#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1d h ASP 437 N 0.00 0.56 -0.56 6.41 3.32 -2.05 -2.79 116.42 121.30 3d1d h ASP 437 Ca 0.00 -0.30 0.05 0.00 0.02 0.00 0.00 57.03 56.81 3d1d h ASP 437 Cb 0.00 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 39.33 3d1d h ASP 437 CO 0.00 0.71 -0.39 -0.07 -1.72 0.00 0.00 179.24 177.78 3d1d h LEU 438 N 0.38 -1.40 -0.76 1.55 3.38 -2.05 0.10 115.31 116.51 3d1d h LEU 438 Ca 0.09 0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.39 3d1d h LEU 438 Cb 0.42 0.61 -0.08 0.00 0.09 0.00 0.00 40.66 41.69 3d1d h LEU 438 CO 0.01 -0.19 0.36 1.88 0.09 0.00 0.00 178.44 180.59 3d1d h TYR 439 N -0.07 0.63 -0.73 1.13 -1.99 -1.97 0.35 116.97 114.31 3d1d h TYR 439 Ca 0.09 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 60.80 3d1d h TYR 439 Cb 0.31 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 38.84 3d1d h TYR 439 CO -0.92 0.17 0.23 0.82 -0.00 0.00 0.00 178.16 178.46 3d1d h ILE 440 N 0.56 1.26 -0.36 -2.88 1.08 -0.98 0.47 117.51 116.66 3d1d h ILE 440 Ca 0.40 -0.90 -0.14 0.00 -0.39 0.00 0.00 64.86 63.83 3d1d h ILE 440 Cb 0.51 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.72 3d1d h ILE 440 CO -0.33 0.35 -0.33 0.78 -0.69 0.00 0.00 178.15 177.93 3d1d h ASN 441 N 1.07 0.85 -0.37 1.72 2.35 0.02 -1.78 115.58 119.44 3d1d h ASN 441 Ca 0.23 -0.36 -0.05 0.00 -0.55 0.00 0.00 56.30 55.57 3d1d h ASN 441 Cb 0.30 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 3d1d h ASN 441 CO -0.01 1.10 0.02 -0.50 -1.65 0.00 0.00 177.43 176.39 3d1d h TRP 442 N 0.68 0.69 -0.00 1.19 6.55 0.20 -1.49 115.95 123.76 3d1d h TRP 442 Ca 0.07 -0.11 0.03 0.00 0.95 0.00 0.00 58.89 59.83 3d1d h TRP 442 Cb 0.88 -0.18 -0.05 0.00 -0.86 0.00 0.00 29.16 28.95 3d1d h TRP 442 CO 0.05 0.72 -0.29 1.25 -1.05 0.00 0.00 178.44 179.12 3d1d h LEU 443 N 0.46 -0.87 -2.22 -4.49 5.85 0.11 -0.30 115.31 113.84 3d1d h LEU 443 Ca 0.11 0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.99 3d1d h LEU 443 Cb 0.43 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 3d1d h LEU 443 CO 0.02 -0.36 0.14 0.11 -0.34 0.00 0.00 178.44 178.01 3d1d h LYS 444 N -0.44 0.00 0.00 1.25 1.57 -1.21 -1.82 116.57 115.93 3d1d h LYS 444 Ca 0.06 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.72 3d1d h LYS 444 Cb 0.53 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 3d1d h LYS 444 CO -0.25 0.00 -0.59 0.77 -0.57 0.00 0.00 179.45 178.81 3d1d h SER 445 N 0.00 0.00 -3.10 0.86 0.02 0.03 -3.42 113.55 107.94 3d1d h SER 445 Ca 0.07 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.46 3d1d h SER 445 Cb 0.36 0.00 0.09 0.00 0.14 0.00 0.00 62.40 62.99 3d1d h SER 445 CO -0.00 0.59 0.70 0.18 -1.14 0.00 0.00 176.83 177.16 3d1d n LEU 446 N -3.75 3.76 -0.31 5.07 4.77 -0.68 -4.89 117.00 120.98 3d1d n LEU 446 Ca -0.01 1.16 -0.04 0.00 -0.03 0.00 0.00 56.01 57.09 3d1d n LEU 446 Cb 0.61 -1.51 0.08 0.00 -2.33 0.00 0.00 43.42 40.27 3d1d n LEU 446 CO 0.41 -0.21 1.21 0.28 -1.33 0.00 0.00 177.39 177.75 3d1d h SER 447 N 4.02 0.97 0.12 -1.43 0.02 -1.89 -0.40 113.55 114.96 3d1d h SER 447 Ca -0.46 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.44 3d1d h SER 447 Cb 1.26 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 63.55 3d1d h SER 447 CO 0.74 0.72 -0.01 0.15 -1.14 0.00 0.00 176.83 177.29 3d1d h PHE 448 N 1.13 0.00 0.00 3.45 3.57 -1.94 0.94 116.94 124.09 3d1d h PHE 448 Ca 0.30 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.72 3d1d h PHE 448 Cb -0.10 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 3d1d h PHE 448 CO -0.01 0.01 -1.29 0.34 -2.23 0.00 0.00 178.31 175.13 3d1d n PHE 449 N -3.29 0.88 0.01 0.41 7.35 -0.24 -3.89 117.46 118.71 3d1d n PHE 449 Ca -0.03 0.28 -0.11 0.00 -0.76 0.00 0.00 57.45 56.83 3d1d n PHE 449 Cb 0.11 -0.99 -0.14 0.00 0.35 0.00 0.00 39.48 38.81 3d1d n PHE 449 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 