83 177.07 1dq8 h LYS 670 N 0.53 1.04 -0.30 2.24 1.63 -0.85 -2.80 116.57 118.08 1dq8 h LYS 670 Ca 0.17 -0.38 -0.08 0.00 -0.85 0.00 0.00 60.65 59.52 1dq8 h LYS 670 Cb -0.00 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 1dq8 h LYS 670 CO -0.07 1.07 -0.15 1.25 -3.45 0.00 0.00 179.45 178.10 1dq8 h LEU 671 N 0.93 0.50 -1.83 5.20 5.85 -0.10 -2.35 115.31 123.51 1dq8 h LEU 671 Ca 0.15 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1dq8 h LEU 671 Cb 0.65 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 1dq8 h LEU 671 CO 0.05 0.68 -0.11 -0.74 -0.34 0.00 0.00 178.44 177.97 1dq8 h HIS 672 N 0.47 0.00 -0.64 1.25 2.76 -0.30 -1.42 115.15 117.28 1dq8 h HIS 672 Ca 0.08 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.19 1dq8 h HIS 672 Cb 0.53 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.47 1dq8 h HIS 672 CO 0.02 0.11 0.14 0.93 -1.30 0.00 0.00 177.93 177.83 1dq8 h GLU 673 N 0.00 1.04 0.00 5.26 5.08 -1.29 -1.43 114.58 123.24 1dq8 h GLU 673 Ca -0.00 -0.26 -0.13 0.00 -1.00 0.00 0.00 59.36 57.97 1dq8 h GLU 673 Cb 0.21 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1dq8 h GLU 673 CO 0.01 0.95 -0.60 1.88 -1.00 0.00 0.00 179.01 180.25 1dq8 h TYR 674 N 0.96 0.00 -2.47 4.33 -1.99 -1.37 -3.37 116.97 113.06 1dq8 h TYR 674 Ca 0.20 0.00 -0.59 0.00 2.00 0.00 0.00 58.73 60.34 1dq8 h TYR 674 Cb 0.38 0.00 -0.39 0.00 2.00 0.00 0.00 36.73 38.72 1dq8 h TYR 674 CO 0.03 0.60 -0.89 1.19 -0.00 0.00 0.00 178.16 179.09 1dq8 n PHE 675 N -3.47 0.18 0.30 4.88 3.01 -0.62 -4.98 117.46 116.76 1dq8 n PHE 675 Ca 0.00 -3.58 0.20 0.00 1.01 0.00 0.00 57.45 55.08 1dq8 n PHE 675 Cb 0.69 -0.02 1.06 0.00 -0.01 0.00 0.00 39.48 41.20 1dq8 n PHE 675 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1dq8 h PRO 676 N 5.36 0.00 0.00 -1.08 0.13 -1.44 -1.57 132.00 133.40 1dq8 h PRO 676 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 1dq8 h PRO 676 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1dq8 h PRO 676 CO 0.47 0.00 -0.03 0.39 -0.23 0.00 0.00 178.00 178.60 1dq8 n GLU 677 N -2.89 0.08 -2.23 0.86 1.02 -1.26 -4.86 120.64 111.36 1dq8 n GLU 677 Ca -0.03 0.06 -0.42 0.00 -0.02 0.00 0.00 57.16 56.75 1dq8 n GLU 677 Cb 0.09 -1.59 -0.03 0.00 -0.02 0.00 0.00 31.44 29.89 1dq8 n GLU 677 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1dq8 s MET 678 N -3.03 4.34 -0.26 3.49 1.75 -0.59 -4.53 119.30 120.47 1dq8 s MET 678 Ca 0.13 2.00 -0.08 0.00 -1.25 0.00 0.00 55.69 56.49 1dq8 s MET 678 Cb 0.17 -3.31 -0.03 0.00 2.84 0.00 0.00 34.83 34.50 1dq8 s MET 678 CO 0.56 -0.42 0.09 -1.14 -0.65 0.00 0.00 175.02 173.45 1dq8 s GLN 679 N 1.27 3.66 -0.70 4.11 0.74 0.23 -4.93 119.66 124.04 1dq8 s GLN 679 Ca 0.63 -0.48 -0.26 0.00 0.05 0.00 0.00 55.36 55.30 1dq8 s GLN 679 Cb -0.35 -3.37 0.04 0.00 1.10 0.00 0.00 33.01 30.43 1dq8 s GLN 679 CO 0.30 -0.20 1.21 0.42 -0.55 0.00 0.00 175.29 176.47 1dq8 s ILE 680 N 1.63 3.86 0.11 -2.34 1.01 -1.26 -0.07 121.20 124.14 1dq8 s ILE 680 Ca 0.06 0.35 -0.11 0.00 0.00 0.00 0.00 60.65 60.96 1dq8 s ILE 680 Cb -0.15 -4.85 -0.15 0.00 0.01 0.00 0.00 42.46 37.31 1dq8 s ILE 680 CO 0.04 -1.72 1.32 0.25 0.00 0.00 0.00 174.94 174.83 1dq8 h LEU 681 N 12.60 0.87 -7.00 2.97 5.85 -1.79 -3.47 115.31 125.34 1dq8 h LEU 681 Ca -0.28 -0.58 0.09 0.00 0.84 0.00 0.00 57.88 57.95 1dq8 h LEU 681 Cb 1.05 -0.26 -0.26 0.00 0.37 0.00 0.00 40.66 41.57 1dq8 h LEU 681 CO 1.25 1.38 0.33 0.00 -0.34 0.00 0.00 178.44 181.06 1dq8 s ALA 682 N -3.69 -2.19 0.59 1.25 0.00 -1.06 -5.02 121.76 111.64 1dq8 s ALA 682 Ca -0.09 2.22 0.29 0.00 0.00 0.00 0.00 51.96 54.37 1dq8 s ALA 682 Cb 0.09 -1.65 1.75 0.00 0.00 0.00 0.00 23.12 23.31 1dq8 s ALA 682 CO 0.90 -0.35 2.20 -0.24 0.00 0.00 0.00 175.76 178.27 1dq8 h VAL 683 N 4.91 0.52 -3.54 0.00 3.04 -1.90 -1.48 116.25 117.80 1dq8 h VAL 683 Ca -0.28 0.00 -0.60 0.00 -1.01 0.00 0.00 66.70 64.81 1dq8 h VAL 683 Cb 1.20 0.94 -0.39 0.00 -2.01 0.00 0.00 31.29 31.03 1dq8 h VAL 683 CO 0.19 0.00 -0.78 -0.55 -1.01 0.00 0.00 177.57 175.42 1dq8 s SER 684 N -6.06 3.76 -0.42 3.17 0.15 -1.26 -2.65 113.70 110.39 1dq8 s SER 684 Ca -0.05 -1.21 0.05 0.00 0.70 0.00 0.00 55.95 55.44 1dq8 s SER 684 Cb 0.15 -1.08 0.59 0.00 -1.71 0.00 0.00 66.02 63.97 1dq8 s SER 684 CO 0.55 -0.27 1.76 0.61 1.20 0.00 0.00 173.24 177.09 1dq8 n GLY 685 N 4.73 4.86 2.47 9.45 0.00 0.24 -4.73 105.19 122.20 1dq8 n GLY 685 Ca -0.10 -1.33 -0.17 0.00 0.00 0.00 0.00 46.02 44.42 1dq8 n GLY 685 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dq8 n ASN 686 N -1.10 -5.02 -0.97 1.61 4.13 -1.25 -4.76 115.26 107.90 1dq8 n ASN 686 Ca 0.51 0.37 0.10 0.00 1.68 0.00 0.00 54.58 57.24 1dq8 n ASN 686 Cb 1.33 -4.01 0.19 0.00 -1.54 0.00 0.00 39.78 35.75 1dq8 n ASN 686 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1dq8 n TYR 687 N -2.68 0.46 0.48 3.10 9.36 -1.17 -4.63 117.16 122.08 1dq8 n TYR 687 Ca -0.17 -0.28 -0.19 0.00 3.32 0.00 0.00 57.90 60.58 1dq8 n TYR 687 Cb 0.56 -0.01 -0.09 0.00 -0.63 0.00 0.00 39.34 39.18 1dq8 n TYR 687 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1dq8 s THR 689 N -5.57 4.01 -0.24 0.00 2.01 -1.26 -4.70 115.64 109.89 1dq8 s THR 689 Ca -0.18 -0.36 -0.07 0.00 0.31 0.00 0.00 61.69 61.39 1dq8 s THR 689 Cb 0.02 -2.67 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1dq8 s THR 689 CO 0.54 0.59 0.06 -0.62 -0.69 0.00 0.00 174.62 174.51 1dq8 s ASP 690 N -0.73 5.17 -1.53 3.53 2.15 -1.26 -4.65 116.67 119.35 1dq8 s ASP 690 Ca 0.11 -0.17 0.00 0.00 0.43 0.00 0.00 52.55 52.92 1dq8 s ASP 690 Cb -0.11 -1.92 0.00 0.00 -0.30 0.00 0.00 42.92 40.59 1dq8 s ASP 690 CO 0.02 -0.00 0.00 0.29 -0.17 0.00 0.00 175.17 175.31 1dq8 n LYS 691 N 4.70 -1.23 -3.87 4.34 5.02 -1.26 -5.00 118.16 120.86 1dq8 n LYS 691 Ca -0.16 0.91 -0.12 0.00 -2.02 0.00 0.00 58.31 56.92 1dq8 n LYS 691 Cb 0.52 -5.22 -0.13 0.00 -0.02 0.00 0.00 35.03 30.17 1dq8 n LYS 691 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1dq8 s LYS 692 N -4.23 0.12 0.28 1.97 3.01 -1.26 -4.93 119.74 114.71 1dq8 s LYS 692 Ca 0.00 -0.07 -0.30 0.00 -1.01 0.00 0.00 55.97 54.60 1dq8 s LYS 692 Cb 0.00 0.05 -0.11 0.00 -1.01 0.00 0.00 37.83 36.76 1dq8 s LYS 692 CO 0.00 -0.02 1.56 -1.25 0.51 0.00 0.00 175.35 176.15 1dq8 s PRO 693 N -0.29 4.15 -0.23 -1.68 0.04 -1.26 -4.75 135.00 130.98 1dq8 s PRO 693 Ca -0.03 2.51 -0.14 0.00 0.04 0.00 0.00 61.00 63.38 1dq8 s PRO 693 Cb -0.02 -3.04 0.07 0.00 0.04 0.00 0.00 34.50 31.54 1dq8 s PRO 693 CO -0.00 -0.58 0.57 0.00 0.04 0.00 0.00 177.00 177.02 1dq8 s ALA 694 N -0.01 -1.50 0.55 8.56 0.00 -1.26 -5.02 121.76 