#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 2.35 -0.60 4.33 4.01 -1.26 -4.55 118.16 122.45 1pms n LYS 432 Ca 0.00 -2.61 -0.11 0.00 -0.51 0.00 0.00 58.31 55.08 1pms n LYS 432 Cb 0.00 -2.03 0.10 0.00 -0.51 0.00 0.00 35.03 32.58 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 -0.25 1.69 0.32 1.97 6.02 -1.26 -4.35 117.38 121.52 1pms n GLN 433 Ca 0.49 -1.48 0.20 0.00 -0.01 0.00 0.00 57.00 56.20 1pms n GLN 433 Cb 0.58 -1.60 1.10 0.00 1.02 0.00 0.00 30.24 31.34 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 1.06 0.00 0.06 1.08 3.38 -2.00 0.26 115.31 119.15 1pms h LEU 434 Ca 0.30 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.95 1pms h LEU 434 Cb 1.88 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 1pms h LEU 434 CO 0.53 0.00 -1.78 0.00 0.09 0.00 0.00 178.44 177.28 1pms h ALA 435 N 1.92 0.60 0.00 1.53 0.00 -1.99 -3.31 119.26 118.01 1pms h ALA 435 Ca 0.01 -1.40 0.00 0.00 0.00 0.00 0.00 54.91 53.52 1pms h ALA 435 Cb 0.10 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1pms h ALA 435 CO -0.00 1.45 -0.04 -0.89 0.00 0.00 0.00 179.25 179.76 1pms n ILE 436 N -3.24 0.02 0.18 0.00 -0.00 -0.23 -2.82 119.36 113.27 1pms n ILE 436 Ca -0.22 -0.01 0.10 0.00 -0.00 0.00 0.00 62.75 62.63 1pms n ILE 436 Cb 1.05 -0.44 0.11 0.00 -0.00 0.00 0.00 39.64 40.36 1pms n ILE 436 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.55 177.05 1pms h LYS 437 N 0.00 0.00 0.68 0.38 3.11 -0.65 -3.32 116.57 116.77 1pms h LYS 437 Ca 0.00 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 57.81 1pms h LYS 437 Cb 0.51 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 31.74 1pms h LYS 437 CO 0.00 0.08 -0.33 -0.22 -2.81 0.00 0.00 179.45 176.17 1pms h LYS 438 N 0.00 -0.88 -1.63 1.90 3.64 -1.64 -2.47 116.57 115.50 1pms h LYS 438 Ca -0.01 0.06 0.47 0.00 -1.27 0.00 0.00 60.65 59.91 1pms h LYS 438 Cb 1.07 0.20 -0.07 0.00 -0.41 0.00 0.00 32.23 33.02 1pms h LYS 438 CO 0.01 -0.55 1.17 0.00 -2.27 0.00 0.00 179.45 177.81 1pms n MET 439 N -5.44 0.00 0.08 1.90 0.00 -1.25 0.11 117.12 112.52 1pms n MET 439 Ca -0.13 0.89 -0.12 0.00 0.00 0.00 0.00 57.70 58.34 1pms n MET 439 Cb 0.38 -2.06 -0.08 0.00 0.00 0.00 0.00 33.22 31.46 1pms n MET 439 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 175.97 175.06 1pms h ASN 440 N 0.00 -0.22 0.55 3.17 -0.26 -1.63 -1.45 115.58 115.74 1pms h ASN 440 Ca 0.77 -0.30 0.00 0.00 -0.56 0.00 0.00 56.30 56.21 1pms h ASN 440 Cb 3.11 0.06 0.00 0.00 -1.06 0.00 0.00 38.32 40.43 1pms h ASN 440 CO -0.01 0.25 0.00 -0.62 -1.06 0.00 0.00 177.43 175.99 1pms n GLU 441 N -4.99 0.05 0.04 0.81 1.02 0.29 -2.87 120.64 114.99 1pms n GLU 441 Ca -0.09 0.18 -0.22 0.00 -0.02 0.00 0.00 57.16 57.01 1pms n GLU 441 Cb 0.26 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.04 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 0.83 0.00 -3.67 2.04 -0.72 -0.72 117.51 115.27 1pms h ILE 442 Ca 0.00 -2.44 0.00 0.00 1.00 0.00 0.00 64.86 63.42 1pms h ILE 442 Cb 0.28 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 1pms h ILE 442 CO 0.00 0.86 0.00 0.00 0.00 0.00 0.00 178.15 179.01 1pms n GLN 443 N -3.59 0.04 -0.06 2.37 6.02 -0.57 -2.12 117.38 119.47 1pms n GLN 443 Ca -0.27 0.12 -0.08 0.00 -0.01 0.00 0.00 57.00 56.75 1pms n GLN 443 Cb 1.05 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.74 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 -1.47 0.74 0.00 -1.09 3.00 -1.16 -3.69 118.16 114.49 1pms n LYS 444 Ca 0.06 0.06 0.13 0.00 -0.00 0.00 0.00 58.31 58.56 1pms n LYS 444 Cb 0.24 -1.26 0.68 0.00 0.00 0.00 0.00 35.03 34.69 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 -2.78 0.00 -0.10 3.14 5.15 -0.28 -3.61 115.26 116.78 1pms n ASN 445 Ca -0.22 -0.18 -0.20 0.00 -0.60 0.00 0.00 54.58 53.38 1pms n ASN 445 Cb 0.76 -0.25 -0.08 0.00 -0.53 0.00 0.00 39.78 39.69 1pms n ASN 445 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pms n ILE 446 N -1.25 1.11 0.00 -1.44 0.13 -0.90 -4.92 119.36 112.09 1pms n ILE 446 Ca 0.13 -0.31 0.00 0.00 -1.10 0.00 0.00 62.75 61.47 1pms n ILE 446 Cb 0.20 -1.64 0.00 0.00 -0.84 0.00 0.00 39.64 37.35 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 -3.72 0.00 0.00 9.51 2.03 -1.24 -3.71 116.55 119.42 1pms n ASP 447 Ca -0.39 0.00 0.00 0.00 0.52 0.00 0.00 54.79 54.92 1pms n ASP 447 Cb 0.80 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.20 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 