3d1d h GLN 450 N 0.00 0.07 -0.00 -4.13 4.20 -0.30 -3.30 115.11 111.65 3d1d h GLN 450 Ca -0.09 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.51 3d1d h GLN 450 Cb 1.29 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.11 3d1d h GLN 450 CO 0.02 0.77 0.00 0.25 -0.67 0.00 0.00 178.83 179.20 3d1d n THR 451 N -3.22 0.00 -3.75 -0.54 -2.24 0.16 -4.44 114.28 100.25 3d1d n THR 451 Ca -0.15 -0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.33 3d1d n THR 451 Cb 1.03 -0.44 -0.13 0.00 -2.10 0.00 0.00 70.33 68.68 3d1d n THR 451 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3d1d s ASN 452 N -1.93 3.81 0.42 3.42 -0.87 -1.24 -4.83 114.94 113.72 3d1d s ASN 452 Ca 0.44 -2.53 0.10 0.00 -1.57 0.00 0.00 52.86 49.31 3d1d s ASN 452 Cb 0.20 -1.10 0.94 0.00 -0.02 0.00 0.00 41.25 41.27 3d1d s ASN 452 CO 0.34 -0.29 2.03 0.77 -2.57 0.00 0.00 177.10 177.39 3d1d h SER 453 N 6.91 0.41 -0.68 -1.22 4.64 -1.81 -0.81 113.55 120.99 3d1d h SER 453 Ca -0.03 -0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.43 3d1d h SER 453 Cb 0.94 -0.09 -0.12 0.00 -0.31 0.00 0.00 62.40 62.81 3d1d h SER 453 CO 0.50 0.28 -0.03 0.77 -0.87 0.00 0.00 176.83 177.49 3d1d h SER 454 N 0.48 -0.37 -0.74 4.97 4.64 -1.93 0.28 113.55 120.89 3d1d h SER 454 Ca 0.19 0.18 0.05 0.00 -0.47 0.00 0.00 61.79 61.74 3d1d h SER 454 Cb 0.17 0.33 -0.05 0.00 -0.31 0.00 0.00 62.40 62.53 3d1d h SER 454 CO -0.05 -0.16 0.45 0.00 -0.87 0.00 0.00 176.83 176.20 3d1d h ALA 456 N 1.34 1.53 -0.36 0.00 0.00 -0.44 -0.12 119.26 121.20 3d1d h ALA 456 Ca 0.31 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 3d1d h ALA 456 Cb 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3d1d h ALA 456 CO -0.14 0.44 -0.35 0.93 0.00 0.00 0.00 179.25 180.12 3d1d h GLU 457 N 0.89 0.83 -0.11 0.00 5.08 -0.29 -3.07 114.58 117.92 3d1d h GLU 457 Ca 0.24 -0.41 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 3d1d h GLU 457 Cb -0.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 3d1d h GLU 457 CO -0.05 1.05 0.04 0.00 -1.00 0.00 0.00 179.01 179.05 3d1d h ALA 458 N 0.90 0.14 -0.83 3.43 0.00 -0.11 -3.01 119.26 119.79 3d1d h ALA 458 Ca 0.07 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.93 3d1d h ALA 458 Cb 0.91 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 3d1d h ALA 458 CO 0.08 -0.26 0.54 1.25 0.00 0.00 0.00 179.25 180.86 3d1d h LEU 459 N 0.00 0.83 -0.06 0.00 5.85 -1.10 0.14 115.31 120.97 3d1d h LEU 459 Ca 0.04 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.77 3d1d h LEU 459 Cb 0.19 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3d1d h LEU 459 CO -0.00 0.55 -0.02 0.58 -0.34 0.00 0.00 178.44 179.21 3d1d h VAL 460 N 0.95 0.93 -0.10 1.05 2.07 -1.43 0.55 116.25 120.27 3d1d h VAL 460 Ca 0.35 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.72 3d1d h VAL 460 Cb 0.16 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3d1d h VAL 460 CO -0.12 0.00 -0.60 0.11 0.02 0.00 0.00 177.57 176.98 3d1d h LYS 461 N -0.01 0.34 0.07 1.57 1.57 -1.32 -3.33 116.57 115.46 3d1d h LYS 461 Ca 0.03 -0.23 -0.18 0.00 -1.87 0.00 0.00 60.65 58.40 3d1d h LYS 461 Cb 0.06 0.03 0.02 0.00 0.08 0.00 0.00 32.23 32.42 3d1d h LYS 461 CO -0.07 0.83 -0.76 0.28 -0.57 0.00 0.00 179.45 179.16 3d1d h VAL 462 N 0.25 1.45 -0.78 0.50 2.07 -0.46 -3.37 116.25 115.91 3d1d h VAL 462 Ca -0.00 -2.31 0.21 0.00 0.82 0.00 0.00 66.70 65.41 3d1d h VAL 462 Cb 1.11 2.86 -0.04 0.00 -1.52 0.00 0.00 31.29 33.71 3d1d h VAL 462 CO 0.10 0.67 0.54 -0.29 0.02 0.00 0.00 177.57 178.61 3d1d h ILE 463 N -0.18 0.66 -0.66 4.57 2.10 -0.00 -1.34 117.51 122.66 3d1d h ILE 463 Ca -0.12 -0.04 0.03 0.00 1.08 0.00 0.00 64.86 65.81 3d1d h ILE 463 Cb 1.52 0.52 -0.04 0.00 -1.09 0.00 0.00 36.82 37.73 3d1d h ILE 463 CO 0.15 0.02 0.43 -0.65 -1.08 0.00 0.00 178.15 177.02 3d1d h PRO 464 N 0.13 0.76 0.00 2.19 