123.08 1dq8 s ALA 694 Ca 0.62 1.99 0.25 0.00 0.00 0.00 0.00 51.96 54.83 1dq8 s ALA 694 Cb -0.46 -1.18 1.61 0.00 0.00 0.00 0.00 23.12 23.08 1dq8 s ALA 694 CO 0.47 -0.32 2.20 0.00 0.00 0.00 0.00 175.76 178.11 1dq8 h ALA 695 N 6.88 1.63 -0.62 0.00 0.00 -1.94 -2.66 119.26 122.56 1dq8 h ALA 695 Ca -0.33 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 1dq8 h ALA 695 Cb 1.21 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1dq8 h ALA 695 CO 0.21 0.03 0.23 0.97 0.00 0.00 0.00 179.25 180.69 1dq8 h ILE 696 N 0.00 1.22 -0.50 0.00 2.10 -1.98 -0.58 117.51 117.78 1dq8 h ILE 696 Ca -0.00 -0.72 -0.13 0.00 1.08 0.00 0.00 64.86 65.09 1dq8 h ILE 696 Cb 0.05 0.50 -0.01 0.00 -1.09 0.00 0.00 36.82 36.27 1dq8 h ILE 696 CO 0.00 0.28 -0.19 0.78 -1.08 0.00 0.00 178.15 177.95 1dq8 h ASN 697 N 0.89 1.04 -0.34 2.19 2.35 -1.75 0.46 115.58 120.43 1dq8 h ASN 697 Ca 0.21 -0.38 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 1dq8 h ASN 697 Cb 0.20 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1dq8 h ASN 697 CO -0.02 1.19 0.15 -0.25 -1.65 0.00 0.00 177.43 176.85 1dq8 h TRP 698 N 0.88 0.50 0.24 1.19 2.91 -1.49 -0.08 115.95 120.10 1dq8 h TRP 698 Ca 0.12 -0.03 -0.34 0.00 1.13 0.00 0.00 58.89 59.77 1dq8 h TRP 698 Cb 0.77 -0.15 0.03 0.00 -0.51 0.00 0.00 29.16 29.30 1dq8 h TRP 698 CO 0.05 0.45 -1.55 0.82 -1.03 0.00 0.00 178.44 177.18 1dq8 h ILE 699 N 0.40 1.20 0.00 2.65 2.04 -1.06 -3.38 117.51 119.36 1dq8 h ILE 699 Ca 0.11 -2.66 -0.05 0.00 1.00 0.00 0.00 64.86 63.27 1dq8 h ILE 699 Cb 0.15 2.98 -0.01 0.00 -0.74 0.00 0.00 36.82 39.20 1dq8 h ILE 699 CO -0.01 0.82 -1.71 -0.62 0.00 0.00 0.00 178.15 176.63 1dq8 n GLU 700 N -3.69 0.64 0.00 2.37 4.71 0.15 -5.10 120.64 119.72 1dq8 n GLU 700 Ca -0.19 -0.06 0.00 0.00 -0.01 0.00 0.00 57.16 56.91 1dq8 n GLU 700 Cb 1.10 -1.63 0.00 0.00 -1.01 0.00 0.00 31.44 29.90 1dq8 n GLU 700 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1dq8 n GLY 701 N 1.30 -1.25 3.63 0.62 0.00 -0.04 -5.02 105.19 104.42 1dq8 n GLY 701 Ca -0.06 -1.59 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 1dq8 n GLY 701 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1dq8 s ARG 702 N -2.71 0.75 7.13 1.61 3.52 -1.07 -4.70 118.95 123.48 1dq8 s ARG 702 Ca 0.00 1.14 0.00 0.00 -0.13 0.00 0.00 55.73 56.74 1dq8 s ARG 702 Cb 0.00 0.24 0.00 0.00 -1.56 0.00 0.00 34.95 33.63 1dq8 s ARG 702 CO 0.00 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 174.77 1dq8 n GLY 703 N 3.73 2.01 3.66 8.12 0.00 0.21 -3.39 105.19 119.53 1dq8 n GLY 703 Ca -0.18 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 1dq8 n GLY 703 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dq8 s LYS 704 N 0.00 4.04 -0.23 1.61 3.01 0.62 -0.60 119.74 128.19 1dq8 s LYS 704 Ca 0.00 -0.30 -0.09 0.00 -1.01 0.00 0.00 55.97 54.56 1dq8 s LYS 704 Cb 0.00 -3.28 -0.04 0.00 -1.01 0.00 0.00 37.83 33.50 1dq8 s LYS 704 CO 0.00 0.28 0.12 -1.12 0.51 0.00 0.00 175.35 175.14 1dq8 s SER 705 N 0.36 5.75 0.05 2.83 0.01 -0.51 -0.61 113.70 121.57 1dq8 s SER 705 Ca 0.05 0.01 0.03 0.00 1.31 0.00 0.00 55.95 57.35 1dq8 s SER 705 Cb -0.12 -2.03 -0.02 0.00 0.21 0.00 0.00 66.02 64.06 1dq8 s SER 705 CO -0.01 0.05 -0.10 -0.69 0.41 0.00 0.00 173.24 172.91 1dq8 s VAL 706 N 1.11 0.77 0.03 3.43 1.01 -0.44 0.23 120.40 126.55 1dq8 s VAL 706 Ca 0.06 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 61.02 1dq8 s VAL 706 Cb -0.14 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 1dq8 s VAL 706 CO 0.04 -0.25 -0.15 0.54 0.00 0.00 0.00 175.10 175.29 1dq8 s VAL 707 N -1.18 1.18 0.09 2.92 0.11 -0.53 -0.61 120.40 122.38 1dq8 s VAL 707 Ca -0.05 -0.96 0.02 0.00 -2.93 0.00 0.00 61.98 58.06 1dq8 s VAL 707 Cb -0.09 -1.05 -0.04 0.00 -1.53 0.00 0.00 36.38 33.67 1dq8 s VAL 707 CO 0.01 0.08 -0.07 0.00 -3.33 0.00 0.00 175.10 171.79 1dq8 s GLU 709 N -3.44 1.36 -0.09 0.00 -1.05 -0.21 -2.09 118.70 113.18 1dq8 s GLU 709 Ca 0.08 -0.61 -0.31 0.00 -0.15 0.00 0.00 54.97 53.98 1dq8 s GLU 709 Cb 0.02 0.58 0.12 0.00 -0.44 0.00 0.00 34.13 34.41 1dq8 s GLU 709 CO -0.03 -0.59 1.01 0.00 0.95 0.00 0.00 175.26 176.59 1dq8 s ALA 710 N -3.79 -1.92 -0.13 -0.84 0.00 -0.56 -1.77 121.76 112.75 1dq8 s ALA 710 Ca 0.04 1.29 0.02 0.00 0.00 0.00 0.00 51.96 53.30 1dq8 s ALA 710 Cb -0.02 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.18 1dq8 s ALA 710 CO -0.09 -0.60 -0.18 0.08 0.00 0.00 0.00 175.76 174.97 1dq8 s VAL 711 N -2.60 1.74 -0.26 0.00 1.01 -1.26 -1.01 120.40 118.02 1dq8 s VAL 711 Ca 0.06 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 1dq8 s VAL 711 Cb -0.01 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 1dq8 s VAL 711 CO -0.06 0.49 0.12 -0.63 0.00 0.00 0.00 175.10 175.01 1dq8 s ILE 712 N 1.00 4.69 0.48 2.22 -1.09 0.54 -4.65 121.20 124.38 1dq8 s ILE 712 Ca -0.05 -0.06 -0.23 0.00 -2.23 0.00 0.00 60.65 58.08 1dq8 s ILE 712 Cb -0.15 -3.22 -0.08 0.00 -1.58 0.00 0.00 42.46 37.44 1dq8 s ILE 712 CO -0.03 0.30 1.25 -2.65 -1.23 0.00 0.00 174.94 172.57 1dq8 n PRO 713 N 4.98 1.71 -0.34 2.79 -0.02 -1.26 -0.75 135.00 142.11 1dq8 n PRO 713 Ca -0.15 0.62 0.17 0.00 -2.02 0.00 0.00 63.50 62.12 1dq8 n PRO 713 Cb 0.52 -2.40 0.40 0.00 -0.02 0.00 0.00 33.50 31.99 1dq8 n PRO 713 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dq8 h ALA 714 N 1.67 1.87 -0.23 3.55 0.00 -1.92 -0.31 119.26 123.88 1dq8 h ALA 714 Ca -0.49 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1dq8 h ALA 714 Cb 1.31 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1dq8 h ALA 714 CO 0.58 -0.29 0.02 -0.22 0.00 0.00 0.00 179.25 179.33 1dq8 h LYS 715 N 0.59 0.40 -0.08 0.00 3.64 -1.89 -2.36 116.57 116.87 1dq8 h LYS 715 Ca 0.61 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.84 1dq8 h LYS 715 Cb 1.19 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 1dq8 h LYS 715 CO -0.40 0.56 -0.12 0.28 -2.27 0.00 0.00 179.45 177.51 1dq8 h VAL 716 N 0.19 1.13 -0.37 2.00 2.07 -1.45 -0.58 116.25 119.25 1dq8 h VAL 716 Ca 0.07 -0.60 -0.14 0.00 0.82 0.00 0.00 66.70 66.86 1dq8 h VAL 716 Cb 0.37 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1dq8 h VAL 716 CO 0.01 0.18 -0.31 0.58 0.02 0.00 0.00 177.57 178.05 1dq8 h VAL 717 N 0.12 1.28 0.10 2.57 2.07 -1.01 -1.08 116.25 120.30 1dq8 h VAL 717 Ca 0.03 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.07 1dq8 h VAL 717 Cb 0.29 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1dq8 h VAL 717 CO 0.02 0.49 -0.05 0.03 0.02 0.00 0.00 177.57 178.08 1dq8 h ARG 718 N 0.68 -0.13 -0.00 1.57 3.08 -0.92 -2.14 114.38 116.52 1dq8 