#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 1.72 -0.57 -1.46 5.02 -1.26 -4.38 118.16 117.23 1pms n LYS 432 Ca 0.00 -1.59 -0.10 0.00 -2.02 0.00 0.00 58.31 54.60 1pms n LYS 432 Cb 0.00 -1.62 0.10 0.00 -0.02 0.00 0.00 35.03 33.48 1pms n LYS 432 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1pms n GLN 433 N -0.14 1.72 0.30 1.97 6.02 -1.26 -4.36 117.38 121.64 1pms n GLN 433 Ca 0.31 -1.45 0.18 0.00 -0.01 0.00 0.00 57.00 56.04 1pms n GLN 433 Cb 0.93 -1.60 1.02 0.00 1.02 0.00 0.00 30.24 31.61 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 1.09 0.00 0.00 1.08 3.38 -2.00 0.14 115.31 119.00 1pms h LEU 434 Ca 0.28 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.08 1pms h LEU 434 Cb 1.83 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.56 1pms h LEU 434 CO 0.50 0.00 -1.16 0.00 0.09 0.00 0.00 178.44 177.88 1pms h ALA 435 N 1.93 0.64 0.00 1.53 0.00 -1.98 -3.27 119.26 118.12 1pms h ALA 435 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.11 1pms h ALA 435 Cb 0.10 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1pms h ALA 435 CO -0.00 0.94 -0.44 0.82 0.00 0.00 0.00 179.25 180.57 1pms h ILE 436 N 0.00 0.00 0.00 0.00 2.04 -1.18 -3.24 117.51 115.13 1pms h ILE 436 Ca -0.12 -0.57 -0.15 0.00 1.00 0.00 0.00 64.86 65.03 1pms h ILE 436 Cb 1.59 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 38.94 1pms h ILE 436 CO 0.06 0.00 -0.71 0.11 0.00 0.00 0.00 178.15 177.61 1pms h LYS 437 N 0.00 0.00 0.36 2.37 6.56 -0.91 -3.25 116.57 121.69 1pms h LYS 437 Ca 0.00 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1pms h LYS 437 Cb 0.78 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.42 1pms h LYS 437 CO 0.00 0.71 -0.33 0.87 -2.06 0.00 0.00 179.45 178.64 1pms h LYS 438 N 0.00 -0.68 -1.37 3.15 1.57 -1.64 -1.56 116.57 116.05 1pms h LYS 438 Ca -0.01 0.05 0.41 0.00 -1.87 0.00 0.00 60.65 59.23 1pms h LYS 438 Cb 1.33 0.15 -0.07 0.00 0.08 0.00 0.00 32.23 33.73 1pms h LYS 438 CO 0.09 -0.45 0.97 -1.33 -0.57 0.00 0.00 179.45 178.16 1pms n MET 439 N -5.44 -0.01 -0.05 3.15 2.81 -1.23 0.17 117.12 116.52 1pms n MET 439 Ca -0.10 0.83 -0.14 0.00 -1.81 0.00 0.00 57.70 56.48 1pms n MET 439 Cb 0.34 -1.85 -0.12 0.00 -0.71 0.00 0.00 33.22 30.88 1pms n MET 439 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1pms h ASN 440 N 0.00 0.06 0.45 7.83 2.35 -1.45 -3.06 115.58 121.75 1pms h ASN 440 Ca 0.69 -0.89 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 1pms h ASN 440 Cb 2.65 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 41.01 1pms h ASN 440 CO -0.08 0.94 0.00 -0.62 -1.65 0.00 0.00 177.43 176.02 1pms n GLU 441 N -4.61 0.03 0.01 0.81 1.02 0.44 -1.25 120.64 117.10 1pms n GLU 441 Ca -0.10 0.24 -0.17 0.00 -0.02 0.00 0.00 57.16 57.11 1pms n GLU 441 Cb 0.47 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.25 1pms n GLU 441 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1pms h ILE 442 N 0.00 0.79 -0.00 -3.67 2.04 -0.97 -1.73 117.51 113.97 1pms h ILE 442 Ca 0.00 -2.52 0.00 0.00 1.00 0.00 0.00 64.86 63.34 1pms h ILE 442 Cb 0.22 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1pms h ILE 442 CO 0.00 0.78 -0.70 0.00 0.00 0.00 0.00 178.15 178.23 1pms n GLN 443 N -3.37 0.15 -0.00 2.37 6.02 -1.10 -3.57 117.38 117.87 1pms n GLN 443 Ca -0.25 -0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.64 1pms n GLN 443 Cb 1.05 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.80 1pms n GLN 443 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1pms n LYS 444 N -1.33 1.38 0.00 -1.09 3.00 -0.38 -4.14 118.16 115.59 1pms n LYS 444 Ca 0.06 -0.01 0.12 0.00 -0.00 0.00 0.00 58.31 58.48 1pms n LYS 444 Cb 0.34 -1.03 0.23 0.00 0.00 0.00 0.00 35.03 34.57 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 -1.72 1.57 -0.13 3.14 2.85 -0.65 -4.12 115.26 116.21 1pms n ASN 445 Ca -0.01 -1.25 -0.20 0.00 -0.11 0.00 0.00 54.58 53.01 1pms n ASN 445 Cb 0.21 0.25 -0.11 0.00 1.24 0.00 0.00 39.78 41.37 1pms n ASN 445 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1pms n ILE 446 N -0.22 1.44 0.00 -1.44 2.08 -1.23 -4.91 119.36 115.08 1pms n ILE 446 Ca 0.12 -0.51 0.00 0.00 0.56 0.00 0.00 62.75 62.92 1pms n ILE 446 Cb 0.41 -1.50 0.00 0.00 -0.75 0.00 0.00 39.64 37.80 1pms n ILE 446 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1pms n ASP 447 N -3.46 0.00 -2.47 4.38 -0.08 -1.26 -2.44 116.55 111.23 1pms n ASP 447 Ca -0.46 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 