0.11 -1.72 -0.64 132.00 132.83 3d1d h PRO 464 Ca 0.38 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.39 3d1d h PRO 464 Cb 1.31 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3d1d h PRO 464 CO -0.05 0.51 -0.25 0.45 -0.21 0.00 0.00 178.00 178.45 3d1d h HIS 465 N 0.79 0.00 0.05 0.65 3.86 -1.49 -2.20 115.15 116.81 3d1d h HIS 465 Ca 0.26 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 3d1d h HIS 465 Cb 0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.53 3d1d h HIS 465 CO -0.00 0.25 -0.03 -0.92 0.86 0.00 0.00 177.93 178.09 3d1d h TYR 466 N 0.00 -0.07 -0.18 2.45 3.20 -1.16 0.71 116.97 121.92 3d1d h TYR 466 Ca -0.00 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3d1d h TYR 466 Cb 0.72 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 3d1d h TYR 466 CO 0.00 0.45 0.04 0.45 -1.64 0.00 0.00 178.16 177.46 3d1d h HIS 467 N -0.64 0.24 -0.21 -3.82 3.86 -1.28 0.34 115.15 113.64 3d1d h HIS 467 Ca -0.01 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3d1d h HIS 467 Cb 0.55 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.94 3d1d h HIS 467 CO 0.11 0.23 0.00 0.09 0.86 0.00 0.00 177.93 179.22 3d1d n ASN 468 N -4.43 1.75 -2.90 2.45 3.02 -0.84 -4.90 115.26 109.42 3d1d n ASN 468 Ca -0.00 -2.12 -0.18 0.00 -0.03 0.00 0.00 54.58 52.24 3d1d n ASN 468 Cb 0.14 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 3d1d n ASN 468 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3d1d n LYS 469 N 0.18 -3.07 0.02 3.52 4.76 0.11 -4.86 118.16 118.82 3d1d n LYS 469 Ca 0.08 0.59 -0.06 0.00 -2.87 0.00 0.00 58.31 56.05 3d1d n LYS 469 Cb 0.34 -5.27 -0.11 0.00 -1.84 0.00 0.00 35.03 28.15 3d1d n LYS 469 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3d1d h LEU 470 N -0.59 0.00 -8.70 -0.35 3.38 -1.05 -3.47 115.31 104.53 3d1d h LEU 470 Ca -0.38 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.25 3d1d h LEU 470 Cb 1.27 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.87 3d1d h LEU 470 CO 0.46 0.89 -0.71 0.27 0.09 0.00 0.00 178.44 179.43 3d1d s ILE 471 N -2.71 1.19 0.27 1.22 -4.36 -1.18 -5.03 121.20 110.60 3d1d s ILE 471 Ca -0.03 -2.07 0.03 0.00 -0.26 0.00 0.00 60.65 58.33 3d1d s ILE 471 Cb 0.08 -1.93 0.05 0.00 1.25 0.00 0.00 42.46 41.92 3d1d s ILE 471 CO 0.82 -0.68 0.37 -0.90 0.24 0.00 0.00 174.94 174.78 3d1d n ASP 472 N -0.24 0.85 0.08 4.36 5.68 -1.26 -4.56 116.55 121.45 3d1d n ASP 472 Ca -0.09 -1.63 -0.04 0.00 -0.50 0.00 0.00 54.79 52.53 3d1d n ASP 472 Cb 0.61 -0.21 0.18 0.00 -1.14 0.00 0.00 41.12 40.56 3d1d n ASP 472 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 3d1d h PHE 473 N -0.07 0.35 -0.41 2.11 3.57 -1.99 -2.79 116.94 117.71 3d1d h PHE 473 Ca -0.12 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.31 3d1d h PHE 473 Cb 0.54 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 3d1d h PHE 473 CO 0.00 0.70 0.19 0.77 -2.23 0.00 0.00 178.31 177.74 3d1d h SER 474 N 0.24 0.27 -0.62 0.41 0.02 -1.95 -0.81 113.55 111.11 3d1d h SER 474 Ca 0.02 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.92 3d1d h SER 474 Cb 0.90 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 3d1d h SER 474 CO 0.07 0.19 0.09 1.56 -1.14 0.00 0.00 176.83 177.61 3d1d h GLN 475 N 0.39 1.03 -0.55 3.45 4.20 -1.94 -1.93 115.11 119.75 3d1d h GLN 475 Ca 0.18 -0.28 0.09 0.00 0.06 0.00 0.00 58.65 58.70 3d1d h GLN 475 Cb 0.10 -0.12 -0.07 0.00 0.30 0.00 0.00 27.48 27.69 3d1d h GLN 475 CO -0.14 0.97 0.16 0.28 -0.67 0.00 0.00 178.83 179.43 3d1d h VAL 476 N 0.93 0.74 -0.32 -0.54 2.07 -1.14 0.12 116.25 118.12 3d1d h VAL 476 Ca 0.19 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.60 3d1d h VAL 476 Cb 0.44 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3d1d h VAL 476 CO 0.01 0.06 0.20 -0.07 0.02 0.00 0.00 177.57 177.79 3d1d h LEU 477 N 0.32 0.34 0.06 2.57 3.38 -0.72 -1.39 115.31 119.87 3d1d h