#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pms n LYS 432 N 0.00 1.69 -0.43 -1.46 4.01 -1.26 -4.39 118.16 116.33 1pms n LYS 432 Ca 0.00 -1.45 -0.05 0.00 -0.51 0.00 0.00 58.31 56.30 1pms n LYS 432 Cb 0.00 -1.57 0.11 0.00 -0.51 0.00 0.00 35.03 33.06 1pms n LYS 432 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1pms n GLN 433 N 0.14 1.91 -0.09 1.97 6.02 -1.26 -4.28 117.38 121.79 1pms n GLN 433 Ca 0.28 -1.20 0.10 0.00 -0.01 0.00 0.00 57.00 56.17 1pms n GLN 433 Cb 0.76 -1.60 0.47 0.00 1.02 0.00 0.00 30.24 30.89 1pms n GLN 433 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1pms h LEU 434 N 1.23 0.43 -0.44 1.08 3.38 -2.00 0.35 115.31 119.34 1pms h LEU 434 Ca 0.15 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 1pms h LEU 434 Cb 1.48 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 1pms h LEU 434 CO 0.34 0.27 -0.58 0.00 0.09 0.00 0.00 178.44 178.56 1pms h ALA 435 N 1.69 0.76 0.00 1.53 0.00 -1.98 -2.89 119.26 118.37 1pms h ALA 435 Ca 0.26 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1pms h ALA 435 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1pms h ALA 435 CO -0.08 0.73 -0.03 0.82 0.00 0.00 0.00 179.25 180.69 1pms h ILE 436 N 0.00 0.00 0.00 0.00 1.08 -0.76 -3.07 117.51 114.76 1pms h ILE 436 Ca -0.01 -0.76 -0.06 0.00 -0.39 0.00 0.00 64.86 63.65 1pms h ILE 436 Cb 1.26 1.74 -0.01 0.00 -3.07 0.00 0.00 36.82 36.74 1pms h ILE 436 CO 0.08 0.00 -0.27 0.11 -0.69 0.00 0.00 178.15 177.37 1pms h LYS 437 N 0.00 0.00 0.88 2.37 6.56 -0.49 -3.23 116.57 122.66 1pms h LYS 437 Ca 0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.55 1pms h LYS 437 Cb 0.88 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.55 1pms h LYS 437 CO 0.00 0.27 -0.42 -0.22 -2.06 0.00 0.00 179.45 177.02 1pms h LYS 438 N 0.00 -1.14 -1.29 3.15 3.64 -1.59 -2.40 116.57 116.93 1pms h LYS 438 Ca -0.00 0.08 0.40 0.00 -1.27 0.00 0.00 60.65 59.86 1pms h LYS 438 Cb 0.83 0.26 -0.08 0.00 -0.41 0.00 0.00 32.23 32.83 1pms h LYS 438 CO 0.04 -0.76 0.89 -0.12 -2.27 0.00 0.00 179.45 177.22 1pms n MET 439 N -5.27 -0.01 0.06 1.90 1.56 -1.22 0.92 117.12 115.06 1pms n MET 439 Ca -0.15 0.88 -0.10 0.00 -0.27 0.00 0.00 57.70 58.06 1pms n MET 439 Cb 0.47 -1.88 -0.07 0.00 2.15 0.00 0.00 33.22 33.89 1pms n MET 439 CO 0.00 0.00 0.00 -0.97 -0.73 0.00 0.00 175.97 174.27 1pms h ASN 440 N 0.00 -0.20 0.31 6.12 -0.73 -1.57 -1.78 115.58 117.73 1pms h ASN 440 Ca 0.69 -0.32 0.00 0.00 1.87 0.00 0.00 56.30 58.55 1pms h ASN 440 Cb 2.54 0.05 0.00 0.00 0.27 0.00 0.00 38.32 41.18 1pms h ASN 440 CO -0.17 0.35 0.00 -0.62 -0.37 0.00 0.00 177.43 176.62 1pms n GLU 441 N -4.93 0.06 -0.08 6.67 1.02 0.26 -0.63 120.64 123.02 1pms n GLU 441 Ca -0.07 0.26 -0.22 0.00 -0.02 0.00 0.00 57.16 57.11 1pms n GLU 441 Cb 0.25 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.05 1pms n GLU 441 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1pms n ILE 442 N -1.42 1.60 1.04 -3.67 5.41 0.60 -1.55 119.36 121.37 1pms n ILE 442 Ca 0.04 -0.19 0.13 0.00 1.00 0.00 0.00 62.75 63.73 1pms n ILE 442 Cb 0.11 -1.96 0.41 0.00 -0.71 0.00 0.00 39.64 37.49 1pms n ILE 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pms n GLN 443 N -4.20 0.07 -0.06 0.38 10.64 -0.68 -3.18 117.38 120.35 1pms n GLN 443 Ca -0.33 -0.03 -0.09 0.00 -1.83 0.00 0.00 57.00 54.72 1pms n GLN 443 Cb 0.78 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 28.60 1pms n GLN 443 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 1pms n LYS 444 N -1.44 0.31 0.00 2.61 3.00 0.20 -3.44 118.16 119.41 1pms n LYS 444 Ca 0.07 0.08 0.13 0.00 -0.00 0.00 0.00 58.31 58.59 1pms n LYS 444 Cb 0.33 -1.23 0.69 0.00 0.00 0.00 0.00 35.03 34.82 1pms n LYS 444 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1pms n ASN 445 N -2.93 0.00 -0.06 3.14 2.85 -0.60 -3.60 115.26 114.06 1pms n ASN 445 Ca -0.23 -0.22 -0.10 0.00 -0.11 0.00 0.00 54.58 53.92 1pms n ASN 445 Cb 0.73 -0.24 -0.05 0.00 1.24 0.00 0.00 39.78 41.46 1pms n ASN 445 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pms n ILE 446 N -1.24 0.69 0.00 -1.44 0.13 -1.19 -4.99 119.36 111.32 1pms n ILE 446 Ca 0.14 -0.23 0.00 0.00 -1.10 0.00 0.00 62.75 61.56 1pms n ILE 446 Cb 0.19 -1.21 0.00 0.00 -0.84 0.00 0.00 39.64 37.78 1pms n ILE 446 CO 0.00 0.00 0.00 -0.67 2.80 0.00 0.00 176.55 178.68 1pms n ASP 447 N -3.13 0.00 -0.77 9.51 2.03 -1.22 -3.14 116.55 119.83 1pms n ASP 447 Ca -0.23 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.04 1pms n ASP 447 Cb 0.71 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 