52.80 1pms n ASP 447 Cb 0.95 0.00 0.10 0.00 2.34 0.00 0.00 41.12 44.50 1pms n ASP 447 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1pms n GLY 448 N 0.00 1.83 1.57 0.27 0.00 -1.26 -4.83 105.19 102.77 1pms n GLY 448 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.26 0.00 -0.42 1.61 -0.00 -1.10 -4.74 117.44 111.52 1pms n TRP 449 Ca -0.17 0.00 0.39 0.00 -0.00 0.00 0.00 57.50 57.72 1pms n TRP 449 Cb 0.86 -0.93 0.65 0.00 -0.00 0.00 0.00 31.31 31.88 1pms n TRP 449 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 1pms h GLU 450 N 0.00 0.00 0.00 5.87 5.08 -1.84 -3.42 114.58 120.28 1pms h GLU 450 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pms h GLU 450 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1pms h GLU 450 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1pms n GLY 451 N -1.80 0.86 1.85 -3.84 0.00 -1.26 -5.00 105.19 96.00 1pms n GLY 451 Ca 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 1.63 -1.36 1.61 4.01 -1.26 -4.93 118.16 117.86 1pms n LYS 452 Ca 0.00 -1.06 -0.52 0.00 -0.51 0.00 0.00 58.31 56.22 1pms n LYS 452 Cb 0.00 -1.52 -0.11 0.00 -0.51 0.00 0.00 35.03 32.88 1pms n LYS 452 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1pms n ASP 453 N 1.09 0.95 -0.49 4.39 9.92 -1.26 -4.66 116.55 126.49 1pms n ASP 453 Ca 0.24 0.45 0.43 0.00 -0.53 0.00 0.00 54.79 55.38 1pms n ASP 453 Cb 0.59 -1.00 0.75 0.00 -0.64 0.00 0.00 41.12 40.83 1pms n ASP 453 CO 0.00 0.00 0.00 0.16 0.13 0.00 0.00 177.20 177.49 1pms h ILE 454 N 7.30 0.16 -3.35 0.53 -0.00 -1.92 -3.36 117.51 116.87 1pms h ILE 454 Ca -0.12 0.00 -0.56 0.00 -0.00 0.00 0.00 64.86 64.18 1pms h ILE 454 Cb 1.37 0.17 -0.05 0.00 -0.00 0.00 0.00 36.82 38.31 1pms h ILE 454 CO 1.16 0.00 0.05 -0.83 -0.00 0.00 0.00 178.15 178.52 1pms s GLY 455 N -3.84 2.70 0.13 0.16 0.00 -1.25 -4.97 107.32 100.25 1pms s GLY 455 Ca -0.05 0.13 -0.13 0.00 0.00 0.00 0.00 44.72 44.67 1pms s GLY 455 CO 0.80 0.80 1.57 -1.61 0.00 0.00 0.00 173.10 174.66 1pms h GLN 456 N 5.32 0.79 0.00 2.90 4.15 -1.80 -3.46 115.11 123.01 1pms h GLN 456 Ca -0.46 -0.27 0.00 0.00 0.77 0.00 0.00 58.65 58.69 1pms h GLN 456 Cb 1.20 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.83 1pms h GLN 456 CO 0.68 0.87 0.00 0.00 -1.93 0.00 0.00 178.83 178.46 1pms n ASN 459 N 1.85 -1.78 -3.64 0.00 4.05 -1.26 -4.95 115.26 109.53 1pms n ASN 459 Ca 0.06 0.00 -0.10 0.00 0.45 0.00 0.00 54.58 54.98 1pms n ASN 459 Cb 0.39 -0.89 -0.05 0.00 1.23 0.00 0.00 39.78 40.47 1pms n ASN 459 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 177.26 172.38 1pms s GLU 460 N -1.04 1.06 -0.92 1.20 -1.05 -1.26 -3.95 118.70 112.74 1pms s GLU 460 Ca 0.00 -0.72 -0.14 0.00 -0.15 0.00 0.00 54.97 53.96 1pms s GLU 460 Cb 0.00 0.47 -0.27 0.00 -0.44 0.00 0.00 34.13 33.88 1pms s GLU 460 CO 0.00 -0.41 2.22 1.19 0.95 0.00 0.00 175.26 179.21 1pms n PHE 461 N -0.22 0.38 0.25 4.83 3.01 -1.25 -1.90 117.46 122.56 1pms n PHE 461 Ca -0.16 -0.01 0.14 0.00 1.01 0.00 0.00 57.45 58.43 1pms n PHE 461 Cb 0.64 -1.19 0.57 0.00 -0.01 0.00 0.00 39.48 39.49 1pms n PHE 461 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 1pms h ILE 462 N 7.22 0.24 -2.10 4.37 6.09 0.14 -3.39 117.51 130.09 1pms h ILE 462 Ca 0.03 -0.79 -0.44 0.00 -1.37 0.00 0.00 64.86 62.29 1pms h ILE 462 Cb 1.09 1.64 -0.33 0.00 0.47 0.00 0.00 36.82 39.69 1pms h ILE 462 CO 1.42 0.09 -0.76 -0.04 -3.07 0.00 0.00 178.15 175.80 1pms s MET 463 N -3.65 0.68 -0.55 2.19 -1.94 -0.88 -4.97 119.30 110.19 1pms s MET 463 Ca 0.01 -1.17 -0.22 0.00 -1.71 0.00 0.00 55.69 52.60 1pms s MET 463 Cb 0.09 -0.92 0.05 0.00 2.01 0.00 0.00 34.83 36.07 1pms s MET 463 CO 0.59 -1.24 0.82 -1.21 -0.01 0.00 0.00 175.02 173.98 1pms s GLU 464 N 1.11 3.22 0.00 2.03 0.41 -1.26 -1.83 118.70 122.37 1pms s GLU 464 Ca 0.20 -0.60 0.00 0.00 -0.41 0.00 0.00 54.97 54.16 1pms s GLU 464 Cb -0.14 -4.10 0.00 0.00 -1.78 0.00 0.00 34.13 28.11 1pms s GLU 464 CO -0.04 -1.44 0.00 0.41 -0.49 0.00 0.00 175.26 173.70 1pms n GLY 465 N 5.17 1.38 2.98 -1.39 0.00 -1.17 -4.74 105.19 107.41 1pms n GLY 465 Ca -0.02 0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 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 1.18 0.61 0.02 2.61 -4.23 -1.26 -2.43 115.64 112.14 1pms s THR 466 Ca 0.00 -0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 60.20 1pms s THR 466 Cb 0.00 -0.54 -0.01 0.00 1.34 0.00 0.00 72.50 73.29 1pms s THR 466 CO 0.00 0.19 0.03 -0.22 -0.54 0.00 0.00 174.62 174.08 1pms s LEU 467 N 0.11 2.01 -0.09 4.79 1.98 -1.18 -4.55 118.68 121.74 1pms s LEU 467 Ca -0.01 -0.45 -0.17 0.00 -2.89 0.00 0.00 54.13 50.61 1pms s LEU 467 Cb -0.06 0.32 -0.05 0.00 0.66 0.00 0.00 46.19 47.07 1pms s LEU 467 CO -0.00 -0.36 0.46 0.28 -1.89 0.00 0.00 176.35 174.84 1pms s THR 468 N -1.69 5.14 -1.03 3.68 -1.32 -0.08 -2.08 115.64 118.26 1pms s THR 468 Ca -0.13 0.93 -0.17 0.00 -1.21 0.00 0.00 61.69 61.11 1pms s THR 468 Cb -0.07 -3.79 0.14 0.00 -1.51 0.00 0.00 72.50 67.26 1pms s THR 468 CO -0.01 0.39 1.24 -0.13 -2.21 0.00 0.00 174.62 173.90 1pms s ARG 469 N 0.20 3.77 0.49 7.08 0.52 -1.26 -0.96 118.95 128.79 1pms s ARG 469 Ca 0.25 -2.03 -0.13 0.00 -0.52 0.00 0.00 55.73 53.30 1pms s ARG 469 Cb -0.16 -4.98 -0.11 0.00 0.52 0.00 0.00 34.95 30.22 1pms s ARG 469 CO 0.11 -1.78 -0.26 1.33 0.02 0.00 0.00 175.30 174.72 1pms n VAL 470 N 5.23 0.00 0.00 3.52 0.24 -1.13 -2.73 118.33 123.46 1pms n VAL 470 Ca 0.29 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 1pms n VAL 470 Cb 0.47 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 1pms n VAL 470 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pms n GLY 471 N 2.10 0.79 3.11 7.63 0.00 -1.26 -4.97 105.19 112.58 1pms n GLY 471 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1pms n GLY 471 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pms s ALA 472 N -2.21 1.10 -1.12 4.61 0.00 -1.10 -5.03 121.76 118.01 1pms s ALA 472 Ca 0.00 -0.68 -0.06 0.00 0.00 0.00 0.00 51.96 51.22 1pms s ALA 472 Cb 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1pms s ALA 472 CO 0.00 0.24 2.69 1.63 0.00 0.00 0.00 175.76 180.32 1pms n LYS 473 N 2.36 3.78 0.00 0.00 4.01 -1.26 -4.68 118.16 122.37 1pms n LYS 473 Ca -0.16 -2.77 0.00 0.00 -0.51 0.00 0.00 58.31 54.87 1pms n LYS 473 Cb 0.55 -2.52 0.00 0.00 -0.51 0.00 0.00 35.03 32.55 1pms n LYS 473 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 1pms n HIS 474 N 2.04 0.00 -0.20 2.13 -0.00 -1.26 -5.16 115.22 112.77 1pms n HIS 474 Ca 0.62 0.00 -0.06 0.00 0.46 0.00 0.00 57.72 58.74 1pms n HIS 474 Cb 0.36 0.00 0.06 0.00 -0.12 0.00 0.00 29.99 30.29 1pms n HIS 474 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1pms n GLU 475 N 0.00 -0.60 -3.74 1.57 1.02 -1.26 -4.62 120.64 113.00 1pms n GLU 475 Ca 0.00 -0.30 -0.13 0.00 -0.02 0.00 0.00 57.16 56.70 1pms n GLU 475 Cb 0.00 -0.60 -0.09 0.00 -0.02 0.00 0.00 31.44 30.73 1pms n GLU 475 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1pms s ARG 476 N -2.34 0.57 0.74 3.49 1.81 -0.89 -4.80 118.95 117.54 1pms s ARG 476 Ca 0.14 0.18 -0.15 0.00 -1.72 0.00 0.00 55.73 54.17 1pms s ARG 476 Cb -0.02 0.26 0.01 0.00 -0.45 0.00 0.00 34.95 34.75 1pms s ARG 476 CO 0.12 -0.12 0.93 0.72 -0.68 0.00 0.00 175.30 176.26 1pms n HIS 477 N 2.06 0.51 -3.89 -0.53 8.25 -0.91 -3.13 115.22 117.58 1pms n HIS 477 Ca -0.17 0.38 -0.10 0.00 -0.26 0.00 0.00 57.72 57.58 1pms n HIS 477 Cb 0.57 -2.05 -0.09 0.00 1.12 0.00 0.00 29.99 29.54 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 -1.90 0.13 -0.29 1.59 -1.09 -1.02 -1.55 121.20 117.07 1pms s ILE 478 Ca 0.72 -1.07 0.01 0.00 -2.23 0.00 0.00 60.65 58.08 1pms s ILE 478 Cb -0.33 -1.01 0.15 0.00 -1.58 0.00 0.00 42.46 39.69 1pms s ILE 478 CO 0.52 -0.59 0.36 -0.36 -1.23 0.00 0.00 174.94 173.63 1pms s PHE 479 N -2.88 -0.75 -0.11 3.97 0.40 -0.70 -3.06 117.98 114.85 1pms s PHE 479 Ca -0.03 0.08 -0.22 0.00 -0.60 0.00 0.00 56.93 56.16 1pms s PHE 479 Cb 0.00 -0.30 -0.03 0.00 0.51 0.00 0.00 43.02 43.20 1pms s PHE 479 CO -0.06 -0.96 0.65 -1.17 0.70 0.00 0.00 175.22 174.38 1pms s LEU 480 N 2.45 4.26 -0.75 -0.37 1.98 -0.76 -1.25 118.68 124.24 1pms s LEU 480 Ca 0.10 1.03 0.02 0.00 -2.89 0.00 0.00 54.13 52.39 1pms s LEU 480 Cb -0.13 -2.97 0.18 0.00 0.66 0.00 0.00 46.19 43.93 1pms s LEU 480 CO -0.31 -0.14 0.57 0.12 -1.89 0.00 0.00 176.35 174.69 1pms s PHE 481 N 1.09 3.64 0.00 5.38 5.36 -0.60 0.17 117.98 133.03 1pms s PHE 481 Ca 0.33 -3.20 0.00 0.00 -0.96 0.00 0.00 56.93 53.10 1pms s PHE 481 Cb -0.17 -2.91 0.00 0.00 -0.34 0.00 0.00 43.02 39.60 1pms s PHE 481 CO 0.14 -0.63 0.00 -0.25 -1.46 0.00 0.00 175.22 173.02 1pms n ASP 482 N 2.24 0.00 -1.92 6.13 9.92 -0.80 -0.75 116.55 131.38 1pms n ASP 482 Ca 0.19 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.36 1pms n ASP 482 Cb 0.36 0.00 0.27 0.00 -0.64 0.00 0.00 41.12 41.10 1pms n ASP 482 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1pms n