0.75 3.72 0.27 0.00 -1.26 -4.74 105.19 103.93 1pms n GLY 448 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1pms n GLY 448 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1pms s TRP 449 N -1.35 2.78 -0.82 1.61 1.48 -1.24 -3.97 118.94 117.43 1pms s TRP 449 Ca 0.00 -0.27 0.02 0.00 -1.06 0.00 0.00 56.10 54.79 1pms s TRP 449 Cb 0.00 -1.44 0.27 0.00 -1.16 0.00 0.00 33.47 31.14 1pms s TRP 449 CO 0.00 0.47 1.01 -0.85 -4.06 0.00 0.00 176.95 173.52 1pms n GLU 450 N -1.07 3.23 -0.89 3.25 0.28 -1.26 -4.45 120.64 119.73 1pms n GLU 450 Ca -0.05 -4.62 0.00 0.00 -0.16 0.00 0.00 57.16 52.33 1pms n GLU 450 Cb 0.60 -2.36 -0.00 0.00 1.43 0.00 0.00 31.44 31.10 1pms n GLU 450 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1pms n GLY 451 N 1.13 0.74 2.29 -1.84 0.00 -1.26 -4.84 105.19 101.40 1pms n GLY 451 Ca 0.28 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pms n GLY 451 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1pms n LYS 452 N 0.16 -4.84 0.00 1.61 3.00 -1.26 -4.78 118.16 112.05 1pms n LYS 452 Ca -0.02 3.49 0.00 0.00 -0.00 0.00 0.00 58.31 61.78 1pms n LYS 452 Cb 0.82 -4.30 0.00 0.00 0.00 0.00 0.00 35.03 31.54 1pms n LYS 452 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1pms n ASP 453 N 1.89 0.00 -0.05 3.14 2.03 -1.26 -4.86 116.55 117.44 1pms n ASP 453 Ca 0.00 0.04 -0.06 0.00 0.52 0.00 0.00 54.79 55.28 1pms n ASP 453 Cb 0.00 -0.35 -0.04 0.00 -0.72 0.00 0.00 41.12 40.01 1pms n ASP 453 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1pms n ILE 454 N -2.14 0.52 -1.53 5.18 -0.00 -1.26 -4.97 119.36 115.16 1pms n ILE 454 Ca 0.00 -0.20 -0.12 0.00 -0.00 0.00 0.00 62.75 62.43 1pms n ILE 454 Cb 0.00 -0.84 -0.04 0.00 -0.00 0.00 0.00 39.64 38.75 1pms n ILE 454 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1pms n GLY 455 N 3.05 0.85 0.08 7.39 0.00 0.61 -4.78 105.19 112.39 1pms n GLY 455 Ca -0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.70 1pms n GLY 455 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1pms h GLN 456 N 0.00 0.03 0.00 1.61 5.75 -1.94 -3.45 115.11 117.11 1pms h GLN 456 Ca -0.25 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.20 1pms h GLN 456 Cb 0.85 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.42 1pms h GLN 456 CO 0.35 1.03 -0.01 0.00 -2.65 0.00 0.00 178.83 177.54 1pms n ASN 459 N 5.32 0.00 -3.64 0.00 0.23 -1.26 -4.85 115.26 111.05 1pms n ASN 459 Ca -0.04 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 53.98 1pms n ASN 459 Cb 0.48 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 38.18 1pms n ASN 459 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 1pms s GLU 460 N -0.77 1.12 0.00 -3.83 -1.05 -1.26 -0.28 118.70 112.63 1pms s GLU 460 Ca 0.00 -0.65 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 1pms s GLU 460 Cb 0.00 0.36 0.00 0.00 -0.44 0.00 0.00 34.13 34.05 1pms s GLU 460 CO 0.00 -0.52 0.00 1.97 0.95 0.00 0.00 175.26 177.66 1pms n PHE 461 N -0.53 0.00 0.00 4.83 1.16 -1.26 -4.36 117.46 117.30 1pms n PHE 461 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.52 1pms n PHE 461 Cb 0.61 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.48 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 -3.61 1.97 2.08 -1.26 -4.04 119.36 114.50 1pms n ILE 462 Ca 0.00 0.00 -0.13 0.00 0.56 0.00 0.00 62.75 63.18 1pms n ILE 462 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 39.64 38.77 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 0.20 -0.20 0.38 -1.94 -1.18 -4.92 119.30 111.64 1pms s MET 463 Ca 0.00 0.71 -0.04 0.00 -1.71 0.00 0.00 55.69 54.64 1pms s MET 463 Cb 0.00 -0.17 0.08 0.00 2.01 0.00 0.00 34.83 36.75 1pms s MET 463 CO 0.00 -0.37 0.14 -1.21 -0.01 0.00 0.00 175.02 173.58 1pms s GLU 464 N 2.46 0.13 0.00 2.03 2.02 -1.26 -1.08 118.70 123.00 1pms s GLU 464 Ca 0.03 -0.07 0.00 0.00 0.02 0.00 0.00 54.97 54.95 1pms s GLU 464 Cb -0.13 -1.50 0.00 0.00 0.10 0.00 0.00 34.13 32.60 1pms s GLU 464 CO -0.10 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 174.85 1pms n GLY 465 N 5.29 -1.84 3.09 -1.39 0.00 -1.16 -4.17 105.19 105.01 1pms n GLY 465 Ca -0.06 0.82 -0.13 0.00 0.00 0.00 0.00 46.02 46.65 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 1.05 -0.01 -0.00 2.61 -4.23 -1.26 -3.04 115.64 110.75 1pms s THR 466 Ca 0.00 0.05 -0.13 0.00 -1.18 0.00 0.00 61.69 60.43 1pms s THR 466 Cb 0.00 -0.35 0.02 0.00 1.34 0.00 0.00 72.50 73.51 1pms