41.07 1pms n ASP 447 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pms n GLY 448 N 0.00 0.56 1.21 0.27 0.00 -1.26 -4.81 105.19 101.16 1pms n GLY 448 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pms n GLY 448 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1pms n TRP 449 N 0.00 -0.06 -0.73 1.61 -0.00 -1.19 -4.10 117.44 112.97 1pms n TRP 449 Ca -0.16 0.04 0.00 0.00 -0.00 0.00 0.00 57.50 57.37 1pms n TRP 449 Cb 0.57 -1.83 0.00 0.00 -0.00 0.00 0.00 31.31 30.05 1pms n TRP 449 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 1pms n GLU 450 N 0.02 0.43 -1.18 5.87 1.02 -1.26 -4.81 120.64 120.74 1pms n GLU 450 Ca -0.00 -0.55 -0.00 0.00 -0.02 0.00 0.00 57.16 56.59 1pms n GLU 450 Cb 0.00 -0.63 -0.01 0.00 -0.02 0.00 0.00 31.44 30.78 1pms n GLU 450 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pms n GLY 451 N -0.09 0.79 7.00 0.62 0.00 -1.26 -5.14 105.19 107.12 1pms n GLY 451 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1pms n GLY 451 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pms n LYS 452 N 0.26 0.00 -1.36 1.61 5.02 -1.26 -4.80 118.16 117.63 1pms n LYS 452 Ca -0.06 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.87 1pms n LYS 452 Cb 0.92 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 36.00 1pms n LYS 452 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1pms n ASP 453 N -0.87 -0.45 -0.01 4.39 5.68 -1.26 -4.87 116.55 119.15 1pms n ASP 453 Ca 0.00 0.66 0.02 0.00 -0.50 0.00 0.00 54.79 54.97 1pms n ASP 453 Cb 0.00 -1.29 -0.05 0.00 -1.14 0.00 0.00 41.12 38.64 1pms n ASP 453 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1pms n ILE 454 N -2.25 0.10 -5.03 2.12 0.13 -1.26 -4.95 119.36 108.22 1pms n ILE 454 Ca 0.12 -0.18 -0.32 0.00 -1.10 0.00 0.00 62.75 61.26 1pms n ILE 454 Cb 0.49 0.07 -0.15 0.00 -0.84 0.00 0.00 39.64 39.21 1pms n ILE 454 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 1pms s GLY 455 N -3.01 1.42 0.09 4.50 0.00 0.12 -5.01 107.32 105.44 1pms s GLY 455 Ca -0.03 -0.98 -0.21 0.00 0.00 0.00 0.00 44.72 43.51 1pms s GLY 455 CO 0.27 -0.49 1.67 -1.61 0.00 0.00 0.00 173.10 172.94 1pms h GLN 456 N 6.19 0.19 0.00 2.90 4.15 -1.94 -3.39 115.11 123.21 1pms h GLN 456 Ca -0.31 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 58.96 1pms h GLN 456 Cb 1.19 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.83 1pms h GLN 456 CO 0.50 0.23 -1.39 0.00 -1.93 0.00 0.00 178.83 176.25 1pms n ASN 459 N 5.55 -1.42 -0.68 0.00 5.03 -1.26 -3.98 115.26 118.50 1pms n ASN 459 Ca -0.05 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.40 1pms n ASN 459 Cb 0.50 -0.71 0.00 0.00 -1.02 0.00 0.00 39.78 38.55 1pms n ASN 459 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1pms n GLU 460 N 0.77 0.00 0.00 3.52 0.28 -1.26 0.14 120.64 124.09 1pms n GLU 460 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1pms n GLU 460 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1pms n GLU 460 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1pms n PHE 461 N 0.00 0.00 0.00 -1.84 1.16 -1.26 -4.53 117.46 110.99 1pms n PHE 461 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 1pms n PHE 461 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 1pms n PHE 461 CO 0.00 0.00 0.00 -0.89 -1.87 0.00 0.00 176.76 174.00 1pms n ILE 462 N 0.00 0.00 -3.75 1.97 2.08 -1.26 -4.30 119.36 114.10 1pms n ILE 462 Ca 0.00 0.00 -0.26 0.00 0.56 0.00 0.00 62.75 63.05 1pms n ILE 462 Cb 0.00 0.00 -0.17 0.00 -0.75 0.00 0.00 39.64 38.72 1pms n ILE 462 CO 0.00 0.00 0.00 -0.04 0.56 0.00 0.00 176.55 177.07 1pms s MET 463 N 0.00 0.65 -0.29 0.38 -1.94 -1.17 -4.83 119.30 112.10 1pms s MET 463 Ca 0.00 -0.26 -0.04 0.00 -1.71 0.00 0.00 55.69 53.69 1pms s MET 463 Cb 0.00 -1.77 0.10 0.00 2.01 0.00 0.00 34.83 35.17 1pms s MET 463 CO 0.00 -0.54 0.13 -1.21 -0.01 0.00 0.00 175.02 173.40 1pms s GLU 464 N 1.89 0.25 0.00 2.03 8.01 -1.26 -1.10 118.70 128.52 1pms s GLU 464 Ca 0.01 -0.61 0.00 0.00 0.01 0.00 0.00 54.97 54.38 1pms s GLU 464 Cb -0.16 -1.24 0.00 0.00 -4.31 0.00 0.00 34.13 28.43 1pms s GLU 464 CO -0.07 -1.03 0.00 0.41 0.01 0.00 0.00 175.26 174.58 1pms n GLY 465 N 5.16 -0.39 2.90 -1.39 0.00 -1.18 -4.61 105.19 105.69 1pms n GLY 465 Ca -0.05 0.51 -0.14 0.00 0.00 0.00 0.00 46.02 46.34 1pms n GLY 465 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pms s THR 466 N 0.00 0.19 0.00 2.61 -4.23 -1.26 -2.52 115.64 110.43 1pms s THR 466 Ca 0.00 -0.08 -0.16 0.00 -1.18 0.00 0.00 61.69 60.27 1pms s THR 466 Cb 0.00 -0.18 0.03 0.00 1.34 0.00 0.00 72.50 73.69 1pms s THR 466 CO 0.00 0.06 0.35 -0.22 -0.54 0.00 0.00 174.62 174.27 1pms s LEU 467 N 0.06 0.70 0.42 4.79 1.98 -1.17 -4.55 118.68 120.91 1pms s LEU 467 Ca -0.00 0.06 0.08 0.00 -2.89 0.00 0.00 54.13 51.38 1pms s LEU 467 Cb -0.02 1.42 -0.02 0.00 0.66 0.00 0.00 46.19 48.23 1pms s LEU 467 CO -0.00 -0.52 0.37 0.28 -1.89 0.00 0.00 176.35 174.59 1pms s THR 468 N -1.69 2.59 -0.74 3.68 -1.32 -0.36 -2.63 115.64 115.16 1pms s THR 468 Ca -0.11 -1.37 -0.02 0.00 -1.21 0.00 0.00 61.69 58.98 1pms s THR 468 Cb -0.03 -2.96 0.35 0.00 -1.51 0.00 0.00 72.50 68.34 1pms s THR 468 CO 0.02 0.00 2.10 0.54 -2.21 0.00 0.00 174.62 175.07 1pms n ARG 469 N -1.54 2.67 -1.30 7.08 1.74 -1.26 -1.00 116.66 123.04 1pms n ARG 469 Ca 0.03 -3.28 0.15 0.00 -0.77 0.00 0.00 57.85 53.98 1pms n ARG 469 Cb 0.62 -2.24 -0.08 0.00 -1.02 0.00 0.00 32.46 29.74 1pms n ARG 469 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1pms n VAL 470 N -0.50 -0.74 -3.19 1.55 0.31 -1.21 -4.75 118.33 109.81 1pms n VAL 470 Ca 0.55 0.77 -0.10 0.00 -0.01 0.00 0.00 64.34 65.56 1pms n VAL 470 Cb 0.40 -1.18 0.01 0.00 -0.91 0.00 0.00 33.84 32.16 1pms n VAL 470 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pms n GLY 471 N -4.13 0.05 0.00 2.92 0.00 -1.26 -4.94 105.19 97.83 1pms n GLY 471 Ca -0.08 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1pms n GLY 471 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pms n ALA 472 N 0.89 0.00 0.24 4.61 0.00 -1.26 -5.00 120.51 119.99 1pms n ALA 472 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.50 1pms n ALA 472 Cb 0.53 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.22 1pms n ALA 472 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1pms n LYS 473 N -0.04 2.35 -3.16 0.00 4.81 -1.26 -4.50 118.16 116.35 1pms n LYS 473 Ca 0.00 -1.96 -0.20 0.00 -0.87 0.00 0.00 58.31 55.27 1pms n LYS 473 Cb 0.00 -1.46 -0.06 0.00 0.02 0.00 0.00 35.03 33.53 1pms n LYS 473 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1pms n HIS 474 N 1.04 -1.52 -0.22 5.64 8.25 -1.26 -5.13 115.22 122.01 1pms n HIS 474 Ca 0.18 -2.89 -0.14 0.00 -0.26 0.00 0.00 57.72 54.61 1pms n HIS 474 Cb 0.48 0.44 0.14 0.00 1.12 0.00 0.00 29.99 32.17 1pms n HIS 474 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1pms n GLU 475 N 2.34 -2.36 -4.22 -0.41 0.28 -1.26 -5.00 120.64 110.00 1pms n GLU 475 Ca 0.23 -0.69 -0.13 0.00 -0.16 0.00 0.00 57.16 56.41 1pms n GLU 475 Cb 0.52 -1.06 -0.10 0.00 1.43 0.00 0.00 31.44 32.23 1pms n GLU 475 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1pms s ARG 476 N -3.54 0.98 0.73 3.44 0.52 -1.08 -4.96 118.95 115.04 1pms s ARG 476 Ca 0.32 -1.42 -0.16 0.00 -0.52 0.00 0.00 55.73 53.95 1pms s ARG 476 Cb -0.06 -0.44 -0.03 0.00 0.52 0.00 0.00 34.95 34.94 1pms s ARG 476 CO 0.27 0.02 0.60 0.72 0.02 0.00 0.00 175.30 176.93 1pms n HIS 477 N -0.15 -0.57 -3.83 -0.53 8.25 -0.08 -3.05 115.22 115.26 1pms n HIS 477 Ca -0.11 0.36 -0.11 0.00 -0.26 0.00 0.00 57.72 57.60 1pms n HIS 477 Cb 0.61 -1.94 -0.09 0.00 1.12 0.00 0.00 29.99 29.69 1pms n HIS 477 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1pms s ILE 478 N -1.92 0.09 -0.30 1.59 -1.09 -1.05 -1.56 121.20 116.96 1pms s ILE 478 Ca 0.66 -0.72 0.02 0.00 -2.23 0.00 0.00 60.65 58.38 1pms s ILE 478 Cb -0.34 -0.70 0.15 0.00 -1.58 0.00 0.00 42.46 39.99 1pms s ILE 478 CO 0.57 -0.39 0.39 0.12 -1.23 0.00 0.00 174.94 174.39 1pms s PHE 479 N -1.91 -0.82 -0.03 3.97 2.19 -0.87 -3.07 117.98 117.44 1pms s PHE 479 Ca -0.10 0.07 -0.02 0.00 0.33 0.00 0.00 56.93 57.21 1pms s PHE 479 Cb -0.04 -0.24 -0.04 0.00 -1.31 0.00 0.00 43.02 41.39 1pms s PHE 479 CO -0.00 -0.98 0.13 -1.17 1.83 0.00 0.00 175.22 175.03 1pms s LEU 480 N 2.36 4.15 -0.25 6.12 0.20 -0.26 -1.44 118.68 129.55 1pms s LEU 480 Ca 0.11 0.27 -0.03 0.00 0.69 0.00 0.00 54.13 55.17 1pms s LEU 480 Cb -0.13 -2.36 0.08 0.00 -0.43 0.00 0.00 46.19 43.35 1pms s LEU 480 CO -0.27 0.29 0.08 0.12 -0.29 0.00 0.00 176.35 176.28 1pms s PHE 481 N -1.21 0.98 0.00 5.38 5.36 -0.15 -3.05 117.98 125.29 1pms s PHE 481 Ca 0.23 -1.09 0.00 0.00 -0.96 0.00 0.00 56.93 55.11 1pms s PHE 481 Cb -0.12 -1.18 0.00 0.00 -0.34 0.00 0.00 43.02 41.38 1pms s PHE 481 CO 0.14 -0.74 0.00 -3.47 -1.46 0.00 0.00 175.22 169.69 1pms n ASP 482 N 5.06 0.00 -1.63 6.13 2.03 -1.26 -0.25 116.55 126.63 1pms n ASP 482 Ca -0.06 0.00 -0.16 0.00 0.52 0.00 0.00 54.79 55.09 1pms n ASP 482 Cb 0.44 0.00 0.09 0.00 -0.72 0.00 0.00 41.12 40.93 1pms n ASP 482 