GLY 483 N 0.00 3.97 3.22 0.44 0.00 -1.26 -4.82 105.19 106.74 1pms n GLY 483 Ca 0.00 -1.04 -0.23 0.00 0.00 0.00 0.00 46.02 44.75 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 -3.08 2.22 -0.35 0.99 2.96 0.08 -1.09 118.68 120.41 1pms s LEU 484 Ca 0.54 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 1pms s LEU 484 Cb 0.44 -0.78 0.10 0.00 0.50 0.00 0.00 46.19 46.45 1pms s LEU 484 CO 0.12 0.07 0.07 -0.32 -1.32 0.00 0.00 176.35 174.96 1pms s MET 485 N -1.42 1.71 0.16 1.98 1.75 -0.90 -1.56 119.30 121.02 1pms s MET 485 Ca 0.04 -1.79 -0.00 0.00 -1.25 0.00 0.00 55.69 52.69 1pms s MET 485 Cb -0.09 -3.27 -0.04 0.00 2.84 0.00 0.00 34.83 34.27 1pms s MET 485 CO 0.02 -0.92 0.34 0.42 -0.65 0.00 0.00 175.02 174.23 1pms s ILE 486 N 0.99 5.25 -0.09 10.11 1.01 -0.38 -1.42 121.20 136.68 1pms s ILE 486 Ca 0.08 -0.40 -0.16 0.00 0.00 0.00 0.00 60.65 60.17 1pms s ILE 486 Cb -0.20 -3.71 0.04 0.00 0.01 0.00 0.00 42.46 38.60 1pms s ILE 486 CO -0.07 -0.09 0.39 0.00 0.00 0.00 0.00 174.94 175.17 1pms n LYS 489 N 4.42 0.68 -1.24 0.00 4.81 -1.05 -2.15 118.16 123.63 1pms n LYS 489 Ca -0.18 0.28 0.00 0.00 -0.87 0.00 0.00 58.31 57.54 1pms n LYS 489 Cb 0.51 -1.75 -0.00 0.00 0.02 0.00 0.00 35.03 33.80 1pms n LYS 489 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1pms n SER 490 N -3.19 -6.68 -4.56 3.14 7.64 -1.15 -4.87 113.62 103.95 1pms n SER 490 Ca -0.23 1.48 -0.35 0.00 1.01 0.00 0.00 58.87 60.79 1pms n SER 490 Cb 1.05 -3.80 -0.11 0.00 -1.01 0.00 0.00 64.21 60.35 1pms n SER 490 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1pms s ASN 491 N -4.89 5.31 -0.32 6.43 2.47 -1.26 -4.91 114.94 117.76 1pms s ASN 491 Ca 0.00 -0.03 0.17 0.00 0.42 0.00 0.00 52.86 53.43 1pms s ASN 491 Cb 0.00 -1.91 0.47 0.00 -1.45 0.00 0.00 41.25 38.36 1pms s ASN 491 CO 0.00 0.14 1.00 1.41 -3.72 0.00 0.00 177.10 175.93 1pms n HIS 492 N 3.78 1.44 0.00 0.43 8.25 -1.26 -4.73 115.22 123.12 1pms n HIS 492 Ca -0.17 -2.68 0.00 0.00 -0.26 0.00 0.00 57.72 54.61 1pms n HIS 492 Cb 0.52 -0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.31 1pms n HIS 492 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pms n GLY 493 N -0.22 0.41 3.71 -1.41 0.00 -1.26 -5.03 105.19 101.39 1pms n GLY 493 Ca 0.13 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 1pms n GLY 493 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pms s GLN 494 N 0.00 4.41 0.00 1.61 -1.52 -1.26 -3.89 119.66 119.00 1pms s GLN 494 Ca 0.00 1.85 0.00 0.00 -1.95 0.00 0.00 55.36 55.26 1pms s GLN 494 Cb 0.00 -3.32 0.00 0.00 -0.22 0.00 0.00 33.01 29.47 1pms s GLN 494 CO 0.00 -0.29 0.01 -0.35 -0.25 0.00 0.00 175.29 174.41 1pms n PRO 495 N 3.86 0.00 0.00 2.91 -0.04 -1.24 -5.01 135.00 135.48 1pms n PRO 495 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1pms n PRO 495 Cb 0.45 -0.14 0.00 0.00 -0.04 0.00 0.00 33.50 33.78 1pms n PRO 495 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1pms n ARG 496 N -0.09 0.00 -0.09 0.54 1.74 -1.26 -4.98 116.66 112.51 1pms n ARG 496 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 1pms n ARG 496 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 1pms n ARG 496 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1pms h LEU 497 N 0.00 0.00 0.00 0.55 3.38 -2.04 -3.48 115.31 113.72 1pms h LEU 497 Ca 0.00 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1pms h LEU 497 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1pms h LEU 497 CO 0.00 1.32 0.00 -0.81 0.09 0.00 0.00 178.44 179.04 1pms n PRO 498 N -4.49 0.99 -1.83 1.13 -0.04 -1.26 -5.00 135.00 124.50 1pms n PRO 498 Ca -0.25 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 62.98 1pms n PRO 498 Cb 0.59 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 34.09 1pms n PRO 498 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pms n GLY 499 N 5.00 6.24 0.00 0.55 0.00 -1.26 -3.93 105.19 111.78 1pms n GLY 499 Ca 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 46.02 43.51 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 -0.77 0.00 -2.64 4.61 0.00 -1.26 -4.31 120.51 116.14 1pms n ALA 500 Ca 0.44 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.46 1pms n ALA 500 Cb 0.92 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.35 1pms n ALA 500 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1pms s SER 501 N -2.75 7.21 -0.16 0.00 0.01 -1.26 -4.90 113.70 111.84 1pms s SER 501 Ca 0.00 1.60 0.17 0.00 1.31 0.00 0.00 55.95 59.03 1pms