LEU 477 Ca 0.28 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 3d1d h LEU 477 Cb 0.36 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3d1d h LEU 477 CO -0.32 0.25 -0.03 -0.61 0.09 0.00 0.00 178.44 177.82 3d1d h GLN 478 N 0.41 -0.08 0.26 1.13 4.15 -0.55 -0.10 115.11 120.34 3d1d h GLN 478 Ca 0.12 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.55 3d1d h GLN 478 Cb -0.03 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 3d1d h GLN 478 CO -0.04 -0.01 -0.27 -0.07 -1.93 0.00 0.00 178.83 176.51 3d1d h LEU 479 N -0.12 -0.72 0.02 -2.39 3.38 -0.68 0.42 115.31 115.22 3d1d h LEU 479 Ca -0.01 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.05 3d1d h LEU 479 Cb 0.10 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3d1d h LEU 479 CO 0.01 -0.39 -0.15 0.58 0.09 0.00 0.00 178.44 178.59 3d1d h VAL 480 N -0.56 0.64 0.00 1.22 2.07 -1.21 -1.88 116.25 116.53 3d1d h VAL 480 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 3d1d h VAL 480 Cb 0.52 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 3d1d h VAL 480 CO -0.06 0.00 -0.05 -0.26 0.02 0.00 0.00 177.57 177.22 3d1d h PHE 481 N -0.26 0.00 0.00 1.57 0.04 -0.88 -1.42 116.94 115.99 3d1d h PHE 481 Ca 0.04 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.78 3d1d h PHE 481 Cb 0.31 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.46 3d1d h PHE 481 CO -0.20 0.05 -0.15 0.66 -0.60 0.00 0.00 178.31 178.07 3d1d h SER 482 N 0.00 0.00 -0.32 2.17 4.64 -0.05 -2.17 113.55 117.82 3d1d h SER 482 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d1d h SER 482 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3d1d h SER 482 CO 0.01 0.15 0.00 0.00 -0.87 0.00 0.00 176.83 176.12 3d1d n ALA 483 N -2.31 2.48 -2.08 5.18 0.00 -0.53 -4.92 120.51 118.34 3d1d n ALA 483 Ca -0.02 -0.59 -0.41 0.00 0.00 0.00 0.00 53.44 52.42 3d1d n ALA 483 Cb 0.27 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.70 3d1d n ALA 483 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3d1d s SER 484 N -0.96 7.26 -0.12 0.00 1.04 -0.82 -4.08 113.70 116.01 3d1d s SER 484 Ca 0.22 2.09 0.03 0.00 0.48 0.00 0.00 55.95 58.77 3d1d s SER 484 Cb 0.12 -2.60 -0.10 0.00 0.10 0.00 0.00 66.02 63.54 3d1d s SER 484 CO 0.14 -0.23 -0.07 -0.62 0.98 0.00 0.00 173.24 173.44 3d1d n GLU 485 N 2.43 0.89 -3.93 4.02 1.02 -1.26 -5.00 120.64 118.81 3d1d n GLU 485 Ca 0.03 0.05 -0.35 0.00 -0.02 0.00 0.00 57.16 56.87 3d1d n GLU 485 Cb 0.46 -1.27 -0.11 0.00 -0.02 0.00 0.00 31.44 30.50 3d1d n GLU 485 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3d1d s LYS 486 N -2.26 3.82 -0.30 3.49 1.02 -1.26 -5.06 119.74 119.19 3d1d s LYS 486 Ca -0.14 -0.41 -0.26 0.00 0.02 0.00 0.00 55.97 55.17 3d1d s LYS 486 Cb 0.04 -3.25 0.20 0.00 -0.52 0.00 0.00 37.83 34.30 3d1d s LYS 486 CO 0.34 0.06 1.45 -0.59 -0.92 0.00 0.00 175.35 175.70 3d1d s PHE 487 N 0.94 -0.01 0.31 3.18 -0.12 -1.26 -4.95 117.98 116.06 3d1d s PHE 487 Ca 0.04 0.03 -0.29 0.00 -0.05 0.00 0.00 56.93 56.66 3d1d s PHE 487 Cb -0.14 0.50 -0.13 0.00 -0.63 0.00 0.00 43.02 42.62 3d1d s PHE 487 CO 0.03 -0.01 1.25 -0.35 -0.05 0.00 0.00 175.22 176.09 3d1d n PRO 488 N 1.18 1.95 -3.78 1.99 -0.04 -1.26 -4.85 135.00 130.18 3d1d n PRO 488 Ca -0.06 0.69 -0.34 0.00 -0.04 0.00 0.00 63.50 63.74 3d1d n PRO 488 Cb 0.58 -2.24 -0.11 0.00 -0.04 0.00 0.00 33.50 31.69 3d1d n PRO 488 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3d1d s ILE 489 N -0.90 3.42 0.74 0.52 1.01 -1.26 0.12 121.20 124.85 3d1d s ILE 489 Ca 0.58 -3.22 -0.12 0.00 0.00 0.00 0.00 60.65 57.89 3d1d s ILE 489 Cb -0.61 -3.25 0.04 0.00 0.01 0.00 0.00 42.46 38.65 3d1d s ILE 489 CO 0.60 -0.88 1.10 -1.10 0.00 0.00 0.00 174.94 174.65 3d1d s GLN 490 N -0.32 2.40 -0.10 2.79 -1.52 -0.85 -4.88 119.66 117.19 3d1d s GLN 490 Ca 0.18 1.27 0.03 0.00 -1.95 0.00 0.00 55.36 54.89 3d1d s GLN 490 Cb -0.20 -1.91 -0.01 