#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1d n ASP 437 N 0.00 0.89 0.10 0.53 2.03 -1.26 -3.54 116.55 115.30 3d1d n ASP 437 Ca 0.00 -0.37 -0.12 0.00 0.52 0.00 0.00 54.79 54.82 3d1d n ASP 437 Cb 0.00 1.48 -0.08 0.00 -0.72 0.00 0.00 41.12 41.80 3d1d n ASP 437 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3d1d h LEU 438 N 0.00 -0.24 -0.39 -2.67 6.46 -2.05 -3.01 115.31 113.41 3d1d h LEU 438 Ca 0.00 -0.27 -0.07 0.00 -0.12 0.00 0.00 57.88 57.43 3d1d h LEU 438 Cb 0.64 0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.62 3d1d h LEU 438 CO 0.00 0.19 -0.01 1.88 -0.62 0.00 0.00 178.44 179.87 3d1d h TYR 439 N -0.72 0.76 -0.67 1.25 0.05 -2.00 -1.86 116.97 113.79 3d1d h TYR 439 Ca -0.03 -0.14 0.19 0.00 0.05 0.00 0.00 58.73 58.81 3d1d h TYR 439 Cb 0.49 -0.20 -0.03 0.00 1.01 0.00 0.00 36.73 38.01 3d1d h TYR 439 CO 0.05 0.79 0.49 0.82 -1.05 0.00 0.00 178.16 179.26 3d1d h ILE 440 N 0.51 0.63 0.00 -2.88 2.04 -1.63 -1.07 117.51 115.11 3d1d h ILE 440 Ca 0.11 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.83 3d1d h ILE 440 Cb 0.49 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3d1d h ILE 440 CO 0.02 0.00 -0.78 0.78 0.00 0.00 0.00 178.15 178.17 3d1d h ASN 441 N 0.00 0.00 -1.01 1.72 2.35 -1.34 -3.18 115.58 114.12 3d1d h ASN 441 Ca 0.32 -0.63 0.23 0.00 -0.55 0.00 0.00 56.30 55.66 3d1d h ASN 441 Cb 1.30 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 39.56 3d1d h ASN 441 CO -0.00 1.27 0.61 -0.50 -1.65 0.00 0.00 177.43 177.16 3d1d h TRP 442 N -1.00 0.98 -0.40 1.19 6.55 -0.94 0.42 115.95 122.75 3d1d h TRP 442 Ca -0.21 0.03 0.01 0.00 0.95 0.00 0.00 58.89 59.67 3d1d h TRP 442 Cb 1.13 -0.29 -0.02 0.00 -0.86 0.00 0.00 29.16 29.12 3d1d h TRP 442 CO 0.14 0.13 0.26 1.25 -1.05 0.00 0.00 178.44 179.17 3d1d h LEU 443 N 0.62 0.44 0.00 -4.49 5.85 -1.34 -0.44 115.31 115.95 3d1d h LEU 443 Ca 0.61 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.32 3d1d h LEU 443 Cb 1.14 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.06 3d1d h LEU 443 CO -0.41 0.32 0.00 0.29 -0.34 0.00 0.00 178.44 178.30 3d1d n LYS 444 N -4.82 0.11 -0.06 1.25 5.02 0.14 -2.14 118.16 117.67 3d1d n LYS 444 Ca 0.01 0.22 -0.09 0.00 -2.02 0.00 0.00 58.31 56.42 3d1d n LYS 444 Cb 0.03 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.39 3d1d n LYS 444 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3d1d n SER 445 N -1.32 0.47 -4.66 4.39 7.64 -0.21 -4.67 113.62 115.26 3d1d n SER 445 Ca 0.04 0.22 -0.48 0.00 1.01 0.00 0.00 58.87 59.66 3d1d n SER 445 Cb 0.08 0.44 -0.05 0.00 -1.01 0.00 0.00 64.21 63.67 3d1d n SER 445 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3d1d n LEU 446 N -2.91 2.88 -0.28 -3.43 4.77 -0.91 -4.83 117.00 112.30 3d1d n LEU 446 Ca -0.25 1.06 0.03 0.00 -0.03 0.00 0.00 56.01 56.83 3d1d n LEU 446 Cb 1.10 -1.36 0.17 0.00 -2.33 0.00 0.00 43.42 41.01 3d1d n LEU 446 CO 0.44 -0.37 1.11 0.77 -1.33 0.00 0.00 177.39 178.01 3d1d h SER 447 N 6.52 0.59 -0.85 -1.43 4.64 -1.91 -0.67 113.55 120.46 3d1d h SER 447 Ca -0.46 0.06 0.08 0.00 -0.47 0.00 0.00 61.79 61.00 3d1d h SER 447 Cb 1.28 -0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 63.26 3d1d h SER 447 CO 0.89 0.33 0.55 0.15 -0.87 0.00 0.00 176.83 177.87 3d1d h PHE 448 N 0.71 0.91 -0.34 4.77 3.57 -1.94 -1.86 116.94 122.76 3d1d h PHE 448 Ca 0.40 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.84 3d1d h PHE 448 Cb 0.41 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3d1d h PHE 448 CO -0.08 0.45 -0.08 0.35 -2.23 0.00 0.00 178.31 176.72 3d1d h PHE 449 N 0.87 0.75 -0.42 0.41 3.57 -1.40 -3.13 116.94 117.60 3d1d h PHE 449 Ca 0.38 -0.16 -0.12 0.00 3.53 0.00 0.00 57.97 61.59 3d1d h PHE 449 Cb 0.33 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 3d1d h PHE 449 CO -0.00 0.83 -0.24 1.96 -2.23 0.00 0.00 178.31 