s SER 501 Cb 0.00 -2.56 0.36 0.00 0.21 0.00 0.00 66.02 64.04 1pms s SER 501 CO 0.00 -0.47 1.23 -1.20 0.41 0.00 0.00 173.24 173.21 1pms n SER 502 N 4.98 2.55 0.00 2.44 7.64 -1.25 -3.73 113.62 126.26 1pms n SER 502 Ca 0.09 -3.23 0.00 0.00 1.01 0.00 0.00 58.87 56.74 1pms n SER 502 Cb 0.48 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1pms n SER 502 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pms n ALA 503 N -1.21 0.00 -1.48 -0.43 0.00 -1.26 -4.18 120.51 111.96 1pms n ALA 503 Ca 0.18 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 53.17 1pms n ALA 503 Cb 0.72 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.09 1pms n ALA 503 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1pms n GLU 504 N -1.47 0.89 -2.00 0.00 2.13 -1.26 -4.79 120.64 114.13 1pms n GLU 504 Ca 0.00 0.18 -0.43 0.00 0.66 0.00 0.00 57.16 57.57 1pms n GLU 504 Cb 0.00 -2.52 -0.03 0.00 0.27 0.00 0.00 31.44 29.17 1pms n GLU 504 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1pms s TYR 505 N 8.69 1.86 -0.44 4.31 2.02 -1.26 -4.74 117.35 127.79 1pms s TYR 505 Ca 1.12 0.54 0.03 0.00 -0.37 0.00 0.00 57.07 58.38 1pms s TYR 505 Cb -0.77 -4.07 0.24 0.00 -0.40 0.00 0.00 41.96 36.95 1pms s TYR 505 CO 0.44 -3.13 0.98 2.89 -1.57 0.00 0.00 175.55 175.16 1pms n ARG 506 N 8.13 0.50 -3.07 -0.62 1.85 -1.26 -4.95 116.66 117.24 1pms n ARG 506 Ca 0.22 -1.40 0.03 0.00 -1.00 0.00 0.00 57.85 55.69 1pms n ARG 506 Cb 0.46 -0.98 -0.00 0.00 -1.05 0.00 0.00 32.46 30.89 1pms n ARG 506 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1pms s LEU 507 N -0.14 -0.95 0.04 2.89 0.20 -1.26 -5.01 118.68 114.44 1pms s LEU 507 Ca 0.29 -0.17 -0.00 0.00 0.69 0.00 0.00 54.13 54.93 1pms s LEU 507 Cb 0.18 1.40 -0.03 0.00 -0.43 0.00 0.00 46.19 47.31 1pms s LEU 507 CO -0.16 -0.14 -0.03 -1.59 -0.29 0.00 0.00 176.35 174.14 1pms s LYS 508 N 2.41 0.47 0.27 1.98 -2.85 -1.26 -2.52 119.74 118.23 1pms s LYS 508 Ca 0.17 -0.91 0.12 0.00 -1.00 0.00 0.00 55.97 54.35 1pms s LYS 508 Cb -0.03 0.14 -0.05 0.00 -2.06 0.00 0.00 37.83 35.83 1pms s LYS 508 CO -0.18 -0.07 -0.21 -1.83 0.10 0.00 0.00 175.35 173.16 1pms s GLU 509 N -2.66 1.66 0.07 1.78 -1.05 -1.01 -4.95 118.70 112.54 1pms s GLU 509 Ca -0.05 -1.74 -0.13 0.00 -0.15 0.00 0.00 54.97 52.90 1pms s GLU 509 Cb -0.01 -1.78 0.02 0.00 -0.44 0.00 0.00 34.13 31.92 1pms s GLU 509 CO -0.05 0.34 0.31 -1.59 0.95 0.00 0.00 175.26 175.22 1pms s LYS 510 N -3.40 0.89 0.31 -4.83 0.00 -1.26 -1.77 119.74 109.69 1pms s LYS 510 Ca 0.29 -0.65 -0.03 0.00 0.00 0.00 0.00 55.97 55.58 1pms s LYS 510 Cb -0.05 0.38 0.01 0.00 0.00 0.00 0.00 37.83 38.17 1pms s LYS 510 CO 0.14 -0.30 0.46 1.19 0.00 0.00 0.00 175.35 176.84 1pms n PHE 511 N 0.23 -1.43 -3.95 1.78 3.01 -0.51 -5.02 117.46 111.57 1pms n PHE 511 Ca -0.17 -2.02 -0.35 0.00 1.01 0.00 0.00 57.45 55.92 1pms n PHE 511 Cb 0.61 0.52 -0.11 0.00 -0.01 0.00 0.00 39.48 40.50 1pms n PHE 511 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1pms s PHE 512 N -3.16 3.17 -0.82 1.38 0.40 -1.26 -2.13 117.98 115.56 1pms s PHE 512 Ca 0.24 -0.13 0.02 0.00 -0.60 0.00 0.00 56.93 56.46 1pms s PHE 512 Cb -0.01 -2.14 0.31 0.00 0.51 0.00 0.00 43.02 41.69 1pms s PHE 512 CO 0.17 -0.06 1.25 -0.12 0.70 0.00 0.00 175.22 177.16 1pms n MET 513 N 4.09 3.92 0.00 0.44 1.56 -0.25 -4.61 117.12 122.28 1pms n MET 513 Ca -0.16 -4.71 0.00 0.00 -0.27 0.00 0.00 57.70 52.56 1pms n MET 513 Cb 0.52 -2.36 0.00 0.00 2.15 0.00 0.00 33.22 33.53 1pms n MET 513 CO 0.00 0.00 0.00 2.89 -0.73 0.00 0.00 175.97 178.13 1pms n ARG 514 N 0.38 1.98 -1.02 2.12 0.00 -1.25 -4.34 116.66 114.54 1pms n ARG 514 Ca 0.34 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 58.07 1pms n ARG 514 Cb 0.35 -0.70 0.18 0.00 -0.00 0.00 0.00 32.46 32.28 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 -1.01 2.08 -4.30 2.89 0.00 -1.26 -4.89 118.16 111.66 1pms n LYS 515 Ca 0.00 -3.24 -0.23 0.00 -0.00 0.00 0.00 58.31 54.84 1pms n LYS 515 Cb 0.16 -1.95 -0.07 0.00 -0.00 0.00 0.00 35.03 33.17 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 -3.46 3.36 -0.03 0.58 -7.23 -1.26 -4.39 120.40 107.97 1pms s VAL 516 Ca 0.49 -1.94 0.01 0.00 -1.81 0.00 0.00 61.98 58.73 1pms s VAL 516 Cb 0.43 -2.81 0.01 0.00 0.56 0.00 0.00 36.38 34.57 1pms s VAL 516 CO 0.02 -0.37 -0.05 -1.10 -0.31 0.00 0.00 175.10 173.29 1pms s GLN 517 N -3.67 0.64 0.03 4.82 -0.21 -1.25 -4.98 119.66 115.05 1pms s GLN 517 Ca 0.32 -0.13 -0.18 0.00 0.02 0.00 0.00 