s THR 466 CO 0.00 0.02 0.28 -0.22 -0.54 0.00 0.00 174.62 174.16 1pms s LEU 467 N 0.53 0.97 0.14 4.79 1.98 -1.19 -4.62 118.68 121.28 1pms s LEU 467 Ca -0.03 -0.02 -0.03 0.00 -2.89 0.00 0.00 54.13 51.16 1pms s LEU 467 Cb -0.05 1.19 -0.05 0.00 0.66 0.00 0.00 46.19 47.94 1pms s LEU 467 CO -0.03 -0.47 0.35 0.28 -1.89 0.00 0.00 176.35 174.59 1pms s THR 468 N -1.58 5.21 -0.96 3.68 -1.32 -0.23 -2.64 115.64 117.81 1pms s THR 468 Ca -0.12 -0.11 -0.11 0.00 -1.21 0.00 0.00 61.69 60.14 1pms s THR 468 Cb -0.05 -3.64 0.25 0.00 -1.51 0.00 0.00 72.50 67.55 1pms s THR 468 CO 0.02 0.02 0.92 -0.60 -2.21 0.00 0.00 174.62 172.78 1pms s ARG 469 N -2.75 3.85 -0.00 7.08 3.52 -1.26 -1.17 118.95 128.22 1pms s ARG 469 Ca 0.39 -2.86 -0.35 0.00 -0.13 0.00 0.00 55.73 52.79 1pms s ARG 469 Cb -0.12 -4.45 -0.17 0.00 -1.56 0.00 0.00 34.95 28.64 1pms s ARG 469 CO 0.26 -1.26 0.93 1.33 -0.81 0.00 0.00 175.30 175.75 1pms n VAL 470 N 3.29 0.00 0.00 7.11 0.24 -1.07 -2.34 118.33 125.56 1pms n VAL 470 Ca 0.19 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.49 1pms n VAL 470 Cb 0.43 -0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.80 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 1.31 1.96 0.00 7.63 0.00 -1.26 -4.91 105.19 109.91 1pms n GLY 471 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.01 0.00 -2.73 4.61 0.00 -0.99 -5.08 120.51 116.30 1pms n ALA 472 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1pms n ALA 472 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 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 0.00 1.50 0.00 0.00 4.81 -1.26 -5.05 118.16 118.16 1pms n LYS 473 Ca 0.00 -2.10 0.00 0.00 -0.87 0.00 0.00 58.31 55.34 1pms n LYS 473 Cb 0.00 -0.36 0.00 0.00 0.02 0.00 0.00 35.03 34.69 1pms n LYS 473 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1pms n HIS 474 N -1.17 0.00 -0.82 5.64 -0.00 -1.26 -5.16 115.22 112.45 1pms n HIS 474 Ca -0.08 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.77 1pms n HIS 474 Cb 0.85 0.00 0.09 0.00 -0.12 0.00 0.00 29.99 30.81 1pms n HIS 474 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 1pms n GLU 475 N 0.00 -0.83 -3.82 1.57 0.28 -1.26 -4.81 120.64 111.77 1pms n GLU 475 Ca 0.00 -0.24 -0.09 0.00 -0.16 0.00 0.00 57.16 56.67 1pms n GLU 475 Cb 0.00 -1.31 -0.06 0.00 1.43 0.00 0.00 31.44 31.50 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 -2.68 1.03 0.57 3.44 0.52 -1.08 -4.96 118.95 115.78 1pms s ARG 476 Ca 0.42 -0.95 -0.19 0.00 -0.52 0.00 0.00 55.73 54.49 1pms s ARG 476 Cb 0.00 0.40 -0.06 0.00 0.52 0.00 0.00 34.95 35.81 1pms s ARG 476 CO 0.60 -0.37 0.94 0.72 0.02 0.00 0.00 175.30 177.21 1pms n HIS 477 N -0.17 0.79 -4.00 -0.53 8.25 -0.74 -3.16 115.22 115.66 1pms n HIS 477 Ca -0.13 0.45 -0.08 0.00 -0.26 0.00 0.00 57.72 57.70 1pms n HIS 477 Cb 0.63 -2.14 -0.10 0.00 1.12 0.00 0.00 29.99 29.50 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 -1.49 0.16 -0.30 1.59 -1.09 -1.17 -1.57 121.20 117.34 1pms s ILE 478 Ca 0.73 -1.35 -0.01 0.00 -2.23 0.00 0.00 60.65 57.78 1pms s ILE 478 Cb -0.44 -1.03 0.13 0.00 -1.58 0.00 0.00 42.46 39.54 1pms s ILE 478 CO 0.49 -0.75 0.24 0.12 -1.23 0.00 0.00 174.94 173.82 1pms s PHE 479 N -2.95 -0.16 -0.49 3.97 5.36 -0.92 -2.96 117.98 119.84 1pms s PHE 479 Ca -0.02 -0.48 -0.18 0.00 -0.96 0.00 0.00 56.93 55.29 1pms s PHE 479 Cb 0.01 -0.62 0.06 0.00 -0.34 0.00 0.00 43.02 42.13 1pms s PHE 479 CO -0.06 -0.89 0.53 -1.17 -1.46 0.00 0.00 175.22 172.17 1pms s LEU 480 N 2.19 5.20 -0.78 6.12 2.96 -0.24 -1.53 118.68 132.60 1pms s LEU 480 Ca 0.10 -1.05 -0.20 0.00 -0.22 0.00 0.00 54.13 52.76 1pms s LEU 480 Cb -0.15 -2.35 0.11 0.00 0.50 0.00 0.00 46.19 44.30 1pms s LEU 480 CO -0.32 -0.79 1.00 0.12 -1.32 0.00 0.00 176.35 175.05 1pms s PHE 481 N 2.25 2.94 0.00 5.38 5.36 0.25 -3.07 117.98 131.08 1pms s PHE 481 Ca 0.11 -1.03 0.00 0.00 -0.96 0.00 0.00 56.93 55.05 1pms s PHE 481 Cb -0.21 -4.24 0.00 0.00 -0.34 0.00 0.00 43.02 38.23 1pms s PHE 481 CO 0.10 -1.52 0.00 -3.47 -1.46 0.00 0.00 175.22 168.87 1pms n ASP 482 N 6.91 0.00 -2.21 6.13 2.03 -1.26 -0.01 116.55 128.15 1pms n ASP 482 Ca 0.09 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.09 1pms n ASP 482 Cb 0.47 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.92 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 6.09 3.16 0.27 0.00 -1.26 -4.77 105.19 108.69 1pms n GLY 483 Ca 0.00 -2.46 -0.12 0.00 