h ARG 718 Ca 0.07 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1dq8 h ARG 718 Cb 0.86 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1dq8 h ARG 718 CO 0.08 0.37 -0.01 0.93 -1.07 0.00 0.00 179.97 180.27 1dq8 h GLU 719 N -0.74 0.01 0.00 0.04 5.08 -1.16 -2.45 114.58 115.36 1dq8 h GLU 719 Ca -0.01 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1dq8 h GLU 719 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1dq8 h GLU 719 CO 0.02 0.61 -0.31 0.28 -1.00 0.00 0.00 179.01 178.62 1dq8 h VAL 720 N -0.59 1.56 -0.00 3.13 2.07 -1.40 -3.38 116.25 117.64 1dq8 h VAL 720 Ca -0.00 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.23 1dq8 h VAL 720 Cb 0.61 3.07 0.00 0.00 -1.52 0.00 0.00 31.29 33.46 1dq8 h VAL 720 CO 0.00 0.53 -0.23 0.18 0.02 0.00 0.00 177.57 178.07 1dq8 n LEU 721 N -4.57 0.49 -3.67 2.57 4.77 -1.14 -4.98 117.00 110.47 1dq8 n LEU 721 Ca -0.15 0.04 -0.25 0.00 -0.03 0.00 0.00 56.01 55.62 1dq8 n LEU 721 Cb 0.52 -0.25 0.07 0.00 -2.33 0.00 0.00 43.42 41.43 1dq8 n LEU 721 CO 0.30 0.10 0.22 0.29 -1.33 0.00 0.00 177.39 176.97 1dq8 n LYS 722 N -1.16 -7.44 -0.12 3.23 4.76 -0.85 -4.58 118.16 112.01 1dq8 n LYS 722 Ca 0.10 0.78 0.00 0.00 -2.87 0.00 0.00 58.31 56.32 1dq8 n LYS 722 Cb 0.32 -5.80 0.00 0.00 -1.84 0.00 0.00 35.03 27.71 1dq8 n LYS 722 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1dq8 n THR 723 N -4.94 0.00 -4.41 -0.18 5.66 -0.96 -4.71 114.28 104.73 1dq8 n THR 723 Ca 0.02 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.81 1dq8 n THR 723 Cb 0.55 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.23 1dq8 n THR 723 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1dq8 s THR 724 N -2.89 1.74 0.16 1.09 -4.23 -1.26 -3.27 115.64 106.97 1dq8 s THR 724 Ca 0.00 -2.17 -0.13 0.00 -1.18 0.00 0.00 61.69 58.21 1dq8 s THR 724 Cb 0.00 -2.33 0.04 0.00 1.34 0.00 0.00 72.50 71.55 1dq8 s THR 724 CO 0.00 -0.39 1.70 0.74 -0.54 0.00 0.00 174.62 176.13 1dq8 h THR 725 N 2.35 1.22 -0.60 3.99 2.02 -1.91 -2.38 112.91 117.60 1dq8 h THR 725 Ca -0.39 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 1dq8 h THR 725 Cb 1.23 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 1dq8 h THR 725 CO 0.65 0.26 0.35 -0.08 0.37 0.00 0.00 175.52 177.08 1dq8 h GLU 726 N 0.70 0.82 -0.44 6.66 4.81 -1.93 -1.70 114.58 123.49 1dq8 h GLU 726 Ca 0.17 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1dq8 h GLU 726 Cb 0.22 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1dq8 h GLU 726 CO -0.01 0.60 0.17 0.00 -0.73 0.00 0.00 179.01 179.04 1dq8 h ALA 727 N 1.17 0.57 -0.23 2.92 0.00 -1.93 -1.10 119.26 120.67 1dq8 h ALA 727 Ca 0.21 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1dq8 h ALA 727 Cb -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1dq8 h ALA 727 CO -0.04 0.18 0.01 0.52 0.00 0.00 0.00 179.25 179.92 1dq8 h MET 728 N 0.56 0.08 -0.65 0.00 2.86 -1.18 -0.84 114.93 115.78 1dq8 h MET 728 Ca 0.14 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1dq8 h MET 728 Cb 0.20 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 1dq8 h MET 728 CO -0.01 0.06 0.36 0.82 1.06 0.00 0.00 176.91 179.19 1dq8 h ILE 729 N 0.09 1.20 -0.66 -1.22 2.04 -1.14 0.17 117.51 117.99 1dq8 h ILE 729 Ca 0.11 -0.51 -0.08 0.00 1.00 0.00 0.00 64.86 65.38 1dq8 h ILE 729 Cb 0.13 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1dq8 h ILE 729 CO -0.17 0.22 0.09 -0.08 0.00 0.00 0.00 178.15 178.21 1dq8 h GLU 730 N 0.88 1.10 -0.34 2.37 4.57 -0.91 -1.49 114.58 120.76 1dq8 h GLU 730 Ca 0.23 -0.30 -0.17 0.00 -1.18 0.00 0.00 59.36 57.94 1dq8 h GLU 730 Cb 0.04 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1dq8 h GLU 730 CO -0.04 1.02 -0.45 0.28 -1.18 0.00 0.00 179.01 178.64 1dq8 h VAL 731 N 1.02 1.27 0.25 0.32 2.07 -0.91 -2.76 116.25 117.52 1dq8 h VAL 731 Ca 0.20 -1.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.08 1dq8 h VAL 731 Cb 0.46 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1dq8 h VAL 731 CO 0.02 0.54 -0.12 -1.13 0.02 0.00 0.00 177.57 176.89 1dq8 h ASN 732 N 0.71 -0.28 -0.09 0.57 -1.24 -0.36 0.08 115.58 114.96 1dq8 h ASN 732 Ca 0.04 0.00 0.01 0.00 0.71 0.00 0.00 56.30 57.06 1dq8 h ASN 732 Cb 1.05 0.07 -0.01 0.00 0.73 0.00 0.00 38.32 40.16 1dq8 h ASN 732 CO 0.11 -0.20 0.01 0.40 -1.29 0.00 0.00 177.43 176.46 1dq8 h ILE 733 N -0.35 0.95 0.00 2.57 2.04 -1.36 -0.60 117.51 120.76 1dq8 h ILE 733 Ca -0.03 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1dq8 h ILE 733 Cb 0.27 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1dq8 h ILE 733 CO 0.06 0.01 -0.15 0.78 0.00 0.00 0.00 178.15 178.84 1dq8 h ASN 734 N 0.04 0.00 0.00 1.72 2.35 -1.42 0.36 115.58 118.64 1dq8 h ASN 734 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1dq8 h ASN 734 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1dq8 h ASN 734 CO -0.06 0.15 -0.21 1.17 -1.65 0.00 0.00 177.43 176.83 1dq8 n LYS 735 N -3.20 0.12 0.24 0.81 4.81 0.01 -1.73 118.16 119.22 1dq8 n LYS 735 Ca 0.02 0.11 0.10 0.00 -0.87 0.00 0.00 58.31 57.67 1dq8 n LYS 735 Cb 0.48 -0.78 0.62 0.00 0.02 0.00 0.00 35.03 35.38 1dq8 n LYS 735 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1dq8 h ASN 736 N -0.24 0.00 0.00 3.14 2.35 -1.25 -1.76 115.58 117.82 1dq8 h ASN 736 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1dq8 h ASN 736 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1dq8 h ASN 736 CO 0.00 0.17 -0.25 0.18 -1.65 0.00 0.00 177.43 175.88 1dq8 n LEU 737 N -3.76 0.55 -0.11 1.61 4.77 -0.91 -4.21 117.00 114.93 1dq8 n LEU 737 Ca -0.02 0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.95 1dq8 n LEU 737 Cb 0.28 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1dq8 n LEU 737 CO 0.32 -0.46 0.83 0.58 -1.33 0.00 0.00 177.39 177.33 1dq8 h VAL 738 N -0.25 1.23 0.01 4.08 2.07 -1.10 -0.90 116.25 121.40 1dq8 h VAL 738 Ca 0.00 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1dq8 h VAL 738 Cb 0.25 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1dq8 h VAL 738 CO 0.00 0.27 -0.01 1.23 0.02 0.00 0.00 177.57 179.08 1dq8 h GLY 739 N 0.38 -0.02 1.44 2.17 0.00 -0.50 0.10 103.07 106.64 1dq8 h GLY 739 Ca 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1dq8 h GLY 739 CO 0.01 -0.01 0.29 1.76 0.00 0.00 0.00 176.54 178.59 1dq8 h SER 740 N -0.03 0.65 -0.31 0.19 0.02 -1.35 -0.50 113.55 112.23 1dq8 h SER 740 Ca 0.00 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 1dq8 h SER 740 Cb 0.03 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1dq8 h SER 740 CO -0.00 0.53 -0.02 0.00 -1.14 