55.36 55.38 1pms s GLN 517 Cb -0.06 -0.66 -0.06 0.00 1.00 0.00 0.00 33.01 33.23 1pms s GLN 517 CO 0.20 -0.00 0.52 -1.50 -2.12 0.00 0.00 175.29 172.39 1pms s ILE 518 N 0.50 4.86 -0.30 1.08 2.07 -1.26 -2.74 121.20 125.41 1pms s ILE 518 Ca -0.06 1.11 0.02 0.00 -1.41 0.00 0.00 60.65 60.30 1pms s ILE 518 Cb -0.10 -3.85 0.09 0.00 0.13 0.00 0.00 42.46 38.73 1pms s ILE 518 CO -0.00 0.53 0.04 0.20 -1.91 0.00 0.00 174.94 173.80 1pms s ASN 519 N -0.89 4.31 -0.08 4.50 0.01 -0.83 -4.93 114.94 117.02 1pms s ASN 519 Ca 0.28 -1.75 -0.30 0.00 -0.71 0.00 0.00 52.86 50.38 1pms s ASN 519 Cb -0.18 -1.27 -0.04 0.00 0.41 0.00 0.00 41.25 40.17 1pms s ASN 519 CO 0.17 -0.36 1.38 -0.62 -1.51 0.00 0.00 177.10 176.16 1pms s ASP 520 N 1.26 6.87 -0.34 -1.22 2.15 -1.26 -2.55 116.67 121.58 1pms s ASP 520 Ca 0.06 1.95 -0.00 0.00 0.43 0.00 0.00 52.55 54.99 1pms s ASP 520 Cb -0.18 -2.55 0.08 0.00 -0.30 0.00 0.00 42.92 39.97 1pms s ASP 520 CO -0.13 -0.76 0.07 -0.75 -0.17 0.00 0.00 175.17 173.43 1pms s LYS 521 N 3.08 2.01 -0.71 4.34 2.20 -1.26 -5.01 119.74 124.39 1pms s LYS 521 Ca 0.61 -1.62 0.04 0.00 -0.36 0.00 0.00 55.97 54.64 1pms s LYS 521 Cb -0.27 -3.29 0.22 0.00 -1.51 0.00 0.00 37.83 32.97 1pms s LYS 521 CO 0.22 -0.85 0.71 -0.25 -0.36 0.00 0.00 175.35 174.82 1pms n ASP 522 N 4.49 3.71 -0.03 1.43 8.00 -1.26 -4.78 116.55 128.11 1pms n ASP 522 Ca -0.05 -3.34 -0.21 0.00 0.71 0.00 0.00 54.79 51.90 1pms n ASP 522 Cb 0.42 -0.77 -0.13 0.00 -0.02 0.00 0.00 41.12 40.62 1pms n ASP 522 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1pms h ASP 523 N 4.83 0.27 -4.74 -2.24 5.19 -1.95 -3.48 116.42 114.31 1pms h ASP 523 Ca 0.18 -0.78 -0.19 0.00 -0.62 0.00 0.00 57.03 55.62 1pms h ASP 523 Cb 0.70 -0.09 -0.22 0.00 0.18 0.00 0.00 39.33 39.90 1pms h ASP 523 CO 0.83 1.65 -0.71 0.42 -3.12 0.00 0.00 179.24 178.31 1pms s THR 524 N -2.46 0.11 -0.94 0.35 -4.23 -1.26 -5.00 115.64 102.21 1pms s THR 524 Ca -0.23 -0.75 0.10 0.00 -1.18 0.00 0.00 61.69 59.63 1pms s THR 524 Cb 0.05 -0.23 0.09 0.00 1.34 0.00 0.00 72.50 73.75 1pms s THR 524 CO 0.71 -0.40 1.33 -0.24 -0.54 0.00 0.00 174.62 175.48 1pms n SER 525 N 1.87 0.06 0.11 3.99 2.88 -1.26 -1.24 113.62 120.03 1pms n SER 525 Ca -0.22 0.52 0.09 0.00 -1.33 0.00 0.00 58.87 57.94 1pms n SER 525 Cb 0.56 -0.53 0.02 0.00 -0.75 0.00 0.00 64.21 63.50 1pms n SER 525 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1pms h GLU 526 N 0.00 0.00 0.00 -1.46 5.08 -2.02 -3.27 114.58 112.91 1pms h GLU 526 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pms h GLU 526 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1pms h GLU 526 CO 0.00 0.07 0.00 0.98 -1.00 0.00 0.00 179.01 179.06 1pms n TYR 527 N -2.81 0.00 -0.31 4.33 4.19 -0.38 -5.00 117.16 117.18 1pms n TYR 527 Ca -0.01 0.00 0.04 0.00 3.31 0.00 0.00 57.90 61.24 1pms n TYR 527 Cb 0.60 0.00 -0.02 0.00 0.49 0.00 0.00 39.34 40.42 1pms n TYR 527 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 1pms n LYS 528 N -0.83 -0.68 -2.62 2.98 3.00 -1.23 -4.72 118.16 114.05 1pms n LYS 528 Ca 0.16 0.52 -0.26 0.00 -0.00 0.00 0.00 58.31 58.73 1pms n LYS 528 Cb 0.07 -0.81 -0.01 0.00 0.00 0.00 0.00 35.03 34.28 1pms n LYS 528 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1pms n HIS 529 N -2.80 3.44 -0.43 5.64 8.25 -1.26 -4.86 115.22 123.19 1pms n HIS 529 Ca -0.01 -3.36 0.00 0.00 -0.26 0.00 0.00 57.72 54.09 1pms n HIS 529 Cb 0.14 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.04 1pms n HIS 529 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pms n ALA 530 N -0.39 0.00 -3.15 -1.41 0.00 -1.26 -4.87 120.51 109.44 1pms n ALA 530 Ca 0.35 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.67 1pms n ALA 530 Cb 0.59 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 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 1.64 -0.06 -0.32 0.00 0.40 -1.01 -4.48 117.98 114.14 1pms s PHE 531 Ca 0.00 0.07 0.02 0.00 -0.60 0.00 0.00 56.93 56.42 1pms s PHE 531 Cb 0.00 0.01 0.10 0.00 0.51 0.00 0.00 43.02 43.64 1pms s PHE 531 CO 0.00 -0.30 0.06 -1.83 0.70 0.00 0.00 175.22 173.84 1pms s GLU 532 N -1.21 1.21 0.40 0.44 -1.05 -1.06 -2.52 118.70 114.91 1pms s GLU 532 Ca -0.13 -1.49 -0.01 0.00 -0.15 0.00 0.00 54.97 53.19 1pms s GLU 532 Cb -0.06 -2.70 -0.03 0.00 -0.44 0.00 0.00 34.13 30.90 1pms s GLU 532 CO 0.02 -0.92 0.63 0.42 0.95 0.00 0.00 175.26 176.36 1pms s ILE 533 N 1.21 4.85 0.05 1.83 1.01 -0.40 -1.96 121.20 127.79 1pms s ILE 533 Ca 