0.00 0.00 0.00 46.02 43.44 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 -3.74 1.19 0.00 0.99 0.20 0.99 -0.90 118.68 117.41 1pms s LEU 484 Ca 0.59 0.03 0.07 0.00 0.69 0.00 0.00 54.13 55.51 1pms s LEU 484 Cb 0.47 0.95 -0.02 0.00 -0.43 0.00 0.00 46.19 47.15 1pms s LEU 484 CO 0.01 -0.36 -0.23 -0.32 -0.29 0.00 0.00 176.35 175.17 1pms s MET 485 N -1.11 1.73 0.07 1.98 -2.45 -1.04 -0.58 119.30 117.90 1pms s MET 485 Ca -0.12 -0.87 -0.02 0.00 -1.25 0.00 0.00 55.69 53.43 1pms s MET 485 Cb -0.06 -1.74 -0.04 0.00 1.25 0.00 0.00 34.83 34.24 1pms s MET 485 CO 0.02 0.47 0.01 0.42 1.05 0.00 0.00 175.02 176.99 1pms s ILE 486 N -0.62 0.19 -0.04 10.11 1.01 -0.58 -1.57 121.20 129.70 1pms s ILE 486 Ca 0.09 -1.77 -0.12 0.00 0.00 0.00 0.00 60.65 58.85 1pms s ILE 486 Cb -0.09 -1.60 0.02 0.00 0.01 0.00 0.00 42.46 40.80 1pms s ILE 486 CO 0.00 -0.87 0.27 0.00 0.00 0.00 0.00 174.94 174.34 1pms n LYS 489 N 1.55 0.96 0.00 0.00 4.81 -1.26 -1.80 118.16 122.43 1pms n LYS 489 Ca -0.21 -3.03 0.00 0.00 -0.87 0.00 0.00 58.31 54.20 1pms n LYS 489 Cb 0.56 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 34.08 1pms n LYS 489 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1pms n SER 490 N 0.41 0.72 -4.58 3.14 2.88 -1.26 -4.77 113.62 110.15 1pms n SER 490 Ca 0.20 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.34 1pms n SER 490 Cb 0.66 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.09 1pms n SER 490 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1pms s ASN 491 N 2.00 5.16 -0.53 -3.46 3.84 -1.26 -4.90 114.94 115.79 1pms s ASN 491 Ca 0.00 1.42 0.04 0.00 0.21 0.00 0.00 52.86 54.53 1pms s ASN 491 Cb 0.00 -2.51 0.13 0.00 -0.55 0.00 0.00 41.25 38.32 1pms s ASN 491 CO 0.00 -2.27 0.28 -2.28 -2.79 0.00 0.00 177.10 170.04 1pms s HIS 492 N 9.47 3.11 0.00 0.43 2.46 -1.26 -4.98 115.29 124.52 1pms s HIS 492 Ca 0.94 -3.13 0.00 0.00 0.47 0.00 0.00 55.06 53.34 1pms s HIS 492 Cb -0.25 -2.73 0.00 0.00 -0.13 0.00 0.00 32.58 29.48 1pms s HIS 492 CO 0.31 -0.73 0.00 0.41 -2.47 0.00 0.00 174.74 172.26 1pms n GLY 493 N 3.03 -0.50 3.75 1.59 0.00 -1.26 -5.02 105.19 106.78 1pms n GLY 493 Ca 0.07 -2.24 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 1pms n GLY 493 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pms s GLN 494 N -0.33 3.15 0.54 1.61 -2.07 -1.26 -4.99 119.66 116.32 1pms s GLN 494 Ca 0.00 1.93 -0.16 0.00 -1.82 0.00 0.00 55.36 55.31 1pms s GLN 494 Cb 0.00 -2.10 -0.06 0.00 -1.09 0.00 0.00 33.01 29.76 1pms s GLN 494 CO 0.00 -1.09 1.01 -1.25 -1.32 0.00 0.00 175.29 172.64 1pms s PRO 495 N -3.10 3.74 -0.09 9.60 0.04 -1.26 -5.02 135.00 138.91 1pms s PRO 495 Ca 0.74 1.02 -0.04 0.00 0.04 0.00 0.00 61.00 62.75 1pms s PRO 495 Cb -0.33 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.08 1pms s PRO 495 CO 0.37 -0.45 0.16 0.00 0.04 0.00 0.00 177.00 177.13 1pms h ARG 496 N 0.70 -0.12 -6.17 4.56 3.08 -2.03 -3.46 114.38 110.95 1pms h ARG 496 Ca -0.47 0.01 -0.63 0.00 0.07 0.00 0.00 59.98 58.96 1pms h ARG 496 Cb 1.20 0.03 0.13 0.00 0.08 0.00 0.00 29.97 31.40 1pms h ARG 496 CO 0.60 -0.06 -0.46 1.47 -1.07 0.00 0.00 179.97 180.45 1pms n LEU 497 N -4.86 -0.71 -4.74 3.04 -0.00 -1.26 -4.88 117.00 103.59 1pms n LEU 497 Ca -0.02 1.02 -0.41 0.00 -0.00 0.00 0.00 56.01 56.60 1pms n LEU 497 Cb 0.06 -1.04 -0.05 0.00 -0.00 0.00 0.00 43.42 42.39 1pms n LEU 497 CO 0.05 -2.92 0.70 -2.16 -0.00 0.00 0.00 177.39 173.05 1pms s PRO 498 N -1.25 4.73 0.00 1.47 0.04 -1.26 -3.58 135.00 135.15 1pms s PRO 498 Ca 0.62 1.56 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1pms s PRO 498 Cb -0.75 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 30.50 1pms s PRO 498 CO 0.59 0.30 0.00 0.41 0.04 0.00 0.00 177.00 178.34 1pms n GLY 499 N 1.79 2.51 3.46 0.56 0.00 -1.26 -4.76 105.19 107.50 1pms n GLY 499 Ca 0.00 -0.62 -0.27 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.57 0.04 4.61 0.00 -1.24 -4.88 120.51 116.47 1pms n ALA 500 Ca 0.00 0.24 0.01 0.00 0.00 0.00 0.00 53.44 53.69 1pms n ALA 500 Cb 0.00 -1.93 -0.07 0.00 0.00 0.00 0.00 19.45 17.45 1pms n ALA 500 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pms n SER 501 N -1.10 0.87 -4.92 0.00 2.88 -1.26 -4.90 113.62 105.19 1pms n SER 501 Ca -0.12 0.38 -0.26 0.00 -1.33 0.00 0.00 58.87 57.53 1pms n SER 501 Cb 0.64 0.18 0.01 0.00 -0.75 0.00 0.00 64.21 64.29 1pms n SER 501 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1pms