0.00 0.00 176.83 176.19 1dq8 h ALA 741 N 1.58 0.42 -0.19 3.77 0.00 -0.45 -1.61 119.26 122.78 1dq8 h ALA 741 Ca 0.19 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1dq8 h ALA 741 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1dq8 h ALA 741 CO -0.03 0.19 -0.01 0.52 0.00 0.00 0.00 179.25 179.92 1dq8 h MET 742 N 0.34 0.28 -0.00 0.00 2.86 0.08 -1.43 114.93 117.06 1dq8 h MET 742 Ca 0.08 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1dq8 h MET 742 Cb 0.48 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1dq8 h MET 742 CO 0.02 0.31 -0.01 0.00 1.06 0.00 0.00 176.91 178.30 1dq8 n ALA 743 N -2.49 2.51 -2.74 6.32 0.00 -0.28 -4.92 120.51 118.90 1dq8 n ALA 743 Ca -0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 53.44 53.20 1dq8 n ALA 743 Cb 0.19 -1.49 0.04 0.00 0.00 0.00 0.00 19.45 18.19 1dq8 n ALA 743 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dq8 n GLY 744 N 1.27 0.10 3.84 0.00 0.00 -0.54 -5.02 105.19 104.84 1dq8 n GLY 744 Ca 0.15 -0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 1dq8 n GLY 744 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dq8 s SER 745 N -3.54 6.86 -0.26 1.61 0.15 -0.64 -5.06 113.70 112.82 1dq8 s SER 745 Ca 0.05 1.06 0.03 0.00 0.70 0.00 0.00 55.95 57.79 1dq8 s SER 745 Cb -0.02 -2.28 0.06 0.00 -1.71 0.00 0.00 66.02 62.06 1dq8 s SER 745 CO 0.34 0.22 -0.11 -0.63 1.20 0.00 0.00 173.24 174.26 1dq8 s ILE 746 N -1.25 2.21 0.00 6.45 -1.09 -1.26 -4.69 121.20 121.56 1dq8 s ILE 746 Ca 0.31 -1.59 0.00 0.00 -2.23 0.00 0.00 60.65 57.14 1dq8 s ILE 746 Cb -0.17 -2.28 0.00 0.00 -1.58 0.00 0.00 42.46 38.43 1dq8 s ILE 746 CO 0.17 -0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.49 1dq8 n GLY 747 N 4.45 0.92 2.77 6.18 0.00 -1.26 -4.94 105.19 113.31 1dq8 n GLY 747 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 1dq8 n GLY 747 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dq8 n GLY 748 N -2.00 5.71 2.60 -0.02 0.00 -1.26 -1.69 105.19 108.53 1dq8 n GLY 748 Ca 0.00 -2.58 -0.35 0.00 0.00 0.00 0.00 46.02 43.09 1dq8 n GLY 748 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dq8 n TYR 749 N -0.49 2.27 -4.04 1.61 4.02 -0.87 -4.82 117.16 114.84 1dq8 n TYR 749 Ca 0.48 -2.30 -0.11 0.00 -0.01 0.00 0.00 57.90 55.96 1dq8 n TYR 749 Cb 0.37 -1.41 -0.05 0.00 -0.02 0.00 0.00 39.34 38.23 1dq8 n TYR 749 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1dq8 s ASN 750 N -0.18 0.32 -0.15 7.72 2.20 -1.21 -1.24 114.94 122.39 1dq8 s ASN 750 Ca 0.54 -1.20 -0.13 0.00 -0.94 0.00 0.00 52.86 51.13 1dq8 s ASN 750 Cb 0.33 0.61 -0.09 0.00 -2.00 0.00 0.00 41.25 40.09 1dq8 s ASN 750 CO -0.23 -1.20 0.05 0.00 -2.94 0.00 0.00 177.10 172.79 1dq8 h ALA 751 N 2.22 0.08 -0.20 3.54 0.00 -1.93 -3.46 119.26 119.52 1dq8 h ALA 751 Ca -0.28 -0.64 -0.23 0.00 0.00 0.00 0.00 54.91 53.76 1dq8 h ALA 751 Cb 1.25 0.46 -0.21 0.00 0.00 0.00 0.00 17.79 19.28 1dq8 h ALA 751 CO 0.39 0.44 -0.54 -2.39 0.00 0.00 0.00 179.25 177.15 1dq8 n HIS 752 N -4.59 -1.42 -0.29 0.00 1.44 -1.26 -4.96 115.22 104.15 1dq8 n HIS 752 Ca -0.14 -2.02 0.06 0.00 -2.01 0.00 0.00 57.72 53.61 1dq8 n HIS 752 Cb 0.37 1.10 0.21 0.00 0.12 0.00 0.00 29.99 31.79 1dq8 n HIS 752 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1dq8 h ALA 753 N 1.93 1.23 -0.93 1.59 0.00 -1.89 -0.94 119.26 120.25 1dq8 h ALA 753 Ca -0.29 0.08 0.18 0.00 0.00 0.00 0.00 54.91 54.89 1dq8 h ALA 753 Cb 1.28 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 1dq8 h ALA 753 CO 0.01 -0.09 0.60 0.00 0.00 0.00 0.00 179.25 179.76 1dq8 h ALA 754 N 1.54 1.95 -0.20 0.00 0.00 -1.93 0.21 119.26 120.83 1dq8 h ALA 754 Ca 0.45 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.39 1dq8 h ALA 754 Cb 0.62 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1dq8 h ALA 754 CO -0.36 -0.25 0.12 -0.91 0.00 0.00 0.00 179.25 177.86 1dq8 h ASN 755 N 0.59 0.24 -0.20 0.00 2.35 -1.57 -0.66 115.58 116.33 1dq8 h ASN 755 Ca 0.49 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 56.15 1dq8 h ASN 755 Cb 0.96 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 1dq8 h ASN 755 CO -0.24 0.22 -0.04 0.40 -1.65 0.00 0.00 177.43 176.12 1dq8 h ILE 756 N 0.24 1.28 -0.29 2.81 5.03 -1.23 -2.35 117.51 123.00 1dq8 h ILE 756 Ca 0.07 -1.02 0.01 0.00 -0.12 0.00 0.00 64.86 63.80 1dq8 h ILE 756 Cb 0.02 1.53 -0.02 0.00 -3.03 0.00 0.00 36.82 35.33 1dq8 h ILE 756 CO -0.01 0.31 0.18 0.58 -0.68 0.00 0.00 178.15 178.52 1dq8 h VAL 757 N 0.12 1.05 -0.26 1.67 2.07 -0.99 -2.09 116.25 117.82 1dq8 h VAL 757 Ca 0.05 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1dq8 h VAL 757 Cb 0.49 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1dq8 h VAL 757 CO 0.02 0.07 0.13 0.74 0.02 0.00 0.00 177.57 178.55 1dq8 h THR 758 N 0.37 1.13 -0.43 2.57 2.02 -1.12 -0.03 112.91 117.42 1dq8 h THR 758 Ca 0.11 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1dq8 h THR 758 Cb -0.02 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1dq8 h THR 758 CO -0.04 0.13 0.28 0.00 0.37 0.00 0.00 175.52 176.26 1dq8 h ALA 759 N 1.00 0.55 -0.49 6.16 0.00 -1.21 -1.17 119.26 124.11 1dq8 h ALA 759 Ca 0.09 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1dq8 h ALA 759 Cb 0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1dq8 h ALA 759 CO -0.01 0.02 -0.20 0.82 0.00 0.00 0.00 179.25 179.88 1dq8 h ILE 760 N 0.58 1.27 -0.40 0.00 2.04 -1.28 -0.93 117.51 118.79 1dq8 h ILE 760 Ca 0.16 -1.36 0.01 0.00 1.00 0.00 0.00 64.86 64.67 1dq8 h ILE 760 Cb -0.04 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1dq8 h ILE 760 CO -0.03 0.47 0.26 1.88 0.00 0.00 0.00 178.15 180.73 1dq8 h TYR 761 N 0.85 0.49 -0.57 1.37 -1.99 -0.66 0.54 116.97 117.01 1dq8 h TYR 761 Ca 0.12 0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.77 1dq8 h TYR 761 Cb 0.77 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 39.31 1dq8 h TYR 761 CO 0.05 0.30 0.02 0.82 -0.00 0.00 0.00 178.16 179.35 1dq8 h ILE 762 N 0.53 1.26 -0.16 -2.88 2.04 -1.21 0.11 117.51 117.19 1dq8 h ILE 762 Ca 0.15 -1.08 -0.16 0.00 1.00 0.00 0.00 64.86 64.77 1dq8 h ILE 762 Cb -0.05 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1dq8 h ILE 762 CO -0.04 0.39 -0.56 0.00 0.00 0.00 0.00 178.15 177.94 1dq8 h ALA 763 N 1.12 0.72 -0.60 1.87 0.00 -1.11 -3.25 119.26 118.02 1dq8 h ALA 763 Ca 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1dq8 h ALA 763 Cb 0.50 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1dq8 h ALA 763 CO 0.02 0.69 0.00 0.00 0.00 0.00 0.00 179.25 179.97 1dq8 n GLY 765 N 1.02 0.09 3.97 0.00 0.00 -0.92 -4.57 105.19 104.77 1dq8 n GLY 765 Ca 0.24 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1dq8 n GLY 765 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dq8 s GLN 766 N -4.37 1.08 -0.57 1.61 -1.52 0.33 -2.90 119.66 113.31 1dq8 s GLN 766 Ca 0.00 -0.85 -0.19 0.00 -1.95 0.00 0.00 55.36 52.36 1dq8 s GLN 766 Cb 0.00 -2.10 0.09 0.00 -0.22 0.00 0.00 33.01 30.78 1dq8 s GLN 766 CO 0.00 -1.98 0.72 0.34 -0.25 0.00 0.00 175.29 174.12 1dq8 s ASP 767 N -4.85 6.20 0.61 5.90 -1.08 -1.26 -4.71 116.67 117.47 1dq8 s ASP 767 Ca 0.71 -1.21 0.32 0.00 -0.52 0.00 0.00 52.55 51.85 1dq8 s ASP 767 Cb -0.04 -2.31 1.89 0.00 -1.46 0.00 0.00 42.92 41.00 1dq8 s ASP 767 CO 0.49 -1.09 2.24 0.00 0.52 0.00 0.00 175.17 177.33 1dq8 h ALA 768 N 9.18 1.49 0.00 3.66 0.00 -1.94 0.26 119.26 131.91 1dq8 h ALA 768 Ca -0.29 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1dq8 h ALA 768 Cb 1.