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pms n GLY 483 N 0.00 5.88 2.67 0.27 0.00 -1.26 -4.58 105.19 108.18 1pms n GLY 483 Ca 0.00 -2.15 -0.30 0.00 0.00 0.00 0.00 46.02 43.58 1pms n GLY 483 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pms s LEU 484 N -3.50 1.77 -0.58 0.99 0.20 0.66 -1.14 118.68 117.08 1pms s LEU 484 Ca 0.49 -1.62 -0.22 0.00 0.69 0.00 0.00 54.13 53.47 1pms s LEU 484 Cb 0.41 -0.72 0.06 0.00 -0.43 0.00 0.00 46.19 45.51 1pms s LEU 484 CO 0.01 -0.41 0.86 -0.32 -0.29 0.00 0.00 176.35 176.19 1pms s MET 485 N 1.66 3.18 0.19 1.98 -2.45 -0.28 -0.98 119.30 122.61 1pms s MET 485 Ca 0.10 -0.69 0.02 0.00 -1.25 0.00 0.00 55.69 53.87 1pms s MET 485 Cb -0.17 -4.14 -0.04 0.00 1.25 0.00 0.00 34.83 31.73 1pms s MET 485 CO -0.26 -1.55 0.34 0.42 1.05 0.00 0.00 175.02 175.02 1pms s ILE 486 N 3.59 5.27 -0.05 10.11 1.01 -0.52 -1.01 121.20 139.59 1pms s ILE 486 Ca 0.22 -0.64 -0.15 0.00 0.00 0.00 0.00 60.65 60.09 1pms s ILE 486 Cb -0.17 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.57 1pms s ILE 486 CO 0.13 -0.19 0.35 0.00 0.00 0.00 0.00 174.94 175.23 1pms s LYS 489 N -3.39 0.46 1.10 0.00 2.36 -1.24 -0.91 119.74 118.12 1pms s LYS 489 Ca 0.01 0.08 -0.18 0.00 -2.55 0.00 0.00 55.97 53.33 1pms s LYS 489 Cb 0.02 -0.27 0.12 0.00 -1.05 0.00 0.00 37.83 36.66 1pms s LYS 489 CO -0.09 -1.06 0.05 -1.13 1.55 0.00 0.00 175.35 174.68 1pms n SER 490 N 5.24 -2.67 0.00 1.43 3.41 -1.26 -4.28 113.62 115.50 1pms n SER 490 Ca 0.02 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 1pms n SER 490 Cb 0.50 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 1pms n SER 490 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1pms n ASN 491 N -1.48 0.00 -4.01 4.04 3.02 -1.26 -4.87 115.26 110.70 1pms n ASN 491 Ca 0.02 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.36 1pms n ASN 491 Cb 0.55 0.01 -0.16 0.00 -0.61 0.00 0.00 39.78 39.57 1pms n ASN 491 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1pms s HIS 492 N -0.04 1.11 0.00 3.10 2.46 -1.26 -5.11 115.29 115.55 1pms s HIS 492 Ca 0.00 -0.31 0.00 0.00 0.47 0.00 0.00 55.06 55.22 1pms s HIS 492 Cb 0.00 -0.80 0.00 0.00 -0.13 0.00 0.00 32.58 31.65 1pms s HIS 492 CO 0.00 -0.14 0.00 0.41 -2.47 0.00 0.00 174.74 172.54 1pms n GLY 493 N 3.41 -0.05 3.72 1.59 0.00 -1.26 -4.66 105.19 107.94 1pms n GLY 493 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1pms n GLY 493 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pms n GLN 494 N 0.00 0.98 -1.75 1.61 10.64 -1.26 -4.86 117.38 122.73 1pms n GLN 494 Ca 0.00 0.39 -0.30 0.00 -1.83 0.00 0.00 57.00 55.26 1pms n GLN 494 Cb 0.00 -2.51 0.06 0.00 -0.86 0.00 0.00 30.24 26.93 1pms n GLN 494 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1pms s PRO 495 N -3.47 2.54 0.41 2.61 0.04 -1.26 -4.95 135.00 130.92 1pms s PRO 495 Ca 0.81 0.53 0.09 0.00 0.04 0.00 0.00 61.00 62.47 1pms s PRO 495 Cb -0.37 -1.98 0.88 0.00 0.04 0.00 0.00 34.50 33.07 1pms s PRO 495 CO 0.42 -1.28 2.01 0.00 0.04 0.00 0.00 177.00 178.19 1pms h ARG 496 N -0.83 0.35 -2.29 4.56 -0.00 -1.98 -3.43 114.38 110.76 1pms h ARG 496 Ca -0.46 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.98 58.91 1pms h ARG 496 Cb 1.26 -0.07 -0.22 0.00 0.00 0.00 0.00 29.97 30.94 1pms h ARG 496 CO 0.62 0.32 -0.01 -0.48 0.00 0.00 0.00 179.97 180.43 1pms s LEU 497 N -9.15 -0.29 0.41 3.04 2.34 -1.26 -5.15 118.68 108.61 1pms s LEU 497 Ca -0.07 1.17 -0.23 0.00 0.06 0.00 0.00 54.13 55.06 1pms s LEU 497 Cb 0.16 2.07 -0.10 0.00 -0.56 0.00 0.00 46.19 47.76 1pms s LEU 497 CO 0.72 -0.23 0.98 -2.16 -1.06 0.00 0.00 176.35 174.60 1pms s PRO 498 N 0.22 4.24 0.00 1.48 0.04 -1.26 -4.21 135.00 135.51 1pms s PRO 498 Ca -0.01 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.29 1pms s PRO 498 Cb -0.04 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.13 1pms s PRO 498 CO 0.01 -0.03 0.00 0.41 0.04 0.00 0.00 177.00 177.43 1pms n GLY 499 N -0.16 2.13 2.39 0.56 0.00 -1.26 -4.92 105.19 103.93 1pms n GLY 499 Ca 0.06 -0.61 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 1pms n GLY 499 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pms n ALA 500 N 0.00 2.05 -3.11 4.61 0.00 -1.26 -5.11 120.51 117.69 1pms n ALA 500 Ca 0.00 -3.04 -0.10 0.00 0.00 0.00 0.00 53.44 50.30 1pms n ALA 500 Cb 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 19.45 18.51 1pms n ALA 500 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1pms n SER 501 N 0.16 0.95 -3.14 0.00 7.64 -1.26 -5.03 113.62 112.94 1pms n SER 501 Ca 0.18 -1.62 0.04 0.00 1.01 0.00 