s SER 502 N -5.73 6.05 -0.29 -3.46 1.04 -1.26 -5.09 113.70 104.96 1pms s SER 502 Ca -0.03 0.73 -0.06 0.00 0.48 0.00 0.00 55.95 57.07 1pms s SER 502 Cb 0.09 -2.00 0.15 0.00 0.10 0.00 0.00 66.02 64.36 1pms s SER 502 CO 0.81 -0.67 0.61 0.00 0.98 0.00 0.00 173.24 174.96 1pms s ALA 503 N -2.72 -2.04 -0.11 5.32 0.00 -1.26 -5.14 121.76 115.81 1pms s ALA 503 Ca 0.48 2.06 -0.08 0.00 0.00 0.00 0.00 51.96 54.42 1pms s ALA 503 Cb -0.10 -1.89 0.04 0.00 0.00 0.00 0.00 23.12 21.16 1pms s ALA 503 CO 0.43 -1.08 0.28 -2.00 0.00 0.00 0.00 175.76 173.39 1pms s GLU 504 N 2.86 0.29 0.57 0.00 2.12 -1.26 -5.17 118.70 118.11 1pms s GLU 504 Ca 0.05 0.47 0.06 0.00 0.36 0.00 0.00 54.97 55.90 1pms s GLU 504 Cb -0.13 0.05 0.06 0.00 0.26 0.00 0.00 34.13 34.37 1pms s GLU 504 CO -0.19 -0.09 0.47 0.71 -0.54 0.00 0.00 175.26 175.62 1pms s TYR 505 N 0.61 1.44 0.00 5.30 2.02 -1.26 -4.44 117.35 121.02 1pms s TYR 505 Ca -0.04 -0.87 0.00 0.00 -0.37 0.00 0.00 57.07 55.79 1pms s TYR 505 Cb -0.05 -1.93 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 1pms s TYR 505 CO -0.04 -0.64 0.00 -2.13 -1.57 0.00 0.00 175.55 171.17 1pms n ARG 506 N -1.88 0.00 -1.48 -0.62 0.63 -1.26 -4.96 116.66 107.09 1pms n ARG 506 Ca 0.00 0.00 0.12 0.00 -0.92 0.00 0.00 57.85 57.06 1pms n ARG 506 Cb 0.64 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.48 1pms n ARG 506 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1pms n LEU 507 N -1.97 -1.20 0.00 6.15 4.77 -1.26 -4.97 117.00 118.52 1pms n LEU 507 Ca 0.00 2.51 0.00 0.00 -0.03 0.00 0.00 56.01 58.49 1pms n LEU 507 Cb 0.00 -3.10 0.00 0.00 -2.33 0.00 0.00 43.42 37.99 1pms n LEU 507 CO 0.00 -1.74 0.00 0.29 -1.33 0.00 0.00 177.39 174.61 1pms n LYS 508 N -3.87 0.00 -4.05 3.23 4.76 -1.09 -4.50 118.16 112.64 1pms n LYS 508 Ca -0.07 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.27 1pms n LYS 508 Cb 0.62 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.74 1pms n LYS 508 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1pms s GLU 509 N 0.27 1.31 -0.14 1.97 -1.05 -1.08 -4.99 118.70 114.99 1pms s GLU 509 Ca 0.00 -1.34 -0.11 0.00 -0.15 0.00 0.00 54.97 53.37 1pms s GLU 509 Cb 0.00 0.38 0.04 0.00 -0.44 0.00 0.00 34.13 34.11 1pms s GLU 509 CO 0.00 -0.49 0.37 -1.59 0.95 0.00 0.00 175.26 174.50 1pms s LYS 510 N -4.04 0.40 0.38 -4.83 -2.85 -1.26 -0.92 119.74 106.62 1pms s LYS 510 Ca 0.26 0.59 0.06 0.00 -1.00 0.00 0.00 55.97 55.88 1pms s LYS 510 Cb 0.03 0.12 -0.02 0.00 -2.06 0.00 0.00 37.83 35.89 1pms s LYS 510 CO 0.07 -0.09 0.21 -0.06 0.10 0.00 0.00 175.35 175.58 1pms s PHE 511 N 0.63 1.77 -0.06 1.78 0.40 -0.61 -5.01 117.98 116.88 1pms s PHE 511 Ca -0.04 -1.50 -0.05 0.00 -0.60 0.00 0.00 56.93 54.74 1pms s PHE 511 Cb -0.05 -0.93 -0.04 0.00 0.51 0.00 0.00 43.02 42.51 1pms s PHE 511 CO -0.04 -0.61 0.17 -0.06 0.70 0.00 0.00 175.22 175.38 1pms s PHE 512 N -3.30 3.58 -0.46 0.36 0.40 -1.26 -2.48 117.98 114.81 1pms s PHE 512 Ca 0.31 0.46 0.09 0.00 -0.60 0.00 0.00 56.93 57.19 1pms s PHE 512 Cb 0.02 -1.90 0.37 0.00 0.51 0.00 0.00 43.02 42.02 1pms s PHE 512 CO 0.21 0.69 0.91 -1.33 0.70 0.00 0.00 175.22 176.40 1pms n MET 513 N 1.46 2.32 0.00 0.44 2.81 -0.08 -4.67 117.12 119.40 1pms n MET 513 Ca -0.15 -4.16 0.00 0.00 -1.81 0.00 0.00 57.70 51.58 1pms n MET 513 Cb 0.54 -1.96 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 1pms n MET 513 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1pms n ARG 514 N -0.10 1.97 -0.78 0.03 0.00 -1.14 -3.71 116.66 112.93 1pms n ARG 514 Ca 0.28 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 58.09 1pms n ARG 514 Cb 0.57 -0.86 0.21 0.00 -0.00 0.00 0.00 32.46 32.37 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 -1.22 1.98 -4.40 2.89 0.00 -1.26 -4.99 118.16 111.16 1pms n LYS 515 Ca 0.00 -3.14 -0.21 0.00 -0.00 0.00 0.00 58.31 54.96 1pms n LYS 515 Cb 0.09 -1.84 -0.10 0.00 -0.00 0.00 0.00 35.03 33.19 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 -3.20 2.02 0.04 0.58 -7.23 -1.26 -3.96 120.40 107.39 1pms s VAL 516 Ca 0.45 -2.28 0.03 0.00 -1.81 0.00 0.00 61.98 58.37 1pms s VAL 516 Cb 0.40 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 35.14 1pms s VAL 516 CO 0.01 -0.50 -0.10 -1.10 -0.31 0.00 0.00 175.10 173.11 1pms s GLN 517 N -3.60 0.66 0.02 4.82 1.11 -1.24 -4.93 119.66 116.50 1pms s GLN 517 Ca 0.26 -0.71 -0.20 0.00 0.01 0.00 0.00 55.36 54.72 1pms s GLN 517 Cb -0.02 -0.55 -0.06 0.00 -1.01 0.00 0.00 33.01 31.37 1pms s GLN 517 CO 0.10 0.12 0.58 -1.50 0.01 0.00 0.00 175.29 174.60 1pms s ILE 518 N -1.05 4.87 -0.44 1.08 2.07 -1.26 -2.60 121.20 123.87 1pms s ILE 518 Ca -0.04 1.21 0.02 0.00 -1.41 0.00 0.00 60.65 60.43 1pms s ILE 518 Cb -0.08 -3.91 0.12 0.00 0.13 0.00 0.00 42.46 38.72 1pms s ILE 518 CO 0.01 0.46 0.18 0.20 -1.91 0.00 0.00 174.94 173.88 1pms s ASN 519 N -0.47 4.76 -1.37 4.50 0.01 -0.58 -4.92 114.94 116.87 1pms s ASN 519 Ca 0.30 -2.48 -0.10 0.00 -0.71 0.00 0.00 52.86 49.87 1pms s ASN 519 Cb -0.18 -1.69 0.10 0.00 0.41 0.00 0.00 41.25 39.88 1pms s ASN 519 CO 0.17 -0.36 2.19 -0.67 -1.51 0.00 0.00 177.10 176.92 1pms n ASP 520 N 3.86 5.84 -4.25 -1.22 2.03 -1.26 -2.78 116.55 118.78 1pms n ASP 520 Ca 0.04 -2.99 -0.43 0.00 0.52 0.00 0.00 54.79 51.92 1pms n ASP 520 Cb 0.38 -1.50 -0.06 0.00 -0.72 0.00 0.00 41.12 39.22 1pms n ASP 520 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1pms s LYS 521 N 0.90 2.82 -0.22 -0.67 2.20 -1.26 -4.83 119.74 118.68 1pms s LYS 521 Ca 0.48 -1.93 -0.20 0.00 -0.36 0.00 0.00 55.97 53.96 1pms s LYS 521 Cb 0.13 -4.11 0.03 0.00 -1.51 0.00 0.00 37.83 32.38 1pms s LYS 521 CO -0.04 -1.25 0.33 -0.25 -0.36 0.00 0.00 175.35 173.78 1pms n ASP 522 N 4.74 -2.83 0.22 1.43 8.00 -1.26 -4.77 116.55 122.08 1pms n ASP 522 Ca -0.05 -0.08 0.06 0.00 0.71 0.00 0.00 54.79 55.43 1pms n ASP 522 Cb 0.41 -0.82 0.49 0.00 -0.02 0.00 0.00 41.12 41.19 1pms n ASP 522 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 1pms h ASP 523 N 1.13 0.00 -3.63 -2.24 1.82 -1.86 -3.42 116.42 108.21 1pms h ASP 523 Ca -0.29 0.00 -0.32 0.00 -0.39 0.00 0.00 57.03 56.03 1pms h ASP 523 Cb 0.72 0.00 -0.32 0.00 0.68 0.00 0.00 39.33 40.42 1pms h ASP 523 CO 0.11 0.24 -0.75 0.42 -1.61 0.00 0.00 179.24 177.66 1pms s THR 524 N -4.37 0.22 0.62 2.25 -4.23 -1.17 -4.95 115.64 104.02 1pms s THR 524 Ca -0.03 -0.02 0.25 0.00 -1.18 0.00 0.00 61.69 60.71 1pms s THR 524 Cb 0.15 -0.26 0.32 0.00 1.34 0.00 0.00 72.50 74.05 1pms s THR 524 CO 0.68 0.12 1.62 -1.28 -0.54 0.00 0.00 174.62 175.23 1pms h SER 525 N 6.76 0.00 0.04 3.99 0.87 -1.99 0.32 113.55 123.54 1pms h SER 525 Ca -0.36 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1pms h SER 525 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 1pms h SER 525 CO 0.49 0.00 -0.02 -0.33 -0.53 0.00 0.00 176.83 176.44 1pms h GLU 526 N 0.00 -0.05 0.00 2.24 5.08 -1.96 -3.50 114.58 116.39 1pms h GLU 526 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1pms h GLU 526 Cb 1.68 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.94 1pms h GLU 526 CO -0.00 0.39 0.00 0.98 -1.00 0.00 0.00 179.01 179.38 1pms n TYR 527 N -4.90 0.00 -1.75 4.33 4.19 0.11 -5.12 117.16 114.02 1pms n TYR 527 Ca -0.08 0.00 -0.41 0.00 3.31 0.00 0.00 57.90 60.71 1pms n TYR 527 Cb 0.24 0.00 -0.00 0.00 0.49 0.00 0.00 39.34 40.07 1pms n TYR 527 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 1pms n LYS 528 N 0.00 2.55 0.00 2.98 5.02 -1.26 -3.01 118.16 124.43 1pms n LYS 528 Ca 0.00 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 57.18 1pms n LYS 528 Cb 0.00 -2.59 0.00 0.00 -0.02 0.00 0.00 35.03 32.42 1pms n LYS 528 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1pms n HIS 529 N 0.54 -0.39 -1.96 2.13 -0.00 -1.26 -4.89 115.22 109.38 1pms n HIS 529 Ca 0.03 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.21 1pms n HIS 529 Cb 0.38 0.29 0.00 0.00 -0.12 0.00 0.00 29.99 30.54 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 -2.09 0.00 -3.66 1.57 0.00 -1.26 -4.50 120.51 110.57 1pms n ALA 530 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1pms n ALA 530 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 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 -1.08 -0.43 -0.47 0.00 0.40 -1.15 -4.77 117.98 110.47 1pms s PHE 531 Ca 0.00 0.98 -0.12 0.00 -0.60 0.00 0.00 56.93 57.18 1pms s PHE 531 Cb 0.00 0.14 0.10 0.00 0.51 0.00 0.00 43.02 43.77 1pms s PHE 531 CO 0.00 -0.27 0.37 -1.21 0.70 0.00 0.00 175.22 174.82 1pms s GLU 532 N 1.19 2.77 0.48 0.44 2.02 -1.12 -2.95 118.70 121.53 1pms s GLU 532 Ca -0.08 -1.56 -0.04 0.00 0.02 0.00 0.00 54.97 53.31 1pms s GLU 532 Cb -0.09 -4.03 -0.03 0.00 0.10 0.00 0.00 34.13 30.08 1pms s GLU 532 CO -0.09 -1.12 0.76 0.42 0.02 0.00 0.00 175.26 175.25 1pms s ILE 533 N 1.51 4.72 0.03 -1.63 1.09 -0.26 -1.52 121.20 125.14 1pms s ILE 533 Ca 0.04 0.05 0.00 0.00 -1.10 