178.63 3d1d h GLN 450 N 0.45 0.85 -0.00 1.11 4.20 -1.05 -3.05 115.11 117.61 3d1d h GLN 450 Ca 0.09 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.44 3d1d h GLN 450 Cb 0.59 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3d1d h GLN 450 CO 0.03 1.00 -0.00 0.25 -0.67 0.00 0.00 178.83 179.44 3d1d n THR 451 N -4.10 0.00 -3.82 -0.54 -2.24 -0.75 -4.59 114.28 98.24 3d1d n THR 451 Ca -0.00 -0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.42 3d1d n THR 451 Cb 0.45 -0.49 -0.12 0.00 -2.10 0.00 0.00 70.33 68.07 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 -2.19 5.17 0.14 3.42 -0.87 -1.15 -4.93 114.94 114.52 3d1d s ASN 452 Ca 0.42 -1.99 -0.27 0.00 -1.57 0.00 0.00 52.86 49.45 3d1d s ASN 452 Cb 0.21 -1.80 -0.02 0.00 -0.02 0.00 0.00 41.25 39.63 3d1d s ASN 452 CO 0.40 -0.50 1.59 -1.28 -2.57 0.00 0.00 177.10 174.73 3d1d h SER 453 N 7.99 -1.28 -0.84 -1.22 0.87 -1.83 -1.31 113.55 115.94 3d1d h SER 453 Ca -0.12 0.18 0.24 0.00 -1.23 0.00 0.00 61.79 60.86 3d1d h SER 453 Cb 1.05 0.54 -0.03 0.00 -0.44 0.00 0.00 62.40 63.51 3d1d h SER 453 CO 0.66 -0.39 0.77 0.77 -0.53 0.00 0.00 176.83 178.11 3d1d h SER 454 N -0.41 0.00 0.23 6.23 4.64 -1.94 -0.38 113.55 121.93 3d1d h SER 454 Ca 0.11 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.23 3d1d h SER 454 Cb 0.59 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3d1d h SER 454 CO -0.46 0.00 -0.80 0.00 -0.87 0.00 0.00 176.83 174.71 3d1d h ALA 456 N 0.84 0.48 -0.53 0.00 0.00 -1.10 -1.69 119.26 117.26 3d1d h ALA 456 Ca -0.05 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.24 3d1d h ALA 456 Cb 1.39 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 3d1d h ALA 456 CO 0.14 0.71 0.15 0.93 0.00 0.00 0.00 179.25 181.17 3d1d h GLU 457 N 0.46 0.84 0.45 0.00 5.08 -1.53 -2.83 114.58 117.05 3d1d h GLU 457 Ca -0.03 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 3d1d h GLU 457 Cb 1.29 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 3d1d h GLU 457 CO 0.14 0.79 -0.30 0.00 -1.00 0.00 0.00 179.01 178.64 3d1d h ALA 458 N 1.02 -1.10 -0.29 3.43 0.00 -1.29 -2.61 119.26 118.41 3d1d h ALA 458 Ca 0.17 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.02 3d1d h ALA 458 Cb 0.31 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3d1d h ALA 458 CO -0.00 -1.08 0.80 1.25 0.00 0.00 0.00 179.25 180.22 3d1d h LEU 459 N -0.70 0.00 0.14 0.00 5.85 -1.25 0.36 115.31 119.70 3d1d h LEU 459 Ca -0.06 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.36 3d1d h LEU 459 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.60 3d1d h LEU 459 CO 0.04 0.00 -1.42 0.58 -0.34 0.00 0.00 178.44 177.31 3d1d h VAL 460 N 0.00 1.30 0.00 1.05 2.07 -1.21 -1.99 116.25 117.47 3d1d h VAL 460 Ca 0.14 -2.89 -0.05 0.00 0.82 0.00 0.00 66.70 64.72 3d1d h VAL 460 Cb 1.74 2.86 -0.01 0.00 -1.52 0.00 0.00 31.29 34.36 3d1d h VAL 460 CO -0.00 0.85 -0.50 0.11 0.02 0.00 0.00 177.57 178.05 3d1d h LYS 461 N 0.08 0.00 0.00 1.57 1.57 -0.23 -3.38 116.57 116.17 3d1d h LYS 461 Ca -0.20 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.39 3d1d h LYS 461 Cb 2.01 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 34.30 3d1d h LYS 461 CO 0.19 0.18 -1.01 0.28 -0.57 0.00 0.00 179.45 178.51 3d1d h VAL 462 N 0.00 1.09 -1.28 0.50 2.07 -1.27 -3.40 116.25 113.97 3d1d h VAL 462 Ca -0.02 -2.21 0.37 0.00 0.82 0.00 0.00 66.70 65.66 3d1d h VAL 462 Cb 1.18 2.46 -0.06 0.00 -1.52 0.00 0.00 31.29 33.34 3d1d h VAL 462 CO 0.02 0.37 0.91 -0.29 0.02 0.00 0.00 177.57 178.61 3d1d h ILE 463 N -0.99 0.35 -0.64 4.57 2.10 -1.53 0.74 117.51 122.11 3d1d h ILE 463 Ca -0.28 -0.02 -0.09 0.00 1.08 0.00 0.00 64.86 65.56 3d1d h ILE 463 Cb 1.25 0.30 -0.02 0.00 -1.09 0.00 0.00 36.82 37.26 3d1d h ILE 463 CO -0.17 0.01 0.06 -0.65 -1.08 0.00 0.00 178.15 176.32 3d1d h PRO 464 N 0.04 1.08 0.00 