0.09 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.46 1pms s ILE 533 Cb -0.18 -3.79 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1pms s ILE 533 CO -0.14 -0.58 -0.11 -0.63 0.00 0.00 0.00 174.94 173.47 1pms s ILE 534 N -2.46 0.85 0.44 2.92 1.09 -1.11 0.66 121.20 123.58 1pms s ILE 534 Ca 0.43 -1.10 -0.04 0.00 -1.10 0.00 0.00 60.65 58.84 1pms s ILE 534 Cb -0.10 -0.84 -0.04 0.00 -1.06 0.00 0.00 42.46 40.43 1pms s ILE 534 CO 0.38 -0.23 0.71 -0.76 -0.10 0.00 0.00 174.94 174.95 1pms s LEU 535 N -1.48 3.75 -0.17 2.97 1.43 -0.83 -3.82 118.68 120.52 1pms s LEU 535 Ca -0.04 0.79 0.13 0.00 -1.03 0.00 0.00 54.13 53.98 1pms s LEU 535 Cb -0.09 -3.71 0.69 0.00 0.03 0.00 0.00 46.19 43.11 1pms s LEU 535 CO 0.01 -0.48 1.56 0.29 0.23 0.00 0.00 176.35 177.96 1pms n LYS 536 N -2.07 4.10 -0.07 1.70 5.02 -1.26 -4.26 118.16 121.31 1pms n LYS 536 Ca -0.01 -2.66 -0.15 0.00 -2.02 0.00 0.00 58.31 53.46 1pms n LYS 536 Cb 0.55 -2.07 -0.05 0.00 -0.02 0.00 0.00 35.03 33.45 1pms n LYS 536 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1pms n ASP 537 N 0.67 1.06 0.00 4.39 8.00 -1.26 -5.02 116.55 124.39 1pms n ASP 537 Ca 0.24 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.92 1pms n ASP 537 Cb 0.99 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 1pms n ASP 537 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pms n GLY 538 N 2.09 0.00 0.03 0.44 0.00 -1.26 -5.17 105.19 101.32 1pms n GLY 538 Ca -0.28 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.10 -3.71 1.61 5.03 -1.26 -5.03 115.26 112.00 1pms n ASN 539 Ca 0.00 -1.02 -0.14 0.00 0.87 0.00 0.00 54.58 54.30 1pms n ASN 539 Cb 0.00 0.01 -0.14 0.00 -1.02 0.00 0.00 39.78 38.64 1pms n ASN 539 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1pms s SER 540 N -1.02 0.05 -1.25 6.41 1.04 -1.26 -1.97 113.70 115.70 1pms s SER 540 Ca 0.00 0.47 -0.11 0.00 0.48 0.00 0.00 55.95 56.79 1pms s SER 540 Cb 0.00 0.41 0.17 0.00 0.10 0.00 0.00 66.02 66.70 1pms s SER 540 CO 0.00 -0.19 1.69 0.52 0.98 0.00 0.00 173.24 176.24 1pms n VAL 541 N 4.63 4.33 -3.71 5.02 0.31 0.21 -4.88 118.33 124.23 1pms n VAL 541 Ca -0.18 -4.56 -0.36 0.00 -0.01 0.00 0.00 64.34 59.23 1pms n VAL 541 Cb 0.51 -2.40 -0.09 0.00 -0.91 0.00 0.00 33.84 30.96 1pms n VAL 541 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1pms s ILE 542 N 0.80 5.33 0.32 2.52 1.01 -1.25 -1.28 121.20 128.65 1pms s ILE 542 Ca 0.41 0.17 0.05 0.00 0.00 0.00 0.00 60.65 61.28 1pms s ILE 542 Cb 0.04 -3.46 -0.03 0.00 0.01 0.00 0.00 42.46 39.03 1pms s ILE 542 CO 0.01 0.39 0.23 0.72 0.00 0.00 0.00 174.94 176.29 1pms s PHE 543 N 0.72 1.67 -0.19 3.97 -0.71 -1.05 -2.84 117.98 119.55 1pms s PHE 543 Ca 0.07 -1.56 -0.07 0.00 -1.04 0.00 0.00 56.93 54.33 1pms s PHE 543 Cb -0.12 -0.76 0.08 0.00 -1.21 0.00 0.00 43.02 41.01 1pms s PHE 543 CO 0.01 -0.75 0.41 -1.12 -1.34 0.00 0.00 175.22 172.43 1pms s SER 544 N -3.37 -0.28 0.40 1.98 0.01 -0.13 -2.41 113.70 109.89 1pms s SER 544 Ca 0.38 0.95 -0.23 0.00 1.31 0.00 0.00 55.95 58.36 1pms s SER 544 Cb 0.03 1.18 -0.10 0.00 0.21 0.00 0.00 66.02 67.34 1pms s SER 544 CO 0.23 -0.22 0.99 0.00 0.41 0.00 0.00 173.24 174.65 1pms s ALA 545 N 2.32 3.08 -0.11 1.44 0.00 -1.26 -0.90 121.76 126.33 1pms s ALA 545 Ca -0.03 0.54 -0.02 0.00 0.00 0.00 0.00 51.96 52.45 1pms s ALA 545 Cb -0.11 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 1pms s ALA 545 CO -0.13 -0.00 2.43 1.63 0.00 0.00 0.00 175.76 179.69 1pms n LYS 546 N -0.17 1.52 -3.96 0.00 4.76 -1.26 -4.64 118.16 114.41 1pms n LYS 546 Ca 0.05 -0.77 0.03 0.00 -2.87 0.00 0.00 58.31 54.76 1pms n LYS 546 Cb 0.51 -1.45 0.01 0.00 -1.84 0.00 0.00 35.03 32.26 1pms n LYS 546 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1pms s SER 547 N 1.45 -0.00 -0.07 4.39 0.01 -1.26 -4.98 113.70 113.24 1pms s SER 547 Ca 0.26 -0.15 0.11 0.00 1.31 0.00 0.00 55.95 57.49 1pms s SER 547 Cb 0.16 0.11 -0.24 0.00 0.21 0.00 0.00 66.02 66.26 1pms s SER 547 CO -0.02 -0.22 0.55 0.00 0.41 0.00 0.00 173.24 173.96 1pms n ALA 548 N -0.88 1.43 0.05 1.44 0.00 -1.26 -3.20 120.51 118.09 1pms n ALA 548 Ca 0.03 -0.82 -0.06 0.00 0.00 0.00 0.00 53.44 52.59 1pms n ALA 548 Cb 0.59 -0.74 -0.10 0.00 0.00 0.00 0.00 19.45 19.19 1pms n ALA 548 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1pms h GLU 549 N 0.01 0.00 0.00 0.00 4.11 -1.97 -3.09 114.58 113.64 1pms h GLU 549 Ca -0.34 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 58.90 1pms h GLU 