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1dq8 h ALA 768 CO 1.07 -0.06 -0.01 0.00 0.00 0.00 0.00 179.25 180.25 1dq8 h ALA 769 N 1.94 1.01 0.00 0.00 0.00 -2.01 -2.03 119.26 118.17 1dq8 h ALA 769 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1dq8 h ALA 769 Cb 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1dq8 h ALA 769 CO -0.00 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.30 1dq8 n GLN 770 N -3.10 0.88 0.25 0.00 6.02 0.08 -2.95 117.38 118.56 1dq8 n GLN 770 Ca -0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.08 1dq8 n GLN 770 Cb 0.24 -1.43 0.67 0.00 1.02 0.00 0.00 30.24 30.73 1dq8 n GLN 770 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 177.06 175.08 1dq8 h ASN 771 N 0.00 0.00 -0.01 1.08 -1.24 -1.51 0.10 115.58 114.00 1dq8 h ASN 771 Ca 0.00 0.00 0.02 0.00 0.71 0.00 0.00 56.30 57.03 1dq8 h ASN 771 Cb 0.00 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.00 1dq8 h ASN 771 CO 0.00 0.10 -0.53 0.58 -1.29 0.00 0.00 177.43 176.30 1dq8 h VAL 772 N 0.00 0.00 0.00 2.57 2.07 -1.78 -2.38 116.25 116.74 1dq8 h VAL 772 Ca -0.00 0.00 -0.27 0.00 0.82 0.00 0.00 66.70 67.25 1dq8 h VAL 772 Cb 0.21 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.94 1dq8 h VAL 772 CO 0.01 0.00 -1.63 1.23 0.02 0.00 0.00 177.57 177.21 1dq8 h GLY 773 N -0.65 0.00 1.80 2.17 0.00 -1.80 -3.36 103.07 101.22 1dq8 h GLY 773 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.37 1dq8 h GLY 773 CO -0.36 0.00 0.07 1.76 0.00 0.00 0.00 176.54 178.02 1dq8 h SER 774 N 0.00 0.01 0.93 0.19 0.02 -0.77 -2.41 113.55 111.52 1dq8 h SER 774 Ca -0.25 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 1dq8 h SER 774 Cb 1.96 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.49 1dq8 h SER 774 CO 0.08 0.01 0.00 0.28 -1.14 0.00 0.00 176.83 176.06 1dq8 h SER 775 N 0.01 0.00 -1.62 3.07 0.02 -1.57 -3.39 113.55 110.06 1dq8 h SER 775 Ca 0.05 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.31 1dq8 h SER 775 Cb 0.18 0.00 0.06 0.00 0.14 0.00 0.00 62.40 62.78 1dq8 h SER 775 CO -0.00 0.00 0.32 0.59 -1.14 0.00 0.00 176.83 176.60 1dq8 n ASN 776 N -2.32 1.24 -3.64 3.07 3.02 -0.91 -4.57 115.26 111.15 1dq8 n ASN 776 Ca 0.03 1.13 -0.07 0.00 -0.03 0.00 0.00 54.58 55.64 1dq8 n ASN 776 Cb 0.28 -1.15 -0.07 0.00 -0.61 0.00 0.00 39.78 38.23 1dq8 n ASN 776 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dq8 s ILE 778 N 0.37 2.02 -0.19 0.00 2.07 -0.78 -2.06 121.20 122.64 1dq8 s ILE 778 Ca 0.02 -0.93 -0.04 0.00 -1.41 0.00 0.00 60.65 58.29 1dq8 s ILE 778 Cb -0.05 -1.81 -0.02 0.00 0.13 0.00 0.00 42.46 40.71 1dq8 s ILE 778 CO -0.09 0.54 -0.04 0.28 -1.91 0.00 0.00 174.94 173.72 1dq8 s THR 779 N 1.11 3.64 0.04 4.00 -1.32 -0.37 -1.82 115.64 120.92 1dq8 s THR 779 Ca 0.00 -0.42 0.06 0.00 -1.21 0.00 0.00 61.69 60.12 1dq8 s THR 779 Cb -0.14 -2.62 -0.03 0.00 -1.51 0.00 0.00 72.50 68.19 1dq8 s THR 779 CO -0.08 0.45 -0.14 -0.76 -2.21 0.00 0.00 174.62 171.87 1dq8 s LEU 780 N 0.94 2.81 0.03 9.08 1.43 -0.45 -4.89 118.68 127.63 1dq8 s LEU 780 Ca 0.00 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1dq8 s LEU 780 Cb -0.15 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1dq8 s LEU 780 CO 0.01 0.25 -0.09 -0.04 0.23 0.00 0.00 176.35 176.71 1dq8 s MET 781 N -1.53 0.63 0.01 1.70 -1.94 -1.26 -1.51 119.30 115.40 1dq8 s MET 781 Ca 0.16 -0.62 -0.23 0.00 -1.71 0.00 0.00 55.69 53.29 1dq8 s MET 781 Cb -0.11 -0.53 0.05 0.00 2.01 0.00 0.00 34.83 36.26 1dq8 s MET 781 CO 0.07 0.12 0.53 -2.00 -0.01 0.00 0.00 175.02 173.73 1dq8 s GLU 782 N -1.09 0.98 0.26 2.03 2.12 0.13 -4.90 118.70 118.23 1dq8 s GLU 782 Ca -0.03 -0.09 -0.29 0.00 0.36 0.00 0.00 54.97 54.91 1dq8 s GLU 782 Cb -0.07 0.45 -0.09 0.00 0.26 0.00 0.00 34.13 34.67 1dq8 s GLU 782 CO 0.01 -0.33 1.24 0.00 -0.54 0.00 0.00 175.26 175.63 1dq8 s ALA 783 N -1.91 3.47 0.13 6.30 0.00 -1.26 0.25 121.76 128.75 1dq8 s ALA 783 Ca -0.08 1.08 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 1dq8 s ALA 783 Cb -0.01 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1dq8 s ALA 783 CO 0.03 -0.44 0.07 0.45 0.00 0.00 0.00 175.76 175.86 1dq8 s SER 784 N -0.28 0.29 0.00 0.00 0.15 0.99 -4.76 113.70 110.09 1dq8 s SER 784 Ca 0.50 -1.18 0.00 0.00 0.70 0.00 0.00 55.95 55.98 1dq8 s SER 784 Cb -0.36 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 1dq8 s SER 784 CO 0.43 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.75 1dq8 n GLY 785 N -0.10 -2.82 0.44 9.45 0.00 -1.26 -1.16 105.19 109.74 1dq8 n GLY 785 Ca -0.06 -1.71 -0.15 0.00 0.00 0.00 0.00 46.02 44.10 1dq8 n GLY 785 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dq8 h PRO 786 N 0.00 -0.62 -0.01 1.61 0.11 -2.01 -2.48 132.00 128.60 1dq8 h PRO 786 Ca 0.00 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1dq8 h PRO 786 Cb 0.00 0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.25 1dq8 h PRO 786 CO 0.00 -0.42 -0.12 2.41 -0.21 0.00 0.00 178.00 179.66 1dq8 n THR 787 N -5.47 0.00 -3.19 -1.15 -1.04 -1.26 -4.91 114.28 97.26 1dq8 n THR 787 Ca -0.07 -0.16 -0.19 0.00 -2.04 0.00 0.00 64.05 61.59 1dq8 n THR 787 Cb 0.39 0.34 0.05 0.00 -1.82 0.00 0.00 70.33 69.29 1dq8 n THR 787 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1dq8 n ASN 788 N -0.37 -5.47 -0.16 8.00 5.03 -0.93 -4.89 115.26 116.46 1dq8 n ASN 788 Ca 0.16 -0.36 0.04 0.00 0.87 0.00 0.00 54.58 55.29 1dq8 n ASN 788 Cb 0.33 -4.17 -0.01 0.00 -1.02 0.00 0.00 39.78 34.92 1dq8 n ASN 788 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1dq8 n GLU 789 N -3.87 2.55 -2.82 3.52 1.02 -1.05 -4.43 120.64 115.56 1dq8 n GLU 789 Ca -0.03 -0.46 -0.28 0.00 -0.02 