2.19 0.11 -1.76 -0.76 132.00 132.90 3d1d h PRO 464 Ca 0.63 -0.31 -0.01 0.00 0.11 0.00 0.00 66.00 66.43 3d1d h PRO 464 Cb 2.41 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 33.40 3d1d h PRO 464 CO -0.06 1.01 -0.03 0.45 -0.21 0.00 0.00 178.00 179.17 3d1d h HIS 465 N 1.00 0.00 0.18 0.65 3.86 -1.09 -0.27 115.15 119.48 3d1d h HIS 465 Ca 0.19 0.00 -0.31 0.00 -1.16 0.00 0.00 60.37 59.09 3d1d h HIS 465 Cb 0.49 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.99 3d1d h HIS 465 CO 0.03 0.03 -1.32 -0.92 0.86 0.00 0.00 177.93 176.61 3d1d h TYR 466 N 0.00 0.98 -0.00 2.45 3.20 -1.04 -0.71 116.97 121.84 3d1d h TYR 466 Ca -0.00 -0.66 -0.24 0.00 3.14 0.00 0.00 58.73 60.97 3d1d h TYR 466 Cb 0.43 -0.06 0.01 0.00 1.54 0.00 0.00 36.73 38.65 3d1d h TYR 466 CO 0.00 1.50 -0.97 0.45 -1.64 0.00 0.00 178.16 177.51 3d1d h HIS 467 N 0.17 0.75 0.00 -3.82 3.86 -0.65 -3.10 115.15 112.37 3d1d h HIS 467 Ca -0.22 -0.41 0.00 0.00 -1.16 0.00 0.00 60.37 58.59 3d1d h HIS 467 Cb 2.01 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 30.39 3d1d h HIS 467 CO 0.13 1.23 0.00 0.09 0.86 0.00 0.00 177.93 180.24 3d1d n ASN 468 N -3.78 0.00 -3.38 2.45 3.02 -0.16 -4.85 115.26 108.56 3d1d n ASN 468 Ca -0.08 -0.92 -0.20 0.00 -0.03 0.00 0.00 54.58 53.36 3d1d n ASN 468 Cb 0.85 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 40.10 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 -0.68 -7.01 -0.09 3.52 4.76 -1.17 -4.93 118.16 112.56 3d1d n LYS 469 Ca 0.05 0.79 -0.10 0.00 -2.87 0.00 0.00 58.31 56.18 3d1d n LYS 469 Cb 0.02 -5.70 -0.11 0.00 -1.84 0.00 0.00 35.03 27.40 3d1d n LYS 469 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3d1d n LEU 470 N -4.42 1.15 -4.26 -0.35 4.77 -0.30 -5.02 117.00 108.57 3d1d n LEU 470 Ca -0.12 -0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.68 3d1d n LEU 470 Cb 0.60 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.56 3d1d n LEU 470 CO 0.60 0.56 -0.41 0.27 -1.33 0.00 0.00 177.39 177.08 3d1d s ILE 471 N -2.39 1.20 0.46 -0.08 -4.36 -1.04 -5.03 121.20 109.96 3d1d s ILE 471 Ca -0.15 -2.07 0.08 0.00 -0.26 0.00 0.00 60.65 58.24 3d1d s ILE 471 Cb 0.06 -1.88 0.08 0.00 1.25 0.00 0.00 42.46 41.96 3d1d s ILE 471 CO 0.57 -0.72 0.63 -0.90 0.24 0.00 0.00 174.94 174.76 3d1d n ASP 472 N -0.22 1.71 0.20 4.36 5.68 -1.26 -4.54 116.55 122.48 3d1d n ASP 472 Ca -0.10 -2.24 0.06 0.00 -0.50 0.00 0.00 54.79 52.01 3d1d n ASP 472 Cb 0.61 -0.33 0.40 0.00 -1.14 0.00 0.00 41.12 40.66 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 0.10 0.00 -0.49 2.11 3.57 -1.99 -2.49 116.94 117.76 3d1d h PHE 473 Ca -0.22 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.26 3d1d h PHE 473 Cb 1.00 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 3d1d h PHE 473 CO 0.00 0.34 0.22 0.77 -2.23 0.00 0.00 178.31 177.41 3d1d h SER 474 N 0.00 0.65 -0.12 0.41 0.02 -1.97 -1.27 113.55 111.26 3d1d h SER 474 Ca -0.00 -0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 60.72 3d1d h SER 474 Cb 0.78 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 3d1d h SER 474 CO 0.04 0.61 -0.17 1.56 -1.14 0.00 0.00 176.83 177.73 3d1d h GLN 475 N 0.64 0.52 -0.58 3.45 4.20 -1.91 -1.08 115.11 120.35 3d1d h GLN 475 Ca 0.17 -0.17 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 3d1d h GLN 475 Cb 0.14 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3d1d h GLN 475 CO -0.02 0.67 0.11 0.28 -0.67 0.00 0.00 178.83 179.21 3d1d h VAL 476 N 0.47 1.25 -0.46 -0.54 2.07 -1.05 -1.03 116.25 116.97 3d1d h VAL 476 Ca 0.08 -0.95 -0.13 0.00 0.82 0.00 0.00 66.70 66.52 3d1d h VAL 476 Cb 0.57 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3d1d h VAL 476 CO 0.04 0.35 -0.23 -0.07 0.02 0.00 0.00 177.57 177.68 3d1d h LEU 477 N 0.85 0.97 -0.26 2.57 3.38 -0.81 0.27 115.31 122.28 3d1d h LEU 477 Ca 0.18 