0.00 58.87 58.48 1pms n SER 501 Cb 0.71 -0.14 -0.00 0.00 -1.01 0.00 0.00 64.21 63.77 1pms n SER 501 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1pms s SER 502 N -2.38 -1.30 0.45 6.43 1.04 -1.26 -5.13 113.70 111.54 1pms s SER 502 Ca 0.22 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.69 1pms s SER 502 Cb -0.02 1.79 0.00 0.00 0.10 0.00 0.00 66.02 67.89 1pms s SER 502 CO 0.14 -0.22 0.00 0.00 0.98 0.00 0.00 173.24 174.14 1pms n ALA 503 N 5.17 -2.59 0.05 5.32 0.00 -1.26 -4.90 120.51 122.30 1pms n ALA 503 Ca 0.07 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1pms n ALA 503 Cb 0.56 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.13 1pms n ALA 503 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pms n GLU 504 N -3.22 0.00 -2.89 0.00 4.71 -1.26 -4.98 120.64 113.00 1pms n GLU 504 Ca 0.01 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.76 1pms n GLU 504 Cb 0.42 -0.28 -0.06 0.00 -1.01 0.00 0.00 31.44 30.51 1pms n GLU 504 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1pms s TYR 505 N -1.67 3.92 0.21 -0.32 2.02 -1.26 -4.53 117.35 115.72 1pms s TYR 505 Ca 0.00 1.74 0.01 0.00 -0.37 0.00 0.00 57.07 58.46 1pms s TYR 505 Cb 0.00 -2.85 -0.00 0.00 -0.40 0.00 0.00 41.96 38.70 1pms s TYR 505 CO 0.00 0.48 0.24 0.54 -1.57 0.00 0.00 175.55 175.24 1pms n ARG 506 N 1.49 0.35 -2.70 -0.62 1.74 -1.26 -4.92 116.66 110.73 1pms n ARG 506 Ca -0.04 -1.85 -0.10 0.00 -0.77 0.00 0.00 57.85 55.09 1pms n ARG 506 Cb 0.48 1.66 0.02 0.00 -1.02 0.00 0.00 32.46 33.60 1pms n ARG 506 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1pms n LEU 507 N 0.00 -2.20 -4.30 0.55 4.77 -1.26 -4.03 117.00 110.52 1pms n LEU 507 Ca 0.02 -0.16 -0.33 0.00 -0.03 0.00 0.00 56.01 55.51 1pms n LEU 507 Cb 0.36 -1.61 -0.15 0.00 -2.33 0.00 0.00 43.42 39.70 1pms n LEU 507 CO 0.18 0.16 -0.46 -1.59 -1.33 0.00 0.00 177.39 174.34 1pms s LYS 508 N -5.19 3.28 0.34 3.23 -2.85 -1.26 -3.69 119.74 113.60 1pms s LYS 508 Ca 0.17 -0.72 0.04 0.00 -1.00 0.00 0.00 55.97 54.46 1pms s LYS 508 Cb -0.07 -2.64 -0.07 0.00 -2.06 0.00 0.00 37.83 32.99 1pms s LYS 508 CO 0.21 0.08 0.05 -1.83 0.10 0.00 0.00 175.35 173.95 1pms s GLU 509 N 0.68 1.72 0.05 1.78 1.03 -0.86 -4.97 118.70 118.13 1pms s GLU 509 Ca -0.07 -1.96 -0.12 0.00 0.03 0.00 0.00 54.97 52.85 1pms s GLU 509 Cb -0.16 -1.02 0.01 0.00 -0.80 0.00 0.00 34.13 32.17 1pms s GLU 509 CO 0.02 -0.17 0.26 -1.59 -1.33 0.00 0.00 175.26 172.45 1pms s LYS 510 N -3.85 0.79 0.35 -4.83 0.00 -1.26 -0.95 119.74 109.98 1pms s LYS 510 Ca 0.36 -0.61 -0.05 0.00 0.00 0.00 0.00 55.97 55.67 1pms s LYS 510 Cb 0.09 0.33 0.01 0.00 0.00 0.00 0.00 37.83 38.26 1pms s LYS 510 CO 0.16 -0.25 0.52 -0.06 0.00 0.00 0.00 175.35 175.72 1pms s PHE 511 N -2.79 0.91 -0.53 1.78 0.40 -0.18 -4.98 117.98 112.60 1pms s PHE 511 Ca -0.03 -1.21 -0.12 0.00 -0.60 0.00 0.00 56.93 54.97 1pms s PHE 511 Cb -0.00 0.06 0.13 0.00 0.51 0.00 0.00 43.02 43.72 1pms s PHE 511 CO -0.05 -1.20 0.43 -0.06 0.70 0.00 0.00 175.22 175.05 1pms s PHE 512 N -2.97 3.38 -1.26 0.36 0.08 -1.26 -1.13 117.98 115.18 1pms s PHE 512 Ca 0.28 -1.70 -0.06 0.00 0.12 0.00 0.00 56.93 55.57 1pms s PHE 512 Cb -0.01 -3.62 0.17 0.00 -0.57 0.00 0.00 43.02 38.99 1pms s PHE 512 CO 0.19 -1.00 2.09 -0.12 -0.10 0.00 0.00 175.22 176.27 1pms n MET 513 N 4.92 4.31 0.00 0.44 0.00 -0.29 -4.31 117.12 122.20 1pms n MET 513 Ca -0.08 -3.67 0.00 0.00 -0.00 0.00 0.00 57.70 53.95 1pms n MET 513 Cb 0.41 -2.71 0.00 0.00 0.00 0.00 0.00 33.22 30.92 1pms n MET 513 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 1pms n ARG 514 N 2.30 2.23 -0.91 2.12 0.00 -1.26 -4.00 116.66 117.14 1pms n ARG 514 Ca 0.50 0.00 -0.05 0.00 -0.00 0.00 0.00 57.85 58.30 1pms n ARG 514 Cb 0.30 -0.78 0.18 0.00 -0.00 0.00 0.00 32.46 32.16 1pms n ARG 514 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1pms n LYS 515 N -1.02 1.99 -4.37 2.89 -0.00 -1.26 -4.91 118.16 111.48 1pms n LYS 515 Ca 0.00 -3.33 -0.23 0.00 -0.00 0.00 0.00 58.31 54.74 1pms n LYS 515 Cb 0.00 -1.84 -0.08 0.00 -0.00 0.00 0.00 35.03 33.11 1pms n LYS 515 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1pms s VAL 516 N -3.45 3.04 0.02 0.58 -7.23 -1.26 -3.71 120.40 108.39 1pms s VAL 516 Ca 0.45 -2.11 0.04 0.00 -1.81 0.00 0.00 61.98 58.54 1pms s VAL 516 Cb 0.40 -2.