0.00 0.00 57.16 56.37 1dq8 n GLU 789 Cb 0.57 -1.01 -0.01 0.00 -0.02 0.00 0.00 31.44 30.97 1dq8 n GLU 789 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1dq8 s ASP 790 N -1.32 6.33 -0.36 1.62 1.01 -0.31 -3.86 116.67 119.79 1dq8 s ASP 790 Ca 0.06 0.90 -0.07 0.00 0.71 0.00 0.00 52.55 54.15 1dq8 s ASP 790 Cb 0.07 -2.23 0.05 0.00 1.01 0.00 0.00 42.92 41.82 1dq8 s ASP 790 CO 0.24 -0.48 0.15 -0.22 0.21 0.00 0.00 175.17 175.06 1dq8 s LEU 791 N -4.42 4.56 0.09 1.23 2.96 0.07 -0.01 118.68 123.17 1dq8 s LEU 791 Ca 0.47 -1.26 -0.24 0.00 -0.22 0.00 0.00 54.13 52.88 1dq8 s LEU 791 Cb -0.10 -1.90 -0.07 0.00 0.50 0.00 0.00 46.19 44.63 1dq8 s LEU 791 CO 0.40 -0.38 0.75 -0.47 -1.32 0.00 0.00 176.35 175.32 1dq8 s TYR 792 N 1.40 3.81 -0.00 5.38 5.04 0.14 -0.34 117.35 132.77 1dq8 s TYR 792 Ca -0.00 1.51 -0.03 0.00 -2.44 0.00 0.00 57.07 56.11 1dq8 s TYR 792 Cb -0.20 -2.77 -0.00 0.00 0.35 0.00 0.00 41.96 39.34 1dq8 s TYR 792 CO 0.02 0.40 0.05 -1.50 -1.34 0.00 0.00 175.55 173.19 1dq8 s ILE 793 N -0.57 0.06 0.00 3.14 2.07 -0.18 -0.69 121.20 125.02 1dq8 s ILE 793 Ca 0.36 -0.49 -0.10 0.00 -1.41 0.00 0.00 60.65 59.02 1dq8 s ILE 793 Cb -0.21 -0.24 0.01 0.00 0.13 0.00 0.00 42.46 42.14 1dq8 s ILE 793 CO 0.24 -0.27 0.19 -0.94 -1.91 0.00 0.00 174.94 172.25 1dq8 s SER 794 N -0.84 -0.03 -0.04 4.50 1.04 -0.57 -1.50 113.70 116.25 1dq8 s SER 794 Ca -0.09 -0.15 0.01 0.00 0.48 0.00 0.00 55.95 56.20 1dq8 s SER 794 Cb -0.06 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.33 1dq8 s SER 794 CO 0.00 -0.42 -0.07 0.00 0.98 0.00 0.00 173.24 173.73 1dq8 s THR 796 N 0.74 1.80 -0.35 0.00 2.01 -0.76 -1.00 115.64 118.08 1dq8 s THR 796 Ca -0.11 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 60.98 1dq8 s THR 796 Cb -0.14 -1.75 0.10 0.00 0.01 0.00 0.00 72.50 70.73 1dq8 s THR 796 CO 0.01 0.34 0.06 -0.04 -0.69 0.00 0.00 174.62 174.30 1dq8 s MET 797 N 1.36 1.52 0.00 4.92 -1.94 0.22 -1.86 119.30 123.52 1dq8 s MET 797 Ca 0.02 -1.89 0.18 0.00 -1.71 0.00 0.00 55.69 52.28 1dq8 s MET 797 Cb -0.15 -3.23 0.75 0.00 2.01 0.00 0.00 34.83 34.21 1dq8 s MET 797 CO -0.10 -0.95 1.56 -2.30 -0.01 0.00 0.00 175.02 173.22 1dq8 n PRO 798 N 4.24 0.00 -2.88 2.03 -0.02 -1.26 -1.32 135.00 135.79 1dq8 n PRO 798 Ca 0.04 0.20 -0.12 0.00 -2.02 0.00 0.00 63.50 61.59 1dq8 n PRO 798 Cb 0.42 -1.50 0.03 0.00 -0.02 0.00 0.00 33.50 32.43 1dq8 n PRO 798 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1dq8 n SER 799 N -1.50 0.04 -4.62 2.55 3.41 -1.22 -2.59 113.62 109.69 1dq8 n SER 799 Ca 0.04 -2.97 -0.43 0.00 -0.26 0.00 0.00 58.87 55.25 1dq8 n SER 799 Cb 0.20 0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 1dq8 n SER 799 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1dq8 s ILE 800 N -1.77 4.18 -0.39 -1.33 1.01 0.22 -3.54 121.20 119.59 1dq8 s ILE 800 Ca 0.30 1.30 -0.17 0.00 0.00 0.00 0.00 60.65 62.08 1dq8 s ILE 800 Cb 0.38 -4.31 0.01 0.00 0.01 0.00 0.00 42.46 38.55 1dq8 s ILE 800 CO -0.04 -0.64 0.44 -1.61 0.00 0.00 0.00 174.94 173.09 1dq8 s GLU 801 N 4.26 3.32 0.15 2.79 2.02 -1.26 -0.28 118.70 129.70 1dq8 s GLU 801 Ca 0.53 -0.55 -0.16 0.00 0.02 0.00 0.00 54.97 54.81 1dq8 s GLU 801 Cb -0.13 -3.90 0.03 0.00 0.10 0.00 0.00 34.13 30.23 1dq8 s GLU 801 CO 0.25 -0.73 0.42 -1.50 0.02 0.00 0.00 175.26 173.72 1dq8 s ILE 802 N 2.18 0.06 0.11 -1.63 2.07 -1.26 -4.86 121.20 117.86 1dq8 s ILE 802 Ca 0.13 -0.71 -0.25 0.00 -1.41 0.00 0.00 60.65 58.41 1dq8 s ILE 802 Cb -0.16 -1.34 0.08 0.00 0.13 0.00 0.00 42.46 41.16 1dq8 s ILE 802 CO 0.13 -0.26 0.79 -0.83 -1.91 0.00 0.00 174.94 172.86 1dq8 s GLY 803 N -2.84 -0.43 0.00 1.50 0.00 -1.26 -3.63 107.32 100.66 1dq8 s GLY 803 Ca 0.06 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.32 1dq8 s GLY 803 CO -0.08 0.17 0.82 -1.30 0.00 0.00 0.00 173.10 172.71 1dq8 n THR 804 N -0.35 0.67 -3.89 0.90 -2.24 0.61 -4.81 114.28 105.16 1dq8 n THR 804 Ca -0.10 -0.76 -0.11 0.00 -2.27 0.00 0.00 64.05 60.80 1dq8 n THR 804 Cb 0.62 0.70 -0.13 0.00 -2.10 0.00 0.00 70.33 69.42 1dq8 n THR 804 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1dq8 s VAL 805 N -0.67 0.04 0.00 2.28 1.01 -1.23 -1.46 120.40 120.37 1dq8 s VAL 805 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1dq8 s VAL 805 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 36.38 36.22 1dq8 s VAL 805 CO 0.00 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.53 1dq8 n GLY 806 N 2.48 -0.35 7.00 4.51 0.00 -1.26 -4.39 105.19 113.17 1dq8 n GLY 806 Ca -0.17 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.19 1dq8 n GLY 806 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dq8 n GLY 807 N -0.14 3.01 0.19 -0.02 0.00 -1.26 -2.08 105.19 104.89 1dq8 n GLY 807 Ca 0.00 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.91 1dq8 n GLY 807 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1dq8 h GLY 808 N 0.00 0.00 0.97 -0.02 0.00 -1.90 -2.14 103.07 99.97 1dq8 h GLY 808 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1dq8 h GLY 808 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 1dq8 n THR 809 N -2.47 0.00 0.71 4.70 -2.24 -0.88 -2.59 114.28 111.51 1dq8 n THR 809 Ca -0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 1dq8 n THR 809 Cb 0.14 -0.60 0.15 0.00 -2.10 0.00 0.00 70.33 67.92 1dq8 n THR 809 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1dq8 n ASN 810 N -0.98 0.62 -4.79 3.42 3.02 -0.81 -4.53 115.26 111.20 1dq8 n ASN 810 Ca 0.18 -0.11 -0.36 0.00 -0.03 0.00 0.00 54.58 54.26 1dq8 n ASN 810 Cb 0.08 0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 39.57 1dq8 n ASN 810 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1dq8 s LEU 811 N -3.74 4.31 0.09 3.41 1.43 -1.07 -4.97 118.68 118.14 1dq8 s LEU 811 Ca 0.07 1.69 -0.23 0.00 -1.03 0.00 0.00 54.13 54.63 1dq8 s LEU 811 Cb 0.15 -3.92 -0.14 0.00 0.03 0.00 0.00 46.19 42.31 1dq8 s LEU 811 CO 0.74 -0.06 1.73 -0.07 0.23 0.00 0.00 176.35 178.92 1dq8 h LEU 812 N 3.15 -0.09 -0.56 1.79 3.38 -1.89 -1.80 115.31 119.29 1dq8 h LEU 812 Ca -0.47 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.54 1dq8 h LEU 812 Cb 1.19 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.94 1dq8 h LEU 812 CO 0.65 -0.05 0.33 -0.65 0.09 0.00 0.00 178.44 178.81 1dq8 h PRO 813 N -0.07 0.64 -0.34 1.13 0.11 -1.95 -1.32 132.00 130.20 1dq8 h PRO 813 Ca 0.01 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.03 1dq8 h PRO 813 Cb 0.07 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.02 1dq8 h PRO 813 CO -0.02 0.42 -0.00 -0.56 -0.21 0.00 0.00 178.00 177.63 1dq8 