0.00 -0.22 0.00 0.00 33.01 30.67 3d1d s GLN 490 CO -0.04 -1.54 -0.21 -2.00 -0.25 0.00 0.00 175.29 171.25 3d1d s GLU 491 N -4.60 3.00 0.00 2.91 2.56 -1.26 -4.71 118.70 116.60 3d1d s GLU 491 Ca 0.64 -0.83 0.00 0.00 0.00 0.00 0.00 54.97 54.78 3d1d s GLU 491 Cb -0.19 -2.35 0.00 0.00 2.00 0.00 0.00 34.13 33.59 3d1d s GLU 491 CO 0.51 0.26 0.00 0.09 -0.56 0.00 0.00 175.26 175.55 3d1d n ASN 492 N 3.33 -4.00 -4.74 -1.70 4.13 -1.26 -4.90 115.26 106.12 3d1d n ASN 492 Ca -0.18 0.27 -0.37 0.00 1.68 0.00 0.00 54.58 55.98 3d1d n ASN 492 Cb 0.53 -0.94 -0.07 0.00 -1.54 0.00 0.00 39.78 37.76 3d1d n ASN 492 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3d1d s GLN 493 N -0.54 4.21 0.64 3.52 -0.21 -1.26 -5.05 119.66 120.97 3d1d s GLN 493 Ca 0.00 0.18 -0.17 0.00 0.02 0.00 0.00 55.36 55.39 3d1d s GLN 493 Cb 0.00 -3.40 -0.08 0.00 1.00 0.00 0.00 33.01 30.53 3d1d s GLN 493 CO 0.00 0.28 0.34 -2.30 -2.12 0.00 0.00 175.29 171.49 3d1d n PRO 494 N 3.38 0.31 -0.23 2.91 -0.02 -1.26 -4.84 135.00 135.26 3d1d n PRO 494 Ca -0.11 0.13 -0.05 0.00 -2.02 0.00 0.00 63.50 61.45 3d1d n PRO 494 Cb 0.52 -1.59 0.11 0.00 -0.02 0.00 0.00 33.50 32.52 3d1d n PRO 494 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3d1d h LEU 495 N -0.11 0.98 -2.05 2.45 5.85 -2.00 -2.78 115.31 117.66 3d1d h LEU 495 Ca -0.45 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.08 3d1d h LEU 495 Cb 1.38 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 3d1d h LEU 495 CO 0.43 0.92 -0.08 -0.65 -0.34 0.00 0.00 178.44 178.71 3d1d h PRO 496 N 1.02 0.00 0.16 5.25 0.11 -1.99 -0.85 132.00 135.70 3d1d h PRO 496 Ca 0.22 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 66.03 3d1d h PRO 496 Cb 0.28 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.42 3d1d h PRO 496 CO -0.01 0.08 -1.31 0.93 -0.21 0.00 0.00 178.00 177.49 3d1d h GLU 497 N 0.00 0.55 0.26 1.05 3.07 -1.86 -2.19 114.58 115.47 3d1d h GLU 497 Ca -0.00 -0.81 0.00 0.00 -0.50 0.00 0.00 59.36 58.05 3d1d h GLU 497 Cb 0.19 0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 3d1d h GLU 497 CO 0.01 1.37 -0.26 1.96 -1.40 0.00 0.00 179.01 180.69 3d1d h GLN 498 N 0.21 -0.54 -0.17 2.33 1.08 -1.15 0.19 115.11 117.06 3d1d h GLN 498 Ca -0.20 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.04 3d1d h GLN 498 Cb 1.99 0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 29.53 3d1d h GLN 498 CO 0.24 -0.36 0.10 -0.07 -0.95 0.00 0.00 178.83 177.80 3d1d h LEU 499 N -0.56 0.19 -0.34 1.46 3.38 -1.26 0.11 115.31 118.29 3d1d h LEU 499 Ca -0.01 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3d1d h LEU 499 Cb 0.52 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3d1d h LEU 499 CO -0.06 0.15 0.01 -0.03 0.09 0.00 0.00 178.44 178.60 3d1d h MET 500 N 0.23 0.60 -0.18 1.13 4.05 -0.58 -1.17 114.93 119.02 3d1d h MET 500 Ca 0.06 -0.19 -0.02 0.00 -0.28 0.00 0.00 59.70 59.27 3d1d h MET 500 Cb -0.01 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.72 3d1d h MET 500 CO -0.01 0.72 0.02 0.35 0.23 0.00 0.00 176.91 178.21 3d1d h PHE 501 N 0.42 0.33 0.00 1.39 3.57 0.51 -2.91 116.94 120.25 3d1d h PHE 501 Ca 0.10 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 3d1d h PHE 501 Cb 0.44 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 3d1d h PHE 501 CO 0.04 0.48 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.39 3d1d h LEU 502 N 0.08 0.00 -0.07 0.59 3.38 -0.73 0.30 115.31 118.85 3d1d h LEU 502 Ca 0.05 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3d1d h LEU 502 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3d1d h LEU 502 CO 0.01 0.14 -0.13 0.28 0.09 0.00 0.00 178.44 178.82 3d1d h SER 503 N 0.00 0.23 -0.59 -0.43 0.02 -1.09 -1.47 113.55 110.22 3d1d h SER 503 Ca -0.00 -0.56 -0.06 0.00 -0.84 0.00 0.00 61.79 60.32 3d1d h SER 503 Cb 0.32 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 3d1d h