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 3d1d h LEU 477 Cb 0.39 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3d1d h LEU 477 CO 0.01 1.15 -0.07 -0.61 0.09 0.00 0.00 178.44 179.01 3d1d h GLN 478 N 0.81 0.51 -0.37 1.13 4.15 -1.08 -1.02 115.11 119.24 3d1d h GLN 478 Ca 0.10 -0.20 -0.06 0.00 0.77 0.00 0.00 58.65 59.27 3d1d h GLN 478 Cb 0.79 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.43 3d1d h GLN 478 CO 0.07 0.72 -0.00 -0.07 -1.93 0.00 0.00 178.83 177.62 3d1d h LEU 479 N 0.25 0.55 0.18 -2.39 3.38 -1.14 -1.35 115.31 114.80 3d1d h LEU 479 Ca 0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3d1d h LEU 479 Cb 0.54 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3d1d h LEU 479 CO 0.03 0.62 -0.09 0.58 0.09 0.00 0.00 178.44 179.67 3d1d h VAL 480 N 0.56 0.89 0.00 1.22 2.07 -0.75 -3.21 116.25 117.03 3d1d h VAL 480 Ca 0.12 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 3d1d h VAL 480 Cb 0.36 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 3d1d h VAL 480 CO 0.01 0.20 -0.04 -0.26 0.02 0.00 0.00 177.57 177.50 3d1d h PHE 481 N -0.75 0.00 0.00 1.57 0.04 -1.10 -2.24 116.94 114.46 3d1d h PHE 481 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 3d1d h PHE 481 Cb 0.51 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3d1d h PHE 481 CO 0.06 0.04 0.00 0.66 -0.60 0.00 0.00 178.31 178.47 3d1d h SER 482 N 0.00 0.00 0.54 2.17 4.64 -1.24 -1.86 113.55 117.80 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 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3d1d h SER 482 CO 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 176.83 175.77 3d1d n ALA 483 N -2.06 2.88 -0.72 5.18 0.00 -0.84 -4.93 120.51 120.02 3d1d n ALA 483 Ca 0.01 -0.26 -0.33 0.00 0.00 0.00 0.00 53.44 52.86 3d1d n ALA 483 Cb 0.29 -1.30 0.15 0.00 0.00 0.00 0.00 19.45 18.60 3d1d n ALA 483 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3d1d n SER 484 N -1.20 -2.32 0.00 0.00 7.64 -0.70 -4.65 113.62 112.38 3d1d n SER 484 Ca 0.10 0.03 0.00 0.00 1.01 0.00 0.00 58.87 60.01 3d1d n SER 484 Cb 0.31 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 3d1d n SER 484 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3d1d n GLU 485 N -1.87 0.00 -2.57 1.43 1.02 -1.26 -5.07 120.64 112.33 3d1d n GLU 485 Ca 0.03 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.75 3d1d n GLU 485 Cb 0.60 -0.02 -0.03 0.00 -0.02 0.00 0.00 31.44 31.96 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 -1.76 3.28 -0.25 3.49 1.02 -1.26 -4.95 119.74 119.30 3d1d s LYS 486 Ca 0.00 -0.12 -0.27 0.00 0.02 0.00 0.00 55.97 55.59 3d1d s LYS 486 Cb 0.00 -4.14 0.15 0.00 -0.52 0.00 0.00 37.83 33.33 3d1d s LYS 486 CO 0.00 -2.01 1.19 -0.59 -0.92 0.00 0.00 175.35 173.02 3d1d s PHE 487 N 5.47 -0.25 0.36 3.18 -0.12 -1.26 -4.95 117.98 120.41 3d1d s PHE 487 Ca 0.37 0.54 -0.28 0.00 -0.05 0.00 0.00 56.93 57.50 3d1d s PHE 487 Cb -0.08 0.44 -0.11 0.00 -0.63 0.00 0.00 43.02 42.65 3d1d s PHE 487 CO 0.18 -0.17 1.41 -1.25 -0.05 0.00 0.00 175.22 175.33 3d1d s PRO 488 N -0.47 4.20 0.27 1.99 0.04 -1.26 -4.93 135.00 134.82 3d1d s PRO 488 Ca 0.04 2.41 0.08 0.00 0.04 0.00 0.00 61.00 63.57 3d1d s PRO 488 Cb -0.03 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.48 3d1d s PRO 488 CO -0.06 -0.40 0.15 0.42 0.04 0.00 0.00 177.00 177.15 3d1d s ILE 489 N -1.14 4.07 -0.29 0.56 1.01 -1.26 -1.24 121.20 122.91 3d1d s ILE 489 Ca 0.51 -1.54 -0.00 0.00 0.00 0.00 0.00 60.65 59.63 3d1d s ILE 489 Cb -0.43 -3.23 0.19 0.00 0.01 0.00 0.00 42.46 39.00 3d1d s ILE 489 CO 0.58 -0.33 0.75 -1.58 0.00 0.00 0.00 174.94 174.36 3d1d s GLN 490 N -3.82 0.42 0.40 2.79 2.00 0.02 -4.66 119.66 116.81 3d1d s GLN 490 Ca 0.33 0.43 -0.24 0.00 -2.00 0.00 0.00 55.36 53.88 3d1d s GLN 490 Cb -0.07 0.20 -0.09 0.00 0.80 0.00 0.00 33.01 33.85 3d1d s GLN 