h GLN 814 N 0.66 0.53 -0.27 1.05 -0.00 -1.75 -1.18 115.11 114.13 1dq8 h GLN 814 Ca 0.23 -0.11 -0.05 0.00 -0.00 0.00 0.00 58.65 58.72 1dq8 h GLN 814 Cb 0.04 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.48 27.43 1dq8 h GLN 814 CO -0.11 0.56 -0.06 1.96 -0.00 0.00 0.00 178.83 181.18 1dq8 h GLN 815 N 0.51 0.43 -0.59 0.06 4.20 -0.60 -1.22 115.11 117.89 1dq8 h GLN 815 Ca 0.11 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.68 1dq8 h GLN 815 Cb 0.33 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 1dq8 h GLN 815 CO 0.01 0.50 0.19 0.00 -0.67 0.00 0.00 178.83 178.86 1dq8 h ALA 816 N 1.54 1.21 -0.13 3.87 0.00 -0.12 0.34 119.26 125.98 1dq8 h ALA 816 Ca 0.09 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1dq8 h ALA 816 Cb 0.36 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1dq8 h ALA 816 CO 0.02 0.56 -0.66 0.00 0.00 0.00 0.00 179.25 179.16 1dq8 h LEU 818 N 0.37 0.48 -0.59 0.00 3.38 -0.56 -3.02 115.31 115.37 1dq8 h LEU 818 Ca -0.02 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 1dq8 h LEU 818 Cb 1.23 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1dq8 h LEU 818 CO 0.12 0.85 -0.54 1.56 0.09 0.00 0.00 178.44 180.52 1dq8 h GLN 819 N 0.37 0.46 -0.59 1.13 4.20 -0.28 -1.45 115.11 118.96 1dq8 h GLN 819 Ca 0.03 -0.28 0.12 0.00 0.06 0.00 0.00 58.65 58.58 1dq8 h GLN 819 Cb 0.90 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.68 1dq8 h GLN 819 CO 0.08 0.88 0.40 1.98 -0.67 0.00 0.00 178.83 181.50 1dq8 h MET 820 N 0.35 0.25 -0.01 1.46 4.05 -1.21 0.20 114.93 120.02 1dq8 h MET 820 Ca 0.01 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1dq8 h MET 820 Cb 1.07 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 1dq8 h MET 820 CO 0.10 0.17 -0.43 1.28 0.23 0.00 0.00 176.91 178.26 1dq8 n LEU 821 N -4.45 1.20 -0.86 3.39 4.77 -1.01 -4.63 117.00 115.41 1dq8 n LEU 821 Ca 0.10 -0.37 -0.09 0.00 -0.03 0.00 0.00 56.01 55.62 1dq8 n LEU 821 Cb 0.47 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.44 1dq8 n LEU 821 CO 0.35 0.24 -0.10 0.61 -1.33 0.00 0.00 177.39 177.15 1dq8 n GLY 822 N 1.40 0.50 0.07 -0.72 0.00 0.69 -4.92 105.19 102.21 1dq8 n GLY 822 Ca 0.10 -0.57 0.04 0.00 0.00 0.00 0.00 46.02 45.59 1dq8 n GLY 822 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1dq8 n VAL 823 N -3.41 1.24 -2.07 1.61 0.24 -0.60 -5.00 118.33 110.34 1dq8 n VAL 823 Ca -0.10 -1.41 -0.40 0.00 -2.04 0.00 0.00 64.34 60.39 1dq8 n VAL 823 Cb 0.44 0.20 -0.01 0.00 -1.47 0.00 0.00 33.84 33.01 1dq8 n VAL 823 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1dq8 s GLN 824 N -1.69 4.17 1.64 7.34 -0.44 -1.18 -4.75 119.66 124.76 1dq8 s GLN 824 Ca 0.14 2.21 0.00 0.00 -2.50 0.00 0.00 55.36 55.21 1dq8 s GLN 824 Cb 0.13 -2.92 0.00 0.00 -1.64 0.00 0.00 33.01 28.57 1dq8 s GLN 824 CO 0.01 -0.34 0.00 0.41 0.50 0.00 0.00 175.29 175.87 1dq8 n GLY 825 N 0.72 -1.19 3.79 2.59 0.00 -0.54 -4.84 105.19 105.72 1dq8 n GLY 825 Ca 0.02 -1.06 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 1dq8 n GLY 825 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dq8 s ALA 826 N -1.93 3.03 -0.89 4.61 0.00 -1.26 -4.70 121.76 120.62 1dq8 s ALA 826 Ca 0.00 0.67 -0.13 0.00 0.00 0.00 0.00 51.96 52.50 1dq8 s ALA 826 Cb 0.00 -3.26 0.23 0.00 0.00 0.00 0.00 23.12 20.09 1dq8 s ALA 826 CO 0.00 -0.23 0.84 0.00 0.00 0.00 0.00 175.76 176.37 1dq8 h LYS 828 N 7.51 0.41 0.00 0.00 1.57 -1.99 -0.94 116.57 123.13 1dq8 h LYS 828 Ca 0.12 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.78 1dq8 h LYS 828 Cb 1.00 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1dq8 h LYS 828 CO 0.81 0.27 -0.47 -0.44 -0.57 0.00 0.00 179.45 179.05 1dq8 h ASP 829 N 0.42 0.00 -1.40 0.86 3.32 -2.05 -3.39 116.42 114.19 1dq8 h ASP 829 Ca 0.54 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.24 1dq8 h ASP 829 Cb 1.34 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.63 1dq8 h ASP 829 CO -0.25 0.47 -0.72 -3.20 -1.72 0.00 0.00 179.24 173.82 1dq8 n ASN 830 N -3.25 -1.98 -4.64 6.45 5.15 -0.66 -5.13 115.26 111.20 1dq8 n ASN 830 Ca 0.02 -2.78 -0.57 0.00 -0.60 0.00 0.00 54.58 50.65 1dq8 n ASN 830 Cb 0.70 0.74 -0.07 0.00 -0.53 0.00 0.00 39.78 40.62 1dq8 n ASN 830 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1dq8 n PRO 831 N 2.51 0.88 0.00 1.20 -0.02 -0.45 -1.44 135.00 137.69 1dq8 n PRO 831 Ca 0.21 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1dq8 n PRO 831 Cb 0.54 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1dq8 n PRO 831 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dq8 n GLY 832 N 3.19 0.83 0.20 -1.23 0.00 -1.24 -4.81 105.19 102.13 1dq8 n GLY 832 Ca 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.23 1dq8 n GLY 832 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1dq8 h GLU 833 N 3.54 0.24 -0.38 1.61 4.57 -1.55 -1.13 114.58 121.49 1dq8 h GLU 833 Ca 0.00 -0.11 -0.16 0.00 -1.18 0.00 0.00 59.36 57.91 1dq8 h GLU 833 Cb 0.00 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1dq8 h GLU 833 CO 0.00 0.61 -0.38 -0.91 -1.18 0.00 0.00 179.01 177.15 1dq8 h ASN 834 N 0.21 1.00 -0.40 1.04 2.35 -1.88 -0.85 115.58 117.04 1dq8 h ASN 834 Ca 0.02 -0.47 -0.11 0.00 -0.55 0.00 0.00 56.30 55.19 1dq8 h ASN 834 Cb 0.80 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1dq8 h ASN 834 CO 0.06 1.26 -0.17 0.00 -1.65 0.00 0.00 177.43 176.93 1dq8 h ALA 835 N 0.77 0.56 -0.55 -0.83 0.00 -1.79 -1.58 119.26 115.84 1dq8 h ALA 835 Ca 0.06 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1dq8 h ALA 835 Cb 0.98 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1dq8 h ALA 835 CO 0.10 0.50 0.20 0.00 0.00 0.00 0.00 179.25 180.05 1dq8 h ARG 836 N 0.64 0.84 -0.64 0.00 3.08 -1.18 -0.80 114.38 116.32 1dq8 h ARG 836 Ca 0.09 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1dq8 h ARG 836 Cb 0.72 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 1dq8 h ARG 836 CO 0.05 0.75 0.39 0.37 -1.07 0.00 0.00 179.97 180.46 1dq8 h GLN 837 N 0.76 0.87 -0.68 0.04 5.75 -1.02 -0.97 115.11 119.85 1dq8 h GLN 837 Ca 0.18 -0.08 -0.06 0.00 -0.15 0.00 0.00 58.65 58.54 1dq8 h GLN 837 Cb 0.24 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.58 1dq8 h GLN 837 CO -0.01 0.62 0.19 1.25 -2.65 0.00 0.00 178.83 178.23 1dq8 h LEU 838 N 0.87 1.00 -0.65 -2.39 5.85 -0.89 -0.26 115.31 118.83 1dq8 h LEU 838 Ca 0.23 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1dq8 h LEU 838 Cb -0.03 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1dq8 h LEU 838 CO -0.04 0.94 0.37 0.00 -0.34 0.00 0.00 178.44 179.36 1dq8 