549 Cb 2.04 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.27 1pms h GLU 549 CO 0.07 0.75 -0.93 0.93 0.07 0.00 0.00 179.01 179.90 1pms h GLU 550 N 0.00 0.02 -0.18 1.06 5.08 -1.94 -0.64 114.58 117.98 1pms h GLU 550 Ca -0.09 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 1pms h GLU 550 Cb 1.77 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.03 1pms h GLU 550 CO 0.10 0.93 -0.32 1.57 -1.00 0.00 0.00 179.01 180.29 1pms h LYS 551 N 0.01 0.53 -0.00 2.33 2.10 -1.62 -2.77 116.57 117.15 1pms h LYS 551 Ca -0.01 -0.34 0.00 0.00 -2.00 0.00 0.00 60.65 58.30 1pms h LYS 551 Cb 1.64 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 33.01 1pms h LYS 551 CO 0.12 0.94 -0.03 -1.71 -2.00 0.00 0.00 179.45 176.78 1pms n ASN 552 N -4.34 0.03 0.02 7.07 5.15 -1.17 -2.91 115.26 119.12 1pms n ASN 552 Ca -0.06 0.41 -0.05 0.00 -0.60 0.00 0.00 54.58 54.28 1pms n ASN 552 Cb 0.49 -0.44 -0.04 0.00 -0.53 0.00 0.00 39.78 39.26 1pms n ASN 552 CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 1pms h ASN 553 N 0.00 -0.14 -0.37 1.20 4.21 -0.84 -2.49 115.58 117.15 1pms h ASN 553 Ca 0.00 -0.17 -0.10 0.00 1.21 0.00 0.00 56.30 57.25 1pms h ASN 553 Cb 0.49 0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.71 1pms h ASN 553 CO 0.00 0.41 -0.12 -0.50 -1.29 0.00 0.00 177.43 175.93 1pms h TRP 554 N -1.01 0.91 -0.86 1.19 4.06 -1.62 -1.41 115.95 117.21 1pms h TRP 554 Ca -0.02 -0.17 0.04 0.00 2.06 0.00 0.00 58.89 60.80 1pms h TRP 554 Cb 0.30 -0.23 -0.05 0.00 -1.00 0.00 0.00 29.16 28.18 1pms h TRP 554 CO 0.05 0.89 0.55 1.98 -3.56 0.00 0.00 178.44 178.34 1pms h MET 555 N 0.74 1.03 -0.02 0.49 1.85 -1.65 -2.15 114.93 115.22 1pms h MET 555 Ca 0.12 -0.06 -0.20 0.00 -0.61 0.00 0.00 59.70 58.95 1pms h MET 555 Cb 0.61 -0.23 -0.01 0.00 0.43 0.00 0.00 31.60 32.40 1pms h MET 555 CO 0.04 0.68 -0.83 0.00 -0.40 0.00 0.00 176.91 176.40 1pms h ALA 556 N 1.36 0.53 0.00 0.39 0.00 -1.12 -2.94 119.26 117.48 1pms h ALA 556 Ca 0.35 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1pms h ALA 556 Cb 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1pms h ALA 556 CO -0.12 0.84 0.00 0.00 0.00 0.00 0.00 179.25 179.97 1pms h ALA 557 N 0.94 1.00 0.00 0.00 0.00 -0.63 0.23 119.26 120.80 1pms h ALA 557 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1pms h ALA 557 Cb 1.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1pms h ALA 557 CO 0.13 0.00 -0.20 -0.07 0.00 0.00 0.00 179.25 179.12 1pms h LEU 558 N 0.00 0.00 -0.24 0.00 3.38 -1.28 -3.27 115.31 113.90 1pms h LEU 558 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pms h LEU 558 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1pms h LEU 558 CO 0.00 0.53 0.00 -0.38 0.09 0.00 0.00 178.44 178.68 1pms n ILE 559 N -4.32 1.35 -0.04 1.22 -0.00 -1.18 -2.05 119.36 114.34 1pms n ILE 559 Ca -0.03 0.39 -0.16 0.00 -0.00 0.00 0.00 62.75 62.96 1pms n ILE 559 Cb 0.10 -1.28 -0.08 0.00 -0.00 0.00 0.00 39.64 38.39 1pms n ILE 559 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.55 177.32 1pms h SER 560 N 0.00 0.68 -0.02 4.38 4.64 -0.64 -2.94 113.55 119.65 1pms h SER 560 Ca 0.00 -0.61 -0.12 0.00 -0.47 0.00 0.00 61.79 60.59 1pms h SER 560 Cb 0.15 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1pms h SER 560 CO 0.00 1.18 -0.44 -0.07 -0.87 0.00 0.00 176.83 176.63 1pms h LEU 561 N 0.22 0.43 -0.83 5.97 -0.00 -1.46 -3.24 115.31 116.40 1pms h LEU 561 Ca -0.02 -0.73 0.20 0.00 -0.00 0.00 0.00 57.88 57.33 1pms h LEU 561 Cb 1.13 -0.13 -0.13 0.00 -0.00 0.00 0.00 40.66 41.54 1pms h LEU 561 CO 0.11 1.10 0.23 1.56 -0.00 0.00 0.00 178.44 181.44 1pms h GLN 562 N -0.21 0.26 -0.94 1.13 1.08 -1.58 0.13 115.11 114.99 1pms h GLN 562 Ca -0.05 -0.02 0.20 0.00 -1.45 0.00 0.00 58.65 57.34 1pms h GLN 562 Cb 1.15 -0.06 -0.18 0.00 -0.05 0.00 0.00 27.48 28.34 1pms h GLN 562 CO 0.09 0.17 -0.17 1.88 -0.95 0.00 0.00 178.83 179.84 1pms h TYR 563 N 0.26 -0.39 0.00 2.96 -1.99 -1.53 -3.36 116.97 112.91 1pms h TYR 563 Ca 0.50 0.08 0.00 0.00 2.00 0.00 0.00 58.73 61.31 1pms h TYR 563 Cb 0.94 0.32 0.00 0.00 2.00 0.00 0.00 36.73 39.99 1pms h TYR 563 CO -0.25 -0.40 0.00 2.89 -0.00 0.00 0.00 178.16 180.40 1pms n ARG 564 N -5.57 0.00 0.00 4.88 0.00 0.25 -5.15 116.66 111.08 1pms n ARG 564 Ca 0.16 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 58.15 1pms n ARG 564 Cb 0.53 0.00 0.44 0.00 -0.00 0.00 0.00 32.46 33.43 1pms n ARG 564 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06