490 CO 0.24 -0.76 1.08 -2.00 -0.50 0.00 0.00 175.29 173.35 3d1d s GLU 491 N 2.88 4.14 -0.17 1.67 2.12 -1.26 -4.51 118.70 123.56 3d1d s GLU 491 Ca 0.16 1.61 -0.03 0.00 0.36 0.00 0.00 54.97 57.07 3d1d s GLU 491 Cb -0.08 -2.60 0.01 0.00 0.26 0.00 0.00 34.13 31.72 3d1d s GLU 491 CO -0.24 -0.19 0.07 0.09 -0.54 0.00 0.00 175.26 174.45 3d1d n ASN 492 N 0.01 -7.12 -4.50 -1.70 4.13 -1.26 -5.00 115.26 99.81 3d1d n ASN 492 Ca 0.05 0.76 -0.34 0.00 1.68 0.00 0.00 54.58 56.73 3d1d n ASN 492 Cb 0.49 -3.19 -0.12 0.00 -1.54 0.00 0.00 39.78 35.42 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 -1.42 3.70 0.29 3.52 -0.21 -1.26 -5.07 119.66 119.21 3d1d s GLN 493 Ca 0.04 -0.49 -0.26 0.00 0.02 0.00 0.00 55.36 54.67 3d1d s GLN 493 Cb -0.01 -3.03 -0.15 0.00 1.00 0.00 0.00 33.01 30.83 3d1d s GLN 493 CO 0.39 0.16 0.65 -2.30 -2.12 0.00 0.00 175.29 172.07 3d1d n PRO 494 N 3.80 0.55 -0.09 2.91 -0.02 -1.26 -4.80 135.00 136.08 3d1d n PRO 494 Ca -0.17 0.20 -0.01 0.00 -2.02 0.00 0.00 63.50 61.49 3d1d n PRO 494 Cb 0.52 -1.38 0.25 0.00 -0.02 0.00 0.00 33.50 32.87 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 1.22 0.68 -0.31 2.45 5.85 -1.99 -2.38 115.31 120.83 3d1d h LEU 495 Ca -0.35 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.31 3d1d h LEU 495 Cb 1.40 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.22 3d1d h LEU 495 CO 0.56 0.66 0.10 -0.65 -0.34 0.00 0.00 178.44 178.76 3d1d h PRO 496 N 0.73 0.22 -0.37 5.25 0.11 -1.99 0.17 132.00 136.12 3d1d h PRO 496 Ca 0.17 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.31 3d1d h PRO 496 Cb 0.22 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.24 3d1d h PRO 496 CO -0.01 0.15 0.11 0.93 -0.21 0.00 0.00 178.00 178.97 3d1d h GLU 497 N 0.23 0.24 -0.10 1.05 3.07 -1.85 -1.21 114.58 116.01 3d1d h GLU 497 Ca 0.14 -0.01 0.04 0.00 -0.50 0.00 0.00 59.36 59.03 3d1d h GLU 497 Cb 0.12 -0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 27.93 3d1d h GLU 497 CO -0.16 0.16 -0.19 1.96 -1.40 0.00 0.00 179.01 179.38 3d1d h GLN 498 N 0.25 -0.25 -0.79 2.33 1.08 -0.82 -2.72 115.11 114.19 3d1d h GLN 498 Ca 0.17 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.39 3d1d h GLN 498 Cb 0.17 0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.61 3d1d h GLN 498 CO -0.19 -0.16 0.51 -0.07 -0.95 0.00 0.00 178.83 177.96 3d1d h LEU 499 N -0.26 0.93 -0.19 1.46 3.38 -0.19 -2.01 115.31 118.43 3d1d h LEU 499 Ca 0.09 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3d1d h LEU 499 Cb 0.38 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3d1d h LEU 499 CO -0.25 0.69 0.13 -0.03 0.09 0.00 0.00 178.44 179.06 3d1d h MET 500 N 1.08 0.25 0.18 1.13 4.05 -0.96 -1.30 114.93 119.37 3d1d h MET 500 Ca 0.29 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 3d1d h MET 500 Cb -0.10 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.63 3d1d h MET 500 CO -0.06 0.18 -0.16 0.35 0.23 0.00 0.00 176.91 177.45 3d1d h PHE 501 N 0.26 -0.42 -0.28 1.39 3.04 -1.18 -0.53 116.94 119.22 3d1d h PHE 501 Ca 0.07 0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.03 3d1d h PHE 501 Cb -0.02 0.16 -0.01 0.00 2.56 0.00 0.00 35.95 38.63 3d1d h PHE 501 CO -0.06 -0.24 0.19 -0.07 -2.02 0.00 0.00 178.31 176.10 3d1d h LEU 502 N -0.36 0.29 -0.11 0.59 3.38 -1.26 0.19 115.31 118.03 3d1d h LEU 502 Ca -0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3d1d h LEU 502 Cb 0.33 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3d1d h LEU 502 CO -0.03 0.21 -0.03 0.28 0.09 0.00 0.00 178.44 178.96 3d1d h SER 503 N 0.34 0.21 -0.24 -0.43 0.02 -0.72 -1.26 113.55 111.48 3d1d h SER 503 Ca 0.11 -0.37 0.01 0.00 -0.84 0.00 0.00 61.79 60.70 3d1d h SER 503 Cb 0.01 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3d1d h SER 503 CO -0.02 0.53 0.13 -1.13 -1.14 0.00 0.00 176.83 175.20 3d1d