#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 2.26 -0.57 1.43 4.81 -1.26 -4.54 118.16 120.29 1pms n LYS 432 Ca 0.00 -2.01 -0.10 0.00 -0.87 0.00 0.00 58.31 55.33 1pms n LYS 432 Cb 0.00 -2.05 0.10 0.00 0.02 0.00 0.00 35.03 33.09 1pms n LYS 432 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1pms n GLN 433 N 1.10 1.71 -0.23 1.64 6.02 -1.26 -4.39 117.38 121.97 1pms n GLN 433 Ca 0.45 -1.44 0.10 0.00 -0.01 0.00 0.00 57.00 56.11 1pms n GLN 433 Cb 0.62 -1.59 0.38 0.00 1.02 0.00 0.00 30.24 30.67 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 1.08 0.63 -0.18 1.08 3.38 -2.00 0.54 115.31 119.85 1pms h LEU 434 Ca 0.28 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.11 1pms h LEU 434 Cb 1.83 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.45 1pms h LEU 434 CO 0.50 0.36 -0.76 0.00 0.09 0.00 0.00 178.44 178.63 1pms h ALA 435 N 1.60 0.57 -0.00 1.53 0.00 -1.99 -2.99 119.26 117.99 1pms h ALA 435 Ca 0.39 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1pms h ALA 435 Cb 0.55 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1pms h ALA 435 CO -0.15 0.95 -0.13 -0.89 0.00 0.00 0.00 179.25 179.03 1pms n ILE 436 N -3.39 0.00 0.15 0.00 2.08 0.58 -3.13 119.36 115.65 1pms n ILE 436 Ca 0.00 -0.00 0.05 0.00 0.56 0.00 0.00 62.75 63.36 1pms n ILE 436 Cb 0.81 -0.29 0.05 0.00 -0.75 0.00 0.00 39.64 39.45 1pms n ILE 436 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1pms h LYS 437 N 0.02 0.00 0.31 0.38 3.11 0.08 -3.31 116.57 117.15 1pms h LYS 437 Ca 0.00 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 1pms h LYS 437 Cb 0.49 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.72 1pms h LYS 437 CO 0.00 0.36 -0.15 0.87 -2.81 0.00 0.00 179.45 177.72 1pms h LYS 438 N 0.00 -0.40 -1.17 1.90 1.57 -1.61 -2.49 116.57 114.37 1pms h LYS 438 Ca -0.01 0.03 0.40 0.00 -1.87 0.00 0.00 60.65 59.19 1pms h LYS 438 Cb 1.30 0.09 -0.14 0.00 0.08 0.00 0.00 32.23 33.56 1pms h LYS 438 CO 0.05 -0.16 0.72 0.52 -0.57 0.00 0.00 179.45 180.00 1pms h MET 439 N -0.57 0.13 0.82 3.15 2.86 -1.73 0.27 114.93 119.86 1pms h MET 439 Ca -0.04 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1pms h MET 439 Cb 0.42 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1pms h MET 439 CO 0.07 0.08 -0.42 -0.97 1.06 0.00 0.00 176.91 176.73 1pms h ASN 440 N 0.13 -1.02 0.34 1.22 -0.73 -1.59 -0.25 115.58 113.67 1pms h ASN 440 Ca 0.80 0.04 0.00 0.00 1.87 0.00 0.00 56.30 59.01 1pms h ASN 440 Cb 2.27 0.28 0.00 0.00 0.27 0.00 0.00 38.32 41.14 1pms h ASN 440 CO -0.53 -0.70 0.00 1.21 -0.37 0.00 0.00 177.43 177.05 1pms n GLU 441 N -5.59 0.01 0.06 6.67 0.00 0.64 -2.03 120.64 120.40 1pms n GLU 441 Ca -0.15 0.31 -0.15 0.00 0.00 0.00 0.00 57.16 57.17 1pms n GLU 441 Cb 0.46 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.26 1pms n GLU 441 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1pms h ILE 442 N 0.00 1.22 0.00 6.31 2.04 0.75 -1.59 117.51 126.23 1pms h ILE 442 Ca 0.00 -2.88 0.00 0.00 1.00 0.00 0.00 64.86 62.98 1pms h ILE 442 Cb 0.17 2.76 0.00 0.00 -0.74 0.00 0.00 36.82 39.00 1pms h ILE 442 CO 0.00 0.81 -0.16 1.67 0.00 0.00 0.00 178.15 180.47 1pms n GLN 443 N -3.42 0.13 -0.08 2.37 7.27 -0.24 -3.67 117.38 119.75 1pms n GLN 443 Ca -0.14 0.08 -0.22 0.00 0.07 0.00 0.00 57.00 56.80 1pms n GLN 443 Cb 1.03 -1.63 -0.12 0.00 2.41 0.00 0.00 30.24 31.93 1pms n GLN 443 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1pms n LYS 444 N -1.85 0.67 0.04 3.69 3.00 -1.05 -0.83 118.16 121.83 1pms n LYS 444 Ca 0.06 0.28 0.04 0.00 -0.00 0.00 0.00 58.31 58.68 1pms n LYS 444 Cb 0.38 -1.62 0.19 0.00 0.00 0.00 0.00 35.03 33.99 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 -3.67 0.15 -0.17 3.14 5.15 -0.60 -2.66 115.26 116.60 1pms n ASN 445 Ca -0.40 0.56 0.00 0.00 -0.60 0.00 0.00 54.58 54.14 1pms n ASN 445 Cb 0.95 -0.58 0.00 0.00 -0.53 0.00 0.00 39.78 39.62 1pms n ASN 445 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1pms n ILE 446 N -1.69 0.00 0.00 -1.44 -5.35 -1.24 -5.06 119.36 104.58 1pms n ILE 446 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1pms n ILE 446 Cb 0.05 0.56 0.00 0.00 -1.74 0.00