SER 503 CO 0.02 0.75 0.13 -1.13 -1.14 0.00 0.00 176.83 175.46 3d1d h ASN 504 N -0.28 0.93 -0.32 3.07 -0.73 -1.31 -2.95 115.58 113.99 3d1d h ASN 504 Ca 0.00 -0.19 -0.01 0.00 1.87 0.00 0.00 56.30 57.97 3d1d h ASN 504 Cb 0.72 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 39.05 3d1d h ASN 504 CO 0.03 0.91 0.16 0.25 -0.37 0.00 0.00 177.43 178.41 3d1d h LEU 505 N 0.94 0.42 -2.03 0.34 5.85 -0.88 -2.59 115.31 117.35 3d1d h LEU 505 Ca 0.20 -0.12 0.12 0.00 0.84 0.00 0.00 57.88 58.92 3d1d h LEU 505 Cb 0.36 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3d1d h LEU 505 CO 0.00 0.43 0.33 -0.08 -0.34 0.00 0.00 178.44 178.78 3d1d h GLU 506 N 0.39 0.00 0.00 1.25 4.22 -1.09 -1.15 114.58 118.20 3d1d h GLU 506 Ca 0.11 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.55 3d1d h GLU 506 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3d1d h GLU 506 CO -0.01 0.00 -0.45 1.63 -2.18 0.00 0.00 179.01 178.00 3d1d n LYS 507 N -4.26 0.12 -1.22 1.92 5.02 -0.99 -4.96 118.16 113.80 3d1d n LYS 507 Ca 0.07 0.04 -0.33 0.00 -2.02 0.00 0.00 58.31 56.08 3d1d n LYS 507 Cb 0.52 -1.58 0.11 0.00 -0.02 0.00 0.00 35.03 34.06 3d1d n LYS 507 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3d1d s GLN 508 N -3.07 1.86 0.76 1.97 -1.52 -0.44 -5.01 119.66 114.22 3d1d s GLN 508 Ca 0.10 1.62 -0.11 0.00 -1.95 0.00 0.00 55.36 55.02 3d1d s GLN 508 Cb 0.16 -1.82 0.05 0.00 -0.22 0.00 0.00 33.01 31.18 3d1d s GLN 508 CO 0.68 -2.01 1.08 0.95 -0.25 0.00 0.00 175.29 175.73 3d1d s THR 509 N -2.29 3.49 0.03 -0.19 -4.23 -1.26 -4.62 115.64 106.58 3d1d s THR 509 Ca 0.70 0.49 -0.05 0.00 -1.18 0.00 0.00 61.69 61.64 3d1d s THR 509 Cb -0.26 -3.07 -0.01 0.00 1.34 0.00 0.00 72.50 70.51 3d1d s THR 509 CO 0.50 -0.63 0.68 -2.65 -0.54 0.00 0.00 174.62 171.97 3d1d n PRO 510 N -3.42 -0.08 -0.08 3.99 -0.02 -1.26 -0.98 135.00 133.15 3d1d n PRO 510 Ca 0.08 0.67 -0.09 0.00 -2.02 0.00 0.00 63.50 62.14 3d1d n PRO 510 Cb 0.53 -1.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.00 3d1d n PRO 510 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3d1d h PHE 511 N 0.00 0.36 -0.52 6.00 3.57 -1.95 -2.14 116.94 122.25 3d1d h PHE 511 Ca 0.03 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 3d1d h PHE 511 Cb 0.07 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 3d1d h PHE 511 CO -0.56 0.23 0.12 0.00 -2.23 0.00 0.00 178.31 175.87 3d1d h ALA 512 N 1.10 1.24 -0.33 2.41 0.00 -1.67 -2.12 119.26 119.89 3d1d h ALA 512 Ca 0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3d1d h ALA 512 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3d1d h ALA 512 CO -0.02 0.53 0.05 -0.22 0.00 0.00 0.00 179.25 179.59 3d1d h LYS 513 N 0.77 0.55 0.00 0.00 3.64 -0.89 0.14 116.57 120.78 3d1d h LYS 513 Ca 0.17 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3d1d h LYS 513 Cb 0.29 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 3d1d h LYS 513 CO -0.00 0.64 -0.04 0.00 -2.27 0.00 0.00 179.45 177.78 3d1d h ALA 514 N 0.89 1.70 0.04 5.00 0.00 -1.10 0.15 119.26 125.94 3d1d h ALA 514 Ca 0.10 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 3d1d h ALA 514 Cb 0.36 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.15 3d1d h ALA 514 CO 0.01 0.05 -0.41 0.28 0.00 0.00 0.00 179.25 179.18 3d1d h VAL 515 N 0.00 1.58 -0.62 0.00 2.07 -0.70 -2.70 116.25 115.88 3d1d h VAL 515 Ca -0.00 -2.23 -0.08 0.00 0.82 0.00 0.00 66.70 65.21 3d1d h VAL 515 Cb 0.08 3.