h ASN 504 N -0.11 0.21 -0.51 3.07 -0.73 -0.36 -2.24 115.58 114.91 3d1d h ASN 504 Ca 0.03 0.00 0.11 0.00 1.87 0.00 0.00 56.30 58.31 3d1d h ASN 504 Cb 0.44 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 38.96 3d1d h ASN 504 CO 0.01 0.16 0.35 0.25 -0.37 0.00 0.00 177.43 177.83 3d1d h LEU 505 N 0.28 0.18 -1.49 0.34 5.85 -0.54 -0.63 115.31 119.29 3d1d h LEU 505 Ca 0.09 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 3d1d h LEU 505 Cb 0.00 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 3d1d h LEU 505 CO -0.05 0.10 -0.10 -0.08 -0.34 0.00 0.00 178.44 177.97 3d1d h GLU 506 N 0.19 0.00 -0.48 1.25 4.22 -0.59 -2.71 114.58 116.46 3d1d h GLU 506 Ca 0.24 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.68 3d1d h GLU 506 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3d1d h GLU 506 CO -0.04 0.10 0.00 1.63 -2.18 0.00 0.00 179.01 178.52 3d1d n LYS 507 N -3.29 2.54 -1.61 1.92 5.02 -0.25 -4.99 118.16 117.49 3d1d n LYS 507 Ca -0.00 -2.35 -0.30 0.00 -2.02 0.00 0.00 58.31 53.64 3d1d n LYS 507 Cb 0.33 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 34.03 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 -1.28 0.13 0.11 1.97 -1.52 -1.02 -5.07 119.66 112.97 3d1d s GLN 508 Ca 0.40 -0.20 -0.02 0.00 -1.95 0.00 0.00 55.36 53.59 3d1d s GLN 508 Cb 0.22 -1.77 -0.05 0.00 -0.22 0.00 0.00 33.01 31.20 3d1d s GLN 508 CO 0.30 -2.79 0.29 0.95 -0.25 0.00 0.00 175.29 173.79 3d1d s THR 509 N -3.52 5.29 0.00 -0.19 -4.23 -1.26 -4.83 115.64 106.90 3d1d s THR 509 Ca 0.71 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.99 3d1d s THR 509 Cb -0.07 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.13 3d1d s THR 509 CO 0.54 0.07 0.00 -2.65 -0.54 0.00 0.00 174.62 172.04 3d1d n PRO 510 N 0.11 0.00 -0.25 3.99 -0.02 -1.26 -1.27 135.00 136.30 3d1d n PRO 510 Ca -0.04 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.49 3d1d n PRO 510 Cb 0.52 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 34.16 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 0.05 0.00 6.00 3.57 -1.96 -0.95 116.94 123.64 3d1d h PHE 511 Ca 0.00 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 3d1d h PHE 511 Cb 0.00 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3d1d h PHE 511 CO 0.00 -0.20 -0.34 0.00 -2.23 0.00 0.00 178.31 175.54 3d1d h ALA 512 N 1.68 1.21 -0.31 2.41 0.00 -1.46 -0.61 119.26 122.18 3d1d h ALA 512 Ca 0.41 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 3d1d h ALA 512 Cb 0.73 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3d1d h ALA 512 CO -0.62 0.42 -0.47 -0.22 0.00 0.00 0.00 179.25 178.36 3d1d h LYS 513 N 0.00 0.83 0.02 0.00 3.64 0.06 -0.15 116.57 120.97 3d1d h LYS 513 Ca -0.00 -0.48 -0.00 0.00 -1.27 0.00 0.00 60.65 58.89 3d1d h LYS 513 Cb 0.70 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3d1d h LYS 513 CO 0.04 1.12 -0.01 0.00 -2.27 0.00 0.00 179.45 178.33 3d1d h ALA 514 N 0.80 -0.03 -0.59 5.00 0.00 -1.20 -0.29 119.26 122.95 3d1d h ALA 514 Ca 0.03 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.83 3d1d h ALA 514 Cb 1.06 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.79 3d1d h ALA 514 CO 0.11 -0.31 0.23 0.28 0.00 0.00 0.00 179.25 179.55 3d1d h VAL 515 N -0.44 0.80 0.60 0.00 2.07 -1.10 0.00 116.25 118.19 3d1d h VAL 515 Ca -0.00 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 3d1d h VAL 515 Cb 0.41 0.35 0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3d1d h VAL 515 CO 0.01 0.08 -0.29 1.23 0.02 0.00 0.00 177.57 178.61 3d1d h GLY 516 N 0.42 -0.84 0.52 2.17 0.00 -0.91 -1.92 103.07 102.50 3d1d h GLY 516 Ca 0.29 0.31 0.09 0.00 0.00 0.00 0.00 47.33 48.02 3d1d h GLY 516 CO -0.28 -0.31 0.40 0.23 0.00 0.00 0.00 176.54 176.59 3d1d h SER 517 N -0.81 0.56 -0.27 0.19 0.87 -0.77 0.11 113.55 113.43 3d1d h SER 517 Ca -0.08 