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.70 1pms s VAL 516 CO -0.02 -0.38 -0.11 -1.10 -0.31 0.00 0.00 175.10 173.19 1pms s GLN 517 N -3.61 0.76 0.13 4.82 -0.21 -1.23 -4.92 119.66 115.41 1pms s GLN 517 Ca 0.31 -0.59 -0.18 0.00 0.02 0.00 0.00 55.36 54.91 1pms s GLN 517 Cb -0.06 -0.71 -0.07 0.00 1.00 0.00 0.00 33.01 33.17 1pms s GLN 517 CO 0.18 0.18 0.61 -1.50 -2.12 0.00 0.00 175.29 172.63 1pms s ILE 518 N -0.71 4.71 -0.22 1.08 2.07 -1.26 -2.18 121.20 124.69 1pms s ILE 518 Ca -0.00 1.15 -0.01 0.00 -1.41 0.00 0.00 60.65 60.38 1pms s ILE 518 Cb -0.07 -3.86 0.06 0.00 0.13 0.00 0.00 42.46 38.73 1pms s ILE 518 CO 0.01 0.40 0.01 0.20 -1.91 0.00 0.00 174.94 173.64 1pms s ASN 519 N -1.38 3.38 -1.39 4.50 0.01 -0.63 -4.92 114.94 114.50 1pms s ASN 519 Ca 0.34 -1.04 -0.07 0.00 -0.71 0.00 0.00 52.86 51.38 1pms s ASN 519 Cb -0.18 -0.85 0.08 0.00 0.41 0.00 0.00 41.25 40.71 1pms s ASN 519 CO 0.20 -0.29 2.44 -0.67 -1.51 0.00 0.00 177.10 177.26 1pms n ASP 520 N 4.88 7.59 -1.48 -1.22 2.03 -1.26 -1.73 116.55 125.37 1pms n ASP 520 Ca -0.09 -2.99 0.08 0.00 0.52 0.00 0.00 54.79 52.30 1pms n ASP 520 Cb 0.45 -1.44 0.34 0.00 -0.72 0.00 0.00 41.12 39.76 1pms n ASP 520 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1pms n LYS 521 N 2.66 4.03 -2.55 -0.67 5.02 -1.26 -4.48 118.16 120.92 1pms n LYS 521 Ca 0.62 -2.99 -0.19 0.00 -2.02 0.00 0.00 58.31 53.74 1pms n LYS 521 Cb 0.27 -2.05 0.01 0.00 -0.02 0.00 0.00 35.03 33.25 1pms n LYS 521 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1pms n ASP 522 N 0.31 3.26 -4.49 4.39 8.00 -1.26 -5.07 116.55 121.68 1pms n ASP 522 Ca 0.25 -3.25 -0.25 0.00 0.71 0.00 0.00 54.79 52.26 1pms n ASP 522 Cb 1.03 -0.49 -0.10 0.00 -0.02 0.00 0.00 41.12 41.55 1pms n ASP 522 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1pms s ASP 523 N -3.38 3.64 -0.05 -2.24 1.01 -1.26 -4.42 116.67 109.97 1pms s ASP 523 Ca 0.39 -1.08 0.04 0.00 0.71 0.00 0.00 52.55 52.61 1pms s ASP 523 Cb 0.42 -0.32 -0.02 0.00 1.01 0.00 0.00 42.92 44.01 1pms s ASP 523 CO -0.08 -0.04 -0.18 0.42 0.21 0.00 0.00 175.17 175.50 1pms s THR 524 N -2.54 2.74 0.63 -1.27 -4.23 -1.10 -4.95 115.64 104.93 1pms s THR 524 Ca 0.31 -0.84 0.24 0.00 -1.18 0.00 0.00 61.69 60.22 1pms s THR 524 Cb -0.03 -2.05 0.29 0.00 1.34 0.00 0.00 72.50 72.05 1pms s THR 524 CO 0.15 0.58 1.65 0.28 -0.54 0.00 0.00 174.62 176.74 1pms h SER 525 N 5.56 0.00 0.00 3.99 0.02 -2.00 0.15 113.55 121.27 1pms h SER 525 Ca -0.42 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1pms h SER 525 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1pms h SER 525 CO 0.50 0.00 -0.00 -0.33 -1.14 0.00 0.00 176.83 175.86 1pms h GLU 526 N 0.00 -0.00 -2.06 3.45 5.08 -2.06 -3.47 114.58 115.52 1pms h GLU 526 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1pms h GLU 526 Cb 1.43 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.47 1pms h GLU 526 CO -0.00 0.87 -0.00 0.71 -1.00 0.00 0.00 179.01 179.59 1pms s TYR 527 N -2.21 -1.01 0.00 4.33 2.02 0.51 -5.16 117.35 115.84 1pms s TYR 527 Ca -0.17 2.05 0.00 0.00 -0.37 0.00 0.00 57.07 58.58 1pms s TYR 527 Cb -0.03 0.58 0.00 0.00 -0.40 0.00 0.00 41.96 42.12 1pms s TYR 527 CO 0.61 -0.50 0.00 1.63 -1.57 0.00 0.00 175.55 175.72 1pms n LYS 528 N 4.21 1.83 0.00 -0.62 4.01 -1.25 -2.71 118.16 123.63 1pms n LYS 528 Ca -0.20 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.60 1pms n LYS 528 Cb 0.58 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.10 1pms n LYS 528 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 1pms n HIS 529 N -0.18 0.00 -2.53 2.13 -0.00 -1.26 -4.56 115.22 108.81 1pms n HIS 529 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1pms n HIS 529 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1pms n HIS 529 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1pms n ALA 530 N -0.80 0.00 -3.30 1.57 0.00 -1.26 -4.64 120.51 112.07 1pms n ALA 530 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1pms n ALA 530 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1pms n ALA 530 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1pms s PHE 531 N 0.56 -0.41 -0.42 0.00 0.40 -1.14 -4.82 117.98 112.15 1pms s PHE 531 Ca 0.00 0.98 -0.09 0.00 -0.60 0.00 0.00 56.93 57.22 1pms s PHE 531 Cb 0.00 0.14 0.08 0.00 0.51 0.00 0.00 43.02 43.75 1pms s PHE 531 CO 0.00 -0.20 0.26 -1.83 0.70 0.00 0.00 175.22 174.15 1pms s GLU 532 N 0.31 2.58 0.47 0.44 -1.05 -0.70 -2.94 118.70 117.81 1pms s GLU 532 Ca -0.01 -1.48 -0.04 0.00 -0.15 0.00 0.00 54.97 53.29 1pms s GLU 532 Cb -0.03 -3.78 -0.03 0.00 -0.44 0.00 0.00 34.13 29.85 1pms s GLU 532 CO -0.01 -0.96 0.75 0.42 0.95 0.00 0.00 175.26 176.41 1pms s ILE 533 N 1.41 4.67 0.10 1.83 1.09 -0.48 -1.60 121.20 128.22 1pms s ILE 533 Ca 0.03 -0.01 0.07 0.00 -1.10 0.00 0.00 60.65 59.65 1pms s ILE 533 Cb -0.23 -3.77 -0.03 0.00 -1.06 0.00 0.00 42.46 37.37 1pms s ILE 533 CO 0.02 -0.70 -0.18 -0.63 -0.10 0.00 0.00 174.94 173.35 1pms s ILE 534 N -2.69 1.54 0.36 2.92 1.09 -0.93 0.59 121.20 124.08 1pms s ILE 534 Ca 0.47 -1.52 -0.08 0.00 -1.10 0.00 0.00 60.65 58.42 1pms s ILE 534 Cb -0.10 -1.45 -0.06 0.00 -1.06 0.00 0.00 42.46 39.79 1pms s ILE 534 CO 0.43 -0.15 0.68 -0.76 -0.10 0.00 0.00 174.94 175.04 1pms s LEU 535 N -1.96 3.93 -0.07 2.97 1.43 -0.70 -3.49 118.68 120.79 1pms s LEU 535 Ca 0.05 0.96 0.07 0.00 -1.03 0.00 0.00 54.13 54.18 1pms s LEU 535 Cb -0.09 -3.81 0.32 0.00 0.03 0.00 0.00 46.19 42.63 1pms s LEU 535 CO 0.04 -0.31 1.10 0.29 0.23 0.00 0.00 176.35 177.69 1pms n LYS 536 N -1.14 2.32 -0.07 1.70 4.76 -1.24 -3.72 118.16 120.76 1pms n LYS 536 Ca 0.01 -1.25 -0.10 0.00 -2.87 0.00 0.00 58.31 54.10 1pms n LYS 536 Cb 0.54 -1.62 -0.08 0.00 -1.84 0.00 0.00 35.03 32.03 1pms n LYS 536 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1pms n ASP 537 N 0.31 2.57 0.00 4.39 2.03 -1.26 -5.01 116.55 119.58 1pms n ASP 537 Ca 0.11 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.36 1pms n ASP 537 Cb 0.51 0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 1pms n ASP 537 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pms n GLY 538 N 2.62 -0.00 0.00 0.27 0.00 -1.24 -5.15 105.19 101.68 1pms n GLY 538 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1pms n GLY 538 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pms n ASN 539 N 0.00 0.00 -3.73 1.61 4.13 -1.26 -4.94 115.26 111.07 1pms n ASN 539 Ca 0.00 -0.80 -0.15 0.00 1.68 0.00 0.00 54.58 55.31 1pms n ASN 539 Cb 0.00 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.09 1pms n ASN 539 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1pms s SER 540 N -1.00 0.14 -1.15 6.41 1.04 -1.26 -1.72 113.70 116.16 1pms s SER 540 Ca 0.00 0.27 -0.12 0.00 0.48 0.00 0.00 55.95 56.58 1pms s SER 540 Cb 0.00 0.17 0.21 0.00 0.10 0.00 0.00 66.02 66.49 1pms s SER 540 CO 0.00 -0.17 1.29 -0.69 0.98 0.00 0.00 173.24 174.65 1pms s VAL 541 N 1.45 5.36 -0.24 5.02 1.01 0.20 -4.85 120.40 128.34 1pms s VAL 541 Ca -0.06 -2.84 -0.09 0.00 0.00 0.00 0.00 61.98 58.99 1pms s VAL 541 Cb -0.12 -4.79 -0.04 0.00 0.00 0.00 0.00 36.38 31.43 1pms s VAL 541 CO -0.05 -1.45 0.12 -0.63 0.00 0.00 0.00 175.10 173.09 1pms s ILE 542 N 0.65 4.93 0.37 2.22 -1.09 -1.25 -1.39 121.20 125.63 1pms s ILE 542 Ca 0.37 0.03 0.04 0.00 -2.23 0.00 0.00 60.65 58.87 1pms s ILE 542 Cb -0.06 -3.30 -0.03 0.00 -1.58 0.00 0.00 42.46 37.49 1pms s ILE 542 CO -0.03 0.34 0.17 0.72 -1.23 0.00 0.00 174.94 174.90 1pms s PHE 543 N 1.31 1.74 -0.19 3.97 -0.71 -1.15 -3.36 117.98 119.58 1pms s PHE 543 Ca 0.06 -1.39 -0.07 0.00 -1.04 0.00 0.00 56.93 54.49 1pms s PHE 543 Cb -0.15 -0.98 0.09 0.00 -1.21 0.00 0.00 43.02 40.77 1pms s PHE 543 CO 0.05 -0.49 0.41 -1.12 -1.34 0.00 0.00 175.22 172.74 1pms s SER 544 N -3.50 -0.23 0.38 1.98 0.01 -0.17 -2.90 113.70 109.27 1pms s SER 544 Ca 0.31 0.97 -0.24 0.00 1.31 0.00 0.00 55.95 58.30 1pms s SER 544 Cb 0.03 1.31 -0.10 0.00 0.21 0.00 0.00 66.02 67.47 1pms s SER 544 CO 0.18 -0.23 0.98 0.00 0.41 0.00 0.00 173.24 174.58 1pms s ALA 545 N 2.59 3.11 -0.35 1.44 0.00 -1.26 -1.23 121.76 126.06 1pms s ALA 545 Ca -0.02 0.55 -0.05 0.00 0.00 0.00 0.00 51.96 52.44 1pms s ALA 545 Cb -0.12 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1pms s ALA 545 CO -0.13 0.03 3.09 1.17 0.00 0.00 0.00 175.76 179.93 1pms n LYS 546 N -0.01 2.38 -3.75 0.00 3.00 -1.26 -4.59 118.16 113.92 1pms n LYS 546 Ca 0.05 -1.87 0.01 0.00 -0.00 0.00 0.00 58.31 56.49 1pms n LYS 546 Cb 0.51 -2.13 0.00 0.00 0.00 0.00 0.00 35.03 33.41 1pms n LYS 546 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1pms s SER 547 N 1.04 -0.05 -0.17 3.14 0.15 -1.26 -4.99 113.70 111.56 1pms s SER 547 Ca 0.62 -0.25 -0.14 0.00 0.70 0.00 0.00 55.95 56.88 1pms s SER 547 Cb 0.34 0.25 -0.22 0.00 -1.71 0.00 0.00 66.02 64.68 1pms s SER 547 CO -0.13 -0.47 0.26 0.00 1.20 0.00 0.00 173.24 174.11 1pms n ALA 548 N -0.60 0.85 0.21 5.45 0.00 -1.26 -2.98 120.51 122.17 1pms n ALA 548 Ca -0.05 -0.56 0.11 0.00 0.00 0.00 0.00 53.44 52.94 1pms n ALA 548 Cb 0.61 -0.59 0.24 0.00 0.00 0.00 0.00 19.45 19.71 1pms n ALA 548 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1pms h GLU 549 N -0.49 0.00 0.17 0.00 4.39 -1.98 -2.96 114.58 113.71 1pms h GLU 549 Ca -0.40 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.00 1pms h GLU 549 Cb 