0.00 0.00 60.65 59.64 1pms s ILE 533 Cb -0.26 -3.79 -0.02 0.00 -1.06 0.00 0.00 42.46 37.33 1pms s ILE 533 CO 0.03 -0.74 -0.04 -0.63 -0.10 0.00 0.00 174.94 173.46 1pms s ILE 534 N -2.71 0.20 0.48 2.92 1.09 -1.07 0.05 121.20 122.16 1pms s ILE 534 Ca 0.47 -0.98 -0.03 0.00 -1.10 0.00 0.00 60.65 59.01 1pms s ILE 534 Cb -0.10 -0.38 -0.02 0.00 -1.06 0.00 0.00 42.46 40.90 1pms s ILE 534 CO 0.43 -0.50 0.75 -0.76 -0.10 0.00 0.00 174.94 174.77 1pms s LEU 535 N -1.55 3.60 -0.18 2.97 1.43 -0.70 -3.59 118.68 120.66 1pms s LEU 535 Ca -0.14 0.66 0.16 0.00 -1.03 0.00 0.00 54.13 53.78 1pms s LEU 535 Cb -0.09 -3.55 0.77 0.00 0.03 0.00 0.00 46.19 43.35 1pms s LEU 535 CO -0.01 -0.68 1.69 2.29 0.23 0.00 0.00 176.35 179.87 1pms n LYS 536 N -2.22 4.39 -0.08 1.70 2.85 -1.25 -4.34 118.16 119.21 1pms n LYS 536 Ca 0.01 -3.00 -0.16 0.00 -1.05 0.00 0.00 58.31 54.11 1pms n LYS 536 Cb 0.56 -2.11 -0.05 0.00 -0.65 0.00 0.00 35.03 32.78 1pms n LYS 536 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1pms n ASP 537 N 0.83 1.26 0.00 -5.58 2.03 -1.26 -5.01 116.55 108.82 1pms n ASP 537 Ca 0.27 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.79 1pms n ASP 537 Cb 1.06 -0.51 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 2.00 0.00 2.56 0.27 0.00 -1.26 -5.17 105.19 103.59 1pms n GLY 538 Ca -0.29 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.56 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 0.31 -3.72 1.61 5.03 -1.26 -5.03 115.26 112.20 1pms n ASN 539 Ca 0.00 -2.70 -0.13 0.00 0.87 0.00 0.00 54.58 52.62 1pms n ASN 539 Cb 0.00 1.05 -0.13 0.00 -1.02 0.00 0.00 39.78 39.68 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 -2.89 -0.13 -0.95 6.41 1.04 -1.26 -1.71 113.70 114.22 1pms s SER 540 Ca 0.24 0.51 -0.12 0.00 0.48 0.00 0.00 55.95 57.05 1pms s SER 540 Cb 0.01 0.42 0.24 0.00 0.10 0.00 0.00 66.02 66.79 1pms s SER 540 CO 0.17 -0.18 0.93 -0.69 0.98 0.00 0.00 173.24 174.45 1pms s VAL 541 N 1.46 5.72 -0.20 5.02 1.01 0.11 -4.91 120.40 128.59 1pms s VAL 541 Ca -0.07 -2.80 -0.06 0.00 0.00 0.00 0.00 61.98 59.05 1pms s VAL 541 Cb -0.11 -4.54 -0.03 0.00 0.00 0.00 0.00 36.38 31.70 1pms s VAL 541 CO -0.08 -1.12 0.01 -0.63 0.00 0.00 0.00 175.10 173.28 1pms s ILE 542 N -0.24 4.08 0.32 2.22 -1.09 -1.26 -1.10 121.20 124.12 1pms s ILE 542 Ca 0.24 -0.27 0.05 0.00 -2.23 0.00 0.00 60.65 58.44 1pms s ILE 542 Cb -0.10 -2.85 -0.02 0.00 -1.58 0.00 0.00 42.46 37.92 1pms s ILE 542 CO -0.08 0.42 0.17 2.22 -1.23 0.00 0.00 174.94 176.44 1pms n PHE 543 N 4.24 -0.22 -3.68 3.97 -1.74 -1.15 -2.60 117.46 116.28 1pms n PHE 543 Ca -0.17 -2.28 -0.10 0.00 -0.56 0.00 0.00 57.45 54.34 1pms n PHE 543 Cb 0.52 0.10 -0.11 0.00 1.52 0.00 0.00 39.48 41.51 1pms n PHE 543 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1pms s SER 544 N -3.06 -0.39 0.33 5.98 1.04 -0.31 -2.92 113.70 114.37 1pms s SER 544 Ca 0.24 0.90 -0.26 0.00 0.48 0.00 0.00 55.95 57.31 1pms s SER 544 Cb 0.01 0.92 -0.09 0.00 0.10 0.00 0.00 66.02 66.96 1pms s SER 544 CO 0.17 -0.21 1.00 0.00 0.98 0.00 0.00 173.24 175.19 1pms s ALA 545 N 1.80 3.21 -0.12 5.32 0.00 -1.26 -1.07 121.76 129.64 1pms s ALA 545 Ca -0.07 0.65 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 1pms s ALA 545 Cb -0.10 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1pms s ALA 545 CO -0.12 -0.00 2.58 1.63 0.00 0.00 0.00 175.76 179.84 1pms n LYS 546 N 0.53 1.63 -2.76 0.00 4.76 -1.26 -4.62 118.16 116.44 1pms n LYS 546 Ca 0.02 -0.91 0.01 0.00 -2.87 0.00 0.00 58.31 54.56 1pms n LYS 546 Cb 0.49 -1.56 0.01 0.00 -1.84 0.00 0.00 35.03 32.12 1pms n LYS 546 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1pms n SER 547 N 1.48 -0.60 -0.09 4.39 7.64 -1.26 -5.00 113.62 120.17 1pms n SER 547 Ca 0.25 -1.18 -0.15 0.00 1.01 0.00 0.00 58.87 58.80 1pms n SER 547 Cb 0.64 0.94 -0.07 0.00 -1.01 0.00 0.00 64.21 64.71 1pms n SER 547 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pms n ALA 548 N -2.05 0.66 -0.24 -0.43 0.00 -1.26 -3.39 120.51 113.80 1pms n ALA 548 Ca -0.05 -0.49 -0.08 0.00 0.00 0.00 0.00 53.44 52.82 1pms n ALA 548 Cb 0.26 -0.27 0.04 0.00 0.00 0.00 0.00 19.45 19.48 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 -1.00 1.12 -0.40 0.00 4.39 -1.98 -2.46 114.58 114.24 1pms h GLU 549 Ca -0.21 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 59.18 1pms h GLU 549 Cb 0.97 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 1pms