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.84 3d1d h VAL 515 CO 0.00 0.61 0.08 1.23 0.02 0.00 0.00 177.57 179.52 3d1d h GLY 516 N -0.53 1.10 1.14 2.17 0.00 -0.22 -0.43 103.07 106.30 3d1d h GLY 516 Ca -0.06 -0.73 -0.10 0.00 0.00 0.00 0.00 47.33 46.43 3d1d h GLY 516 CO 0.08 0.68 -0.05 0.23 0.00 0.00 0.00 176.54 177.47 3d1d h SER 517 N 0.96 1.01 -0.53 0.19 0.87 -1.09 -0.01 113.55 114.95 3d1d h SER 517 Ca 0.19 -0.31 -0.08 0.00 -1.23 0.00 0.00 61.79 60.36 3d1d h SER 517 Cb 0.44 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 3d1d h SER 517 CO 0.01 1.09 0.01 0.28 -0.53 0.00 0.00 176.83 177.69 3d1d h SER 518 N 0.92 0.91 0.59 6.23 0.02 -1.12 -3.03 113.55 118.07 3d1d h SER 518 Ca 0.15 -0.30 -0.14 0.00 -0.84 0.00 0.00 61.79 60.66 3d1d h SER 518 Cb 0.61 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 3d1d h SER 518 CO 0.04 0.99 -0.64 0.40 -1.14 0.00 0.00 176.83 176.48 3d1d h ILE 519 N 0.80 1.45 0.00 3.27 1.08 -0.96 -2.94 117.51 120.21 3d1d h ILE 519 Ca 0.15 -2.16 -0.00 0.00 -0.39 0.00 0.00 64.86 62.46 3d1d h ILE 519 Cb 0.52 2.16 -0.00 0.00 -3.07 0.00 0.00 36.82 36.42 3d1d h ILE 519 CO 0.03 0.62 -0.01 0.22 -0.69 0.00 0.00 178.15 178.31 3d1d h TYR 520 N 0.03 0.00 -0.51 1.37 3.20 -0.87 -1.03 116.97 119.15 3d1d h TYR 520 Ca -0.01 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 3d1d h TYR 520 Cb 1.14 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.39 3d1d h TYR 520 CO 0.00 0.01 -0.03 0.87 -1.64 0.00 0.00 178.16 177.38 3d1d h LYS 521 N 0.00 0.89 0.00 1.82 6.56 -1.43 -1.92 116.57 122.49 3d1d h LYS 521 Ca -0.00 -0.27 -0.16 0.00 -1.06 0.00 0.00 60.65 59.16 3d1d h LYS 521 Cb 0.37 -0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 31.92 3d1d h LYS 521 CO 0.00 0.90 -0.77 -0.07 -2.06 0.00 0.00 179.45 177.46 3d1d h LEU 522 N 0.82 0.00 0.53 2.94 3.38 -1.33 0.81 115.31 122.46 3d1d h LEU 522 Ca 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3d1d h LEU 522 Cb 0.53 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.28 3d1d h LEU 522 CO 0.03 0.77 -0.26 0.58 0.09 0.00 0.00 178.44 179.65 3d1d h VAL 523 N 0.00 0.45 -0.01 1.22 2.07 -1.01 0.30 116.25 119.28 3d1d h VAL 523 Ca -0.01 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3d1d h VAL 523 Cb 1.43 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 3d1d h VAL 523 CO 0.10 0.02 -0.02 0.71 0.02 0.00 0.00 177.57 178.41 3d1d h THR 524 N -0.81 1.45 -0.00 2.57 1.35 -1.40 -0.14 112.91 115.92 3d1d h THR 524 Ca -0.07 -1.34 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 3d1d h THR 524 Cb 0.59 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.34 3d1d h THR 524 CO 0.12 0.35 -0.03 0.61 -0.25 0.00 0.00 175.52 176.32 3d1d n GLY 525 N 0.43 -1.45 0.00 5.82 0.00 0.28 -4.18 105.19 106.08 3d1d n GLY 525 Ca -0.09 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3d1d n GLY 525 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d1d n LYS 526 N -1.47 0.00 -2.66 1.61 5.02 0.96 -4.99 118.16 116.64 3d1d n LYS 526 Ca 0.08 -0.22 -0.19 0.00 -2.02 0.00 0.00 58.31 55.95 3d1d n LYS 526 Cb 0.33 -0.44 0.01 0.00 -0.02 0.00 0.00 35.03 34.91 3d1d n LYS 526 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3d1d n ASN 527 N 0.00 -5.51 -4.77 4.39 5.03 -0.07 -4.93 115.26 109.41 3d1d n ASN 527 Ca 0.00 -0.14 -0.41 0.00 0.87 0.00 0.00 54.58 54.90 3d1d n ASN 527 Cb 0.38 -4.45 -0.01 0.00 -1.02 0.00 0.00 39.78 34.68 3d1d n ASN 527 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 3d1d s LEU 528 N -5.66 4.34 0.12 3.41 0.20 -0.86 -2.01 118.68 118.22 3d1d s LEU 528 Ca 0.14 2.97 -0.34 0.00 0.69 0.00 0.00 54.13 57.60 3d1d s LEU 528 Cb -0.06 -3.66 -0.14 0.00 -0.43 0.00 0.00 46.19 41.90 3d1d s LEU 528 CO 0.18 -0.82 1.63 -0.24 -0.29 0.00 0.00 176.35 176.80 3d1d n SER 529 N 0.75 3.14 -0.05 3.68 2.88 0.12 -4.47 113.62 119.68 3d1d n SER 529 Ca 0.02 1.06 -0.01 0.00 -1.33 0.00 0.00 58.87 58.61 3d1d n SER 529 Cb 0.39 -1.42 0.27 0.00 -0.75 0.00 0.00 64.21 62.71 3d1d n SER 529 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3d1d h LEU 530 N 6.47 0.58 -0.43 2.46 5.85 -1.90 0.83 115.31 129.17 3d1d h LEU 530 Ca -0.46 -0.10 -0.16 0.00 0.84 0.00 0.00 57.88 58.01 3d1d h LEU 530 Cb 1.26 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 3d1d h LEU 530 CO 0.90 0.61 -0.41 0.44 -0.34 0.00 0.00 178.44 179.64 3d1d h ASP 531 N 0.61 0.93 -0.63 1.25 3.32 -1.99 -1.39 116.42 118.52 3d1d h ASP 531 Ca 0.14 -0.43 -0.05 0.00 0.02 0.00 0.00 57.03 56.70 3d1d h ASP 531 Cb 0.28 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3d1d h ASP 531 CO 0.00 1.21 0.21 0.15 -1.72 0.00 0.00 179.24 179.09 3d1d h PHE 532 N 0.70 1.03 -0.31 4.55 3.57 -1.78 -1.77 116.94 122.93 3d1d h PHE 532 Ca 0.05 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 3d1d h PHE 532 Cb 0.99 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 3d1d h PHE 532 CO 0.06 0.82 0.18 0.00 -2.23 0.00 0.00 178.31 177.14 3d1d h ALA 533 N 1.25 0.39 -0.91 2.41 0.00 -0.51 -2.11 119.26 119.79 3d1d h ALA 533 Ca 0.21 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3d1d h ALA 533 Cb 0.27 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 3d1d h ALA 533 CO -0.01 -0.10 0.59 0.77 0.00 0.00 0.00 179.25 180.50 3d1d h SER 534 N 0.39 1.00 -0.61 0.00 0.02 -0.72 -1.69 113.55 111.94 3d1d h SER 534 Ca 0.11 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 3d1d h SER 534 Cb 0.02 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.30 3d1d h SER 534 CO -0.02 0.70 0.33 1.56 -1.14 0.00 0.00 176.83 178.26 3d1d h GLN 535 N 1.17 0.85 -0.95 3.45 4.20 -1.02 0.20 115.11 123.02 3d1d h GLN 535 Ca 0.35 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.95 3d1d h GLN 535 Cb -0.05 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 27.52 3d1d h GLN 535 CO -0.10 0.66 0.57 0.82 -0.67 0.00 0.00 178.83 180.11 3d1d h ILE 536 N 0.83 1.26 -0.20 2.54 1.08 -0.85 -1.55 117.51 120.62 3d1d h ILE 536 Ca 0.21 -0.56 -0.16 0.00 -0.39 0.00 0.00 64.86 63.96 3d1d h ILE 536 Cb 0.06 -0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 33.72 3d1d h ILE 536 CO -0.03 0.27 -0.54 0.25 -0.69 0.00 0.00 178.15 177.41 3d1d h LEU 537 N 1.31 0.64 0.39 1.44 5.85 -0.76 -0.48 115.31 123.70 3d1d h LEU 537 Ca 0.34 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3d1d h LEU 537 Cb -0.06 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.79 3d1d h LEU 537 CO -0.06 1.05 -0.19 0.11 -0.34 0.00 0.00 178.44 179.01 3d1d h LYS 538 N 0.45 -0.50 -0.55 1.25 1.79 -0.21 -0.06 116.57 118.73 3d1d h LYS 538 Ca 0.01 0.03 0.10 0.00 -2.18 0.00 0.00 60.65 58.61 3d1d h LYS 538 Cb 1.08 0.11 -0.08 0.00 -1.58 0.00 0.00 32.23 31.77 3d1d h LYS 538 CO 0.10 -0.26 0.13 1.49 -1.08 0.00 0.00 179.45 179.83 3d1d h GLU 539 N -0.65 0.27 -0.26 3.15 4.81 -1.28 0.23 114.58 120.85 3d1d h GLU 539 Ca -0.05 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 3d1d h GLU 539 Cb 0.47 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 3d1d h GLU 539 CO 0.09 0.18 -0.09 0.00 -0.73 0.00 0.00 179.01 178.45 3d1d h ALA 540 N 1.42 1.36 -0.18 2.92 0.00 -0.98 -2.03 119.26 121.77 3d1d h ALA 540 Ca 0.28 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3d1d h ALA 540 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3d1d h ALA 540 CO -0.35 0.44 -0.28 1.03 0.00 0.00 0.00 179.25 180.09 3d1d h SER 541 N 0.40 0.35 0.57 0.00 0.87 0.94 -2.95 113.55 113.73 3d1d h SER 541 Ca 0.08 -0.12 -0.23 0.00 -1.23 0.00 0.00 61.79 60.29 3d1d h SER 541 Cb 0.41 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 3d1d h SER 541 CO 0.02 0.63 -1.03 0.40 -0.53 0.00 0.00 176.83 176.32 3d1d h ILE 542 N 0.31 1.49 -0.66 2.23 2.04 -0.73 -3.29 117.51 118.90 3d1d h ILE 542 Ca 0.05 -2.79 -0.03 0.00 1.00 0.00 0.00 64.86 63.09 3d1d h ILE 542 Cb 0.66 2.65 -0.03 0.00 -0.74 0.00 0.00 36.82 39.36 3d1d h ILE 542 CO 0.05 0.82 0.31 -0.07 0.00 0.00 0.00 178.15 179.26 3d1d h LEU 543 N 0.12 0.87 0.00 1.44 3.38 -1.21 -3.51 115.31 116.39 3d1d h LEU 543 Ca -0.08 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3d1d h LEU 543 Cb 1.70 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.23 3d1d h LEU 543 CO 0.17 0.76 0.00 1.21 0.09 0.00 0.00 178.44 180.67