1.66 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.32 1pms h GLU 549 CO -0.08 0.12 -1.41 0.93 -1.16 0.00 0.00 179.01 177.42 1pms h GLU 550 N 0.00 0.36 -0.26 2.33 5.08 -1.95 -2.25 114.58 117.89 1pms h GLU 550 Ca -0.00 -0.62 -0.05 0.00 -1.00 0.00 0.00 59.36 57.69 1pms h GLU 550 Cb 0.98 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1pms h GLU 550 CO 0.02 1.28 -0.04 1.57 -1.00 0.00 0.00 179.01 180.84 1pms h LYS 551 N 0.10 0.49 0.00 2.33 2.10 -1.53 -2.15 116.57 117.90 1pms h LYS 551 Ca -0.21 -0.17 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1pms h LYS 551 Cb 2.05 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 33.35 1pms h LYS 551 CO 0.22 0.68 0.00 0.09 -2.00 0.00 0.00 179.45 178.44 1pms n ASN 552 N -4.57 0.00 -0.03 7.07 3.02 -1.12 -2.99 115.26 116.65 1pms n ASN 552 Ca -0.03 0.41 -0.06 0.00 -0.03 0.00 0.00 54.58 54.86 1pms n ASN 552 Cb 0.28 -0.46 -0.05 0.00 -0.61 0.00 0.00 39.78 38.93 1pms n ASN 552 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1pms h ASN 553 N 0.00 -0.05 -0.43 6.41 4.21 -0.76 -2.32 115.58 122.64 1pms h ASN 553 Ca 0.00 -0.37 -0.05 0.00 1.21 0.00 0.00 56.30 57.09 1pms h ASN 553 Cb 0.37 0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 37.56 1pms h ASN 553 CO 0.00 0.61 0.12 -0.50 -1.29 0.00 0.00 177.43 176.38 1pms h TRP 554 N -0.99 0.77 0.58 1.19 4.06 -1.56 -0.28 115.95 119.73 1pms h TRP 554 Ca -0.01 -0.06 -0.03 0.00 2.06 0.00 0.00 58.89 60.85 1pms h TRP 554 Cb 0.42 -0.23 0.01 0.00 -1.00 0.00 0.00 29.16 28.35 1pms h TRP 554 CO 0.10 0.65 -0.28 0.52 -3.56 0.00 0.00 178.44 175.87 1pms h MET 555 N 0.73 -0.75 0.00 0.49 2.86 -1.64 -2.44 114.93 114.18 1pms h MET 555 Ca 0.16 0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.82 1pms h MET 555 Cb 0.27 0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 1pms h MET 555 CO -0.00 -0.48 -0.16 0.00 1.06 0.00 0.00 176.91 177.33 1pms h ALA 556 N -0.42 1.62 0.00 6.32 0.00 -1.25 -1.11 119.26 124.42 1pms h ALA 556 Ca -0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1pms h ALA 556 Cb 0.62 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1pms h ALA 556 CO 0.13 0.20 -0.05 0.00 0.00 0.00 0.00 179.25 179.53 1pms h ALA 557 N 1.84 1.13 0.00 0.00 0.00 -0.59 -0.19 119.26 121.45 1pms h ALA 557 Ca -0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1pms h ALA 557 Cb 0.30 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1pms h ALA 557 CO 0.02 0.07 -0.14 -0.07 0.00 0.00 0.00 179.25 179.12 1pms h LEU 558 N 0.00 0.00 -1.54 0.00 3.38 -0.81 -3.27 115.31 113.07 1pms h LEU 558 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1pms h LEU 558 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1pms h LEU 558 CO 0.01 0.63 0.01 0.40 0.09 0.00 0.00 178.44 179.57 1pms h ILE 559 N -1.00 0.00 0.24 1.22 5.03 -1.48 -1.58 117.51 119.95 1pms h ILE 559 Ca -0.01 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.72 1pms h ILE 559 Cb 0.24 0.51 0.00 0.00 -3.03 0.00 0.00 36.82 34.54 1pms h ILE 559 CO -0.01 0.00 -0.12 -1.28 -0.68 0.00 0.00 178.15 176.07 1pms h SER 560 N 0.00 -0.28 0.84 1.72 0.87 -1.07 -2.76 113.55 112.87 1pms h SER 560 Ca 0.00 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1pms h SER 560 Cb 0.01 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1pms h SER 560 CO 0.00 -0.05 -0.20 0.18 -0.53 0.00 0.00 176.83 176.23 1pms n LEU 561 N -5.16 0.23 -0.20 2.23 7.99 -0.79 -3.71 117.00 117.60 1pms n LEU 561 Ca -0.09 0.32 -0.09 0.00 -0.01 0.00 0.00 56.01 56.13 1pms n LEU 561 Cb 0.20 -0.40 0.04 0.00 -0.11 0.00 0.00 43.42 43.15 1pms n LEU 561 CO 0.33 0.04 0.80 -0.61 -1.51 0.00 0.00 177.39 176.44 1pms h GLN 562 N 0.00 1.04 0.03 3.23 4.15 -1.02 -1.63 115.11 120.92 1pms h GLN 562 Ca 0.00 -0.34 -0.00 0.00 0.77 0.00 0.00 58.65 59.07 1pms h GLN 562 Cb 0.52 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.12 1pms h GLN 562 CO 0.00 1.04 -0.01 0.10 -1.93 0.00 0.00 178.83 178.03 1pms h TYR 563 N 0.95 -0.04 0.21 3.99 -0.00 -1.61 -3.37 116.97 117.10 1pms h TYR 563 Ca 0.16 -0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.88 1pms h TYR 563 Cb 0.59 0.01 0.00 0.00 0.00 0.00 0.00 36.73 37.33 1pms h TYR 563 CO 0.04 0.66 -0.11 0.07 -0.00 0.00 0.00 178.16 178.82 1pms h ARG 564 N -0.90 -0.29 0.00 0.10 0.11 -1.67 -3.53 114.38 108.21 1pms h ARG 564 Ca -0.00 0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1pms h ARG 564 Cb 0.71 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.86 1pms h ARG 564 CO 0.01 -0.19 0.00 -1.13 0.10 0.00 0.00 179.97 178.76