h ALA 839 N 1.19 0.83 -0.71 1.25 0.00 -0.65 0.17 119.26 121.33 1dq8 h ALA 839 Ca 0.22 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1dq8 h ALA 839 Cb 0.31 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1dq8 h ALA 839 CO -0.00 0.33 0.22 0.00 0.00 0.00 0.00 179.25 179.80 1dq8 h ARG 840 N 0.88 1.11 -0.53 0.00 3.08 -0.81 -0.10 114.38 118.02 1dq8 h ARG 840 Ca 0.23 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 1dq8 h ARG 840 Cb 0.02 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1dq8 h ARG 840 CO -0.04 0.96 0.14 0.82 -1.07 0.00 0.00 179.97 180.78 1dq8 h ILE 841 N 1.06 1.24 -0.44 2.04 2.04 -0.31 0.24 117.51 123.37 1dq8 h ILE 841 Ca 0.23 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1dq8 h ILE 841 Cb 0.31 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1dq8 h ILE 841 CO -0.01 0.31 0.24 0.58 0.00 0.00 0.00 178.15 179.27 1dq8 h VAL 842 N 0.73 1.16 -0.54 1.67 2.07 -0.33 0.58 116.25 121.59 1dq8 h VAL 842 Ca 0.17 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 1dq8 h VAL 842 Cb 0.31 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1dq8 h VAL 842 CO -0.00 0.16 0.06 0.00 0.02 0.00 0.00 177.57 177.81 1dq8 h GLY 844 N 0.99 0.70 1.52 0.00 0.00 -0.55 -2.18 103.07 103.56 1dq8 h GLY 844 Ca 0.17 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.85 1dq8 h GLY 844 CO 0.01 0.52 -0.17 -0.84 0.00 0.00 0.00 176.54 176.06 1dq8 h THR 845 N 0.44 1.25 -0.46 4.70 2.02 -0.72 -1.80 112.91 118.34 1dq8 h THR 845 Ca 0.09 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.10 1dq8 h THR 845 Cb 0.55 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 1dq8 h THR 845 CO 0.03 0.38 0.23 0.58 0.37 0.00 0.00 175.52 177.10 1dq8 h VAL 846 N 0.51 1.18 -0.93 3.16 2.07 -1.07 -0.26 116.25 120.92 1dq8 h VAL 846 Ca 0.09 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.10 1dq8 h VAL 846 Cb 0.58 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 1dq8 h VAL 846 CO 0.04 0.20 0.59 -0.03 0.02 0.00 0.00 177.57 178.38 1dq8 h MET 847 N 0.60 1.24 -0.68 1.57 -1.53 -0.96 0.32 114.93 115.50 1dq8 h MET 847 Ca 0.16 -0.09 -0.08 0.00 -3.44 0.00 0.00 59.70 56.25 1dq8 h MET 847 Cb 0.11 -0.27 -0.03 0.00 -0.55 0.00 0.00 31.60 30.86 1dq8 h MET 847 CO -0.02 0.84 0.12 0.00 0.14 0.00 0.00 176.91 178.00 1dq8 h ALA 848 N 1.38 0.93 -0.38 0.39 0.00 -0.94 -0.94 119.26 119.70 1dq8 h ALA 848 Ca 0.34 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1dq8 h ALA 848 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1dq8 h ALA 848 CO -0.07 0.67 -0.02 0.78 0.00 0.00 0.00 179.25 180.61 1dq8 h GLY 849 N 1.06 0.74 0.90 0.00 0.00 0.48 -2.55 103.07 103.71 1dq8 h GLY 849 Ca 0.21 -0.56 0.03 0.00 0.00 0.00 0.00 47.33 47.01 1dq8 h GLY 849 CO 0.01 0.52 0.57 0.83 0.00 0.00 0.00 176.54 178.46 1dq8 h GLU 850 N 0.51 1.08 -0.19 4.80 4.39 -0.25 -1.58 114.58 123.35 1dq8 h GLU 850 Ca 0.11 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1dq8 h GLU 850 Cb 0.50 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1dq8 h GLU 850 CO 0.02 0.72 0.09 1.25 -1.16 0.00 0.00 179.01 179.93 1dq8 h LEU 851 N 1.11 0.25 -0.15 1.33 5.85 -1.03 -1.31 115.31 121.36 1dq8 h LEU 851 Ca 0.34 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 1dq8 h LEU 851 Cb -0.02 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 1dq8 h LEU 851 CO -0.11 0.30 -0.12 -1.28 -0.34 0.00 0.00 178.44 176.90 1dq8 h SER 852 N 0.17 0.37 -0.43 1.25 0.87 -1.20 -1.65 113.55 112.93 1dq8 h SER 852 Ca 0.06 -0.45 -0.03 0.00 -1.23 0.00 0.00 61.79 60.14 1dq8 h SER 852 Cb 0.12 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 1dq8 h SER 852 CO -0.01 0.74 0.14 0.25 -0.53 0.00 0.00 176.83 177.43 1dq8 h LEU 853 N -0.00 0.62 -1.36 2.23 5.85 -1.34 -1.66 115.31 119.64 1dq8 h LEU 853 Ca 0.03 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 1dq8 h LEU 853 Cb 0.63 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1dq8 h LEU 853 CO 0.03 0.65 0.22 0.24 -0.34 0.00 0.00 178.44 179.24 1dq8 h MET 854 N 0.55 0.65 -0.28 1.25 2.86 -1.22 -0.04 114.93 118.71 1dq8 h MET 854 Ca 0.14 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1dq8 h MET 854 Cb 0.25 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1dq8 h MET 854 CO -0.01 0.52 0.05 0.00 1.06 0.00 0.00 176.91 178.53 1dq8 h ALA 855 N 1.58 0.36 -0.46 6.32 0.00 -1.00 -0.53 119.26 125.55 1dq8 h ALA 855 Ca 0.16 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1dq8 h ALA 855 Cb 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1dq8 h ALA 855 CO -0.02 0.04 0.09 0.00 0.00 0.00 0.00 179.25 179.37 1dq8 h ALA 856 N 0.87 1.31 -0.37 0.00 0.00 -0.75 -0.28 119.26 120.05 1dq8 h ALA 856 Ca 0.08 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 1dq8 h ALA 856 Cb 0.32 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1dq8 h ALA 856 CO 0.00 0.48 -0.22 -0.07 0.00 0.00 0.00 179.25 179.45 1dq8 h LEU 857 N 0.67 0.83 -1.07 0.00 3.38 -0.71 1.14 115.31 119.54 1dq8 h LEU 857 Ca 0.15 -0.42 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 1dq8 h LEU 857 Cb 0.28 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1dq8 h LEU 857 CO -0.00 1.07 -0.34 0.00 0.09 0.00 0.00 178.44 179.26 1dq8 h ALA 858 N 0.79 1.22 -0.00 1.53 0.00 -0.59 -2.75 119.26 119.45 1dq8 h ALA 858 Ca 0.08 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1dq8 h ALA 858 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1dq8 h ALA 858 CO 0.06 0.53 -0.46 0.00 0.00 0.00 0.00 179.25 179.38 1dq8 n ALA 859 N -2.48 3.50 -1.55 0.00 0.00 -0.16 -4.96 120.51 114.87 1dq8 n ALA 859 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1dq8 n ALA 859 Cb 0.42 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1dq8 n ALA 859 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dq8 n GLY 860 N 1.45 0.43 1.42 0.00 0.00 -0.05 -4.99 105.19 103.45 1dq8 n GLY 860 Ca 0.08 -0.93 0.09 0.00 0.00 0.00 0.00 46.02 45.26 1dq8 n GLY 860 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1dq8 n HIS 861 N -3.52 1.25 0.12 1.61 8.25 0.37 -4.57 115.22 118.73 1dq8 n HIS 861 Ca 0.00 -0.52 -0.13 0.00 -0.26 0.00 0.00 57.72 56.81 1dq8 n HIS 861 Cb 0.30 -0.17 -0.08 0.00 1.12 0.00 0.00 29.99 31.15 1dq8 n HIS 861 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1dq8 h LEU 862 N 3.78 -0.29 -0.19 2.41 5.85 -1.91 -3.47 115.31 121.49 1dq8 h LEU 862 Ca 0.00 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1dq8 h LEU 862 Cb 1.24 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1dq8 h LEU 862 CO 0.16 0.12 0.00 0.52 -0.34 0.00 0.00 178.44 178.90