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.50 3d1d h SER 517 Cb 0.62 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 3d1d h SER 517 CO 0.14 0.32 0.09 0.28 -0.53 0.00 0.00 176.83 177.13 3d1d h SER 518 N 0.69 0.44 1.06 6.23 0.02 -0.91 -2.26 113.55 118.82 3d1d h SER 518 Ca 0.36 -0.05 -0.15 0.00 -0.84 0.00 0.00 61.79 61.11 3d1d h SER 518 Cb 0.34 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 3d1d h SER 518 CO -0.25 0.45 -0.72 0.40 -1.14 0.00 0.00 176.83 175.57 3d1d h ILE 519 N 0.48 1.33 -0.16 3.27 1.08 -0.30 -3.17 117.51 120.05 3d1d h ILE 519 Ca 0.12 -2.64 -0.05 0.00 -0.39 0.00 0.00 64.86 61.89 3d1d h ILE 519 Cb 0.18 2.50 -0.01 0.00 -3.07 0.00 0.00 36.82 36.42 3d1d h ILE 519 CO -0.01 0.71 -0.12 0.22 -0.69 0.00 0.00 178.15 178.26 3d1d h TYR 520 N 0.00 0.26 -0.49 1.37 3.20 -0.23 -1.57 116.97 119.51 3d1d h TYR 520 Ca -0.01 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.90 3d1d h TYR 520 Cb 1.44 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 39.59 3d1d h TYR 520 CO 0.00 0.37 0.19 0.87 -1.64 0.00 0.00 178.16 177.95 3d1d h LYS 521 N 0.24 0.37 -0.03 1.82 1.79 -1.49 0.26 116.57 119.52 3d1d h LYS 521 Ca 0.05 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.44 3d1d h LYS 521 Cb 0.36 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 3d1d h LYS 521 CO 0.02 0.24 -0.25 -0.07 -1.08 0.00 0.00 179.45 178.31 3d1d h LEU 522 N 0.38 0.05 0.31 2.94 3.38 -1.43 0.55 115.31 121.49 3d1d h LEU 522 Ca 0.23 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 3d1d h LEU 522 Cb 0.22 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3d1d h LEU 522 CO -0.22 0.30 -0.15 0.58 0.09 0.00 0.00 178.44 179.04 3d1d h VAL 523 N 0.05 0.00 -0.11 1.22 2.07 -0.23 -0.05 116.25 119.20 3d1d h VAL 523 Ca 0.01 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 3d1d h VAL 523 Cb 0.47 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3d1d h VAL 523 CO 0.03 0.00 -0.22 0.71 0.02 0.00 0.00 177.57 178.11 3d1d h THR 524 N -0.58 1.21 0.04 2.57 1.35 -1.01 -1.10 112.91 115.39 3d1d h THR 524 Ca -0.04 -0.99 -0.16 0.00 -0.55 0.00 0.00 66.41 64.66 3d1d h THR 524 Cb 0.32 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 68.11 3d1d h THR 524 CO 0.07 0.30 -0.85 1.23 -0.25 0.00 0.00 175.52 176.02 3d1d h GLY 525 N 0.88 0.11 -1.04 5.82 0.00 0.03 -3.40 103.07 105.46 3d1d h GLY 525 Ca 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3d1d h GLY 525 CO 0.03 0.24 0.00 0.28 0.00 0.00 0.00 176.54 177.09 3d1d n LYS 526 N -4.33 2.89 -1.86 4.80 5.02 -0.11 -4.99 118.16 119.58 3d1d n LYS 526 Ca -0.21 -1.99 -0.12 0.00 -2.02 0.00 0.00 58.31 53.97 3d1d n LYS 526 Cb 0.69 -1.25 -0.02 0.00 -0.02 0.00 0.00 35.03 34.42 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 0.26 -4.06 -4.71 4.39 5.03 -0.42 -4.87 115.26 110.88 3d1d n ASN 527 Ca 0.10 0.12 -0.43 0.00 0.87 0.00 0.00 54.58 55.23 3d1d n ASN 527 Cb 0.42 -3.00 -0.02 0.00 -1.02 0.00 0.00 39.78 36.16 3d1d n ASN 527 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 3d1d n LEU 528 N -1.55 3.79 -4.66 3.41 0.00 -0.71 -0.80 117.00 116.47 3d1d n LEU 528 Ca -0.13 1.13 -0.44 0.00 0.00 0.00 0.00 56.01 56.57 3d1d n LEU 528 Cb 0.52 -1.52 -0.01 0.00 0.00 0.00 0.00 43.42 42.40 3d1d n LEU 528 CO 0.17 -0.09 0.84 -0.24 0.00 0.00 0.00 177.39 178.07 3d1d n SER 529 N 2.52 2.36 0.28 1.96 2.88 -0.37 -4.42 113.62 118.83 3d1d n SER 529 Ca 0.11 1.18 0.18 0.00 -1.33 0.00 0.00 58.87 59.01 3d1d n SER 529 Cb 0.34 -1.41 0.74 0.00 -0.75 0.00 0.00 64.21 63.12 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 2.85 0.00 0.08 2.46 5.85 -1.91 -2.68 115.31 121.96 3d1d h LEU 530 Ca -0.44 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 57.98 3d1d h LEU 530 Cb 1.30 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.30 3d1d h LEU 530 CO 0.66 0.00 -1.61 0.44 -0.34 0.00 0.00 178.44 177.59 3d1d h ASP 531 N 0.00 0.26 0.64 1.25 3.32 -1.99 -2.90 116.42 116.99 3d1d h ASP 531 Ca 0.00 -0.42 -0.06 0.00 0.02 0.00 0.00 57.03 56.57 3d1d h ASP 531 Cb 0.46 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 3d1d h ASP 531 CO 0.00 1.36 -0.29 0.15 -1.72 0.00 0.00 179.24 178.73 3d1d h PHE 532 N 0.04 0.00 0.05 4.55 3.57 -1.89 -2.79 116.94 120.48 3d1d h PHE 532 Ca -0.26 0.00 -0.26 0.00 3.53 0.00 0.00 57.97 60.98 3d1d h PHE 532 Cb 2.00 0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.75 3d1d h PHE 532 CO 0.04 0.29 -1.08 0.00 -2.23 0.00 0.00 178.31 175.34 3d1d h ALA 533 N 1.71 0.21 0.00 2.41 0.00 -1.55 -3.06 119.26 118.98 3d1d h ALA 533 Ca -0.00 -0.76 -0.03 0.00 0.00 0.00 0.00 54.91 54.12 3d1d h ALA 533 Cb 0.69 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 3d1d h ALA 533 CO 0.04 0.81 -0.14 0.77 0.00 0.00 0.00 179.25 180.73 3d1d h SER 534 N 0.22 0.00 0.24 0.00 0.02 -1.28 0.12 113.55 112.87 3d1d h SER 534 Ca -0.12 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 3d1d h SER 534 Cb 1.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.29 3d1d h SER 534 CO 0.19 0.14 -0.12 1.56 -1.14 0.00 0.00 176.83 177.46 3d1d h GLN 535 N 0.00 -0.31 -0.69 3.45 4.20 -1.51 -1.87 115.11 118.38 3d1d h GLN 535 Ca -0.00 0.02 0.15 0.00 0.06 0.00 0.00 58.65 58.88 3d1d h GLN 535 Cb 0.35 0.07 -0.11 0.00 0.30 0.00 0.00 27.48 28.09 3d1d h GLN 535 CO 0.02 0.04 0.03 0.82 -0.67 0.00 0.00 178.83 179.07 3d1d h ILE 536 N -0.92 0.44 -0.22 2.54 1.08 -1.34 0.28 117.51 119.36 3d1d h ILE 536 Ca -0.03 -0.05 0.03 0.00 -0.39 0.00 0.00 64.86 64.42 3d1d h ILE 536 Cb 0.49 0.29 -0.03 0.00 -3.07 0.00 0.00 36.82 34.51 3d1d h ILE 536 CO 0.05 0.03 0.04 0.25 -0.69 0.00 0.00 178.15 177.83 3d1d h LEU 537 N 0.14 0.00 0.22 1.44 5.85 -0.77 -1.80 115.31 120.38 3d1d h LEU 537 Ca 0.37 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.12 3d1d h LEU 537 Cb 0.63 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3d1d h LEU 537 CO -0.57 0.03 -0.10 0.50 -0.34 0.00 0.00 178.44 177.96 3d1d h LYS 538 N 0.13 -0.28 -0.69 1.25 3.64 -0.20 -2.14 116.57 118.27 3d1d h LYS 538 Ca 0.10 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.64 3d1d h LYS 538 Cb 0.10 0.06 -0.13 0.00 -0.41 0.00 0.00 32.23 31.85 3d1d h LYS 538 CO -0.14 0.00 -0.20 1.49 -2.27 0.00 0.00 179.45 178.33 3d1d h GLU 539 N -0.56 -0.03 -1.00 1.90 4.81 -0.47 0.41 114.58 119.64 3d1d h GLU 539 Ca -0.03 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.28 3d1d h GLU 539 Cb 0.41 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.73 3d1d h GLU 539 CO 0.05 -0.02 0.65 0.00 -0.73 0.00 0.00 179.01 178.96 3d1d h ALA 540 N 1.59 1.42 0.00 2.92 0.00 -1.21 -1.72 119.26 122.26 3d1d h ALA 540 Ca 0.32 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 3d1d h ALA 540 Cb 0.52 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3d1d h ALA 540 CO -0.72 0.41 -0.14 1.03 0.00 0.00 0.00 179.25 179.84 3d1d h SER 541 N 1.15 0.00 0.05 0.00 0.87 0.47 -2.69 113.55 113.41 3d1d h SER 541 Ca 0.44 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 61.00 3d1d h SER 541 Cb 0.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 3d1d h SER 541 CO -0.18 0.14 -0.03 0.40 -0.53 0.00 0.00 176.83 176.63 3d1d h ILE 542 N 0.00 1.29 -0.65 2.23 2.04 -0.46 -3.18 117.51 118.77 3d1d h ILE 542 Ca -0.00 -1.50 0.15 0.00 1.00 0.00 0.00 64.86 64.51 3d1d h ILE 542 Cb 0.34 2.22 -0.04 0.00 -0.74 0.00 0.00 36.82 38.60 3d1d h ILE 542 CO 0.02 0.36 0.45 -0.07 0.00 0.00 0.00 178.15 178.90 3d1d h LEU 543 N -0.78 0.19 -1.73 1.44 3.38 -1.39 -3.52 115.31 112.89 3d1d h LEU 543 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d1d h LEU 543 Cb 0.64 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3d1d h LEU 543 CO 0.01 0.10 0.00 1.21 0.09 0.00 0.00 178.44 179.85