h GLU 549 CO -0.13 1.02 0.17 0.93 -1.16 0.00 0.00 179.01 179.85 1pms h GLU 550 N 1.04 0.56 0.23 2.33 5.08 -1.95 0.24 114.58 122.13 1pms h GLU 550 Ca 0.21 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1pms h GLU 550 Cb 0.44 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1pms h GLU 550 CO 0.01 0.46 -0.11 0.87 -1.00 0.00 0.00 179.01 179.24 1pms h LYS 551 N 0.56 -0.30 0.00 2.33 1.57 -1.46 -2.13 116.57 117.14 1pms h LYS 551 Ca 0.14 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1pms h LYS 551 Cb 0.09 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1pms h LYS 551 CO -0.02 -0.08 0.00 0.09 -0.57 0.00 0.00 179.45 178.88 1pms n ASN 552 N -5.15 0.00 0.12 0.86 4.13 -1.04 -2.98 115.26 111.21 1pms n ASN 552 Ca -0.09 0.39 -0.05 0.00 1.68 0.00 0.00 54.58 56.50 1pms n ASN 552 Cb 0.20 -0.45 -0.03 0.00 -1.54 0.00 0.00 39.78 37.96 1pms n ASN 552 CO 0.00 0.00 0.00 -1.13 0.28 0.00 0.00 177.26 176.41 1pms h ASN 553 N 0.00 -0.30 -0.43 6.41 -0.73 0.16 -1.51 115.58 119.18 1pms h ASN 553 Ca 0.00 0.01 -0.05 0.00 1.87 0.00 0.00 56.30 58.13 1pms h ASN 553 Cb 0.32 0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.97 1pms h ASN 553 CO 0.00 -0.01 0.10 -0.50 -0.37 0.00 0.00 177.43 176.65 1pms h TRP 554 N -0.77 0.80 -0.59 0.67 4.06 -1.61 -1.40 115.95 117.11 1pms h TRP 554 Ca -0.04 -0.08 -0.05 0.00 2.06 0.00 0.00 58.89 60.79 1pms h TRP 554 Cb 0.27 -0.23 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 1pms h TRP 554 CO 0.03 0.69 0.18 1.98 -3.56 0.00 0.00 178.44 177.76 1pms h MET 555 N 0.74 0.90 0.03 0.49 1.85 -1.63 -2.76 114.93 114.55 1pms h MET 555 Ca 0.16 -0.17 -0.24 0.00 -0.61 0.00 0.00 59.70 58.84 1pms h MET 555 Cb 0.31 -0.14 0.01 0.00 0.43 0.00 0.00 31.60 32.21 1pms h MET 555 CO 0.00 0.78 -1.02 0.00 -0.40 0.00 0.00 176.91 176.27 1pms h ALA 556 N 1.33 0.28 0.00 0.39 0.00 -0.75 -3.05 119.26 117.46 1pms h ALA 556 Ca 0.20 -0.74 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 1pms h ALA 556 Cb 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1pms h ALA 556 CO -0.01 0.82 -0.02 0.00 0.00 0.00 0.00 179.25 180.04 1pms h ALA 557 N 0.65 1.14 0.01 0.00 0.00 -1.04 0.45 119.26 120.48 1pms h ALA 557 Ca -0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1pms h ALA 557 Cb 1.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1pms h ALA 557 CO 0.18 0.02 -0.01 -0.07 0.00 0.00 0.00 179.25 179.37 1pms h LEU 558 N 0.00 -0.01 0.00 0.00 3.38 -1.39 -2.97 115.31 114.32 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 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1pms h LEU 558 CO 0.00 0.18 0.00 -0.38 0.09 0.00 0.00 178.44 178.33 1pms n ILE 559 N -3.09 1.16 0.14 1.22 -0.00 -1.19 -1.61 119.36 116.00 1pms n ILE 559 Ca -0.00 0.29 -0.25 0.00 -0.00 0.00 0.00 62.75 62.79 1pms n ILE 559 Cb 0.01 -1.12 -0.16 0.00 -0.00 0.00 0.00 39.64 38.37 1pms n ILE 559 CO 0.00 0.00 0.00 -1.28 -0.00 0.00 0.00 176.55 175.27 1pms h SER 560 N 0.00 0.83 0.54 4.38 0.87 -0.17 -3.28 113.55 116.73 1pms h SER 560 Ca 0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 61.79 59.64 1pms h SER 560 Cb 0.15 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1pms h SER 560 CO 0.00 1.72 -0.45 0.18 -0.53 0.00 0.00 176.83 177.75 1pms n LEU 561 N -3.71 0.46 -0.05 2.23 7.99 -0.86 -4.03 117.00 119.02 1pms n LEU 561 Ca -0.18 0.04 -0.12 0.00 -0.01 0.00 0.00 56.01 55.75 1pms n LEU 561 Cb 1.11 -0.27 -0.06 0.00 -0.11 0.00 0.00 43.42 44.09 1pms n LEU 561 CO 0.60 0.11 0.74 -0.61 -1.51 0.00 0.00 177.39 176.73 1pms h GLN 562 N 0.01 0.29 0.08 3.23 5.75 -1.36 0.13 115.11 123.24 1pms h GLN 562 Ca 0.00 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 58.40 1pms h GLN 562 Cb 0.50 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1pms h GLN 562 CO 0.00 0.51 -0.04 0.10 -2.65 0.00 0.00 178.83 176.75 1pms h TYR 563 N 0.03 -0.10 0.11 3.99 -0.00 -1.71 -3.34 116.97 115.95 1pms h TYR 563 Ca 0.05 -0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.77 1pms h TYR 563 Cb 0.38 0.03 0.00 0.00 0.00 0.00 0.00 36.73 37.15 1pms h TYR 563 CO 0.04 0.29 -0.05 0.07 -0.00 0.00 0.00 178.16 178.50 1pms h ARG 564 N -0.51 -0.14 0.00 0.10 0.11 -1.70 -3.53 114.38 108.71 1pms h ARG 564 Ca -0.01 0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1pms h ARG 564 Cb 0.43 0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1pms h ARG 564 CO 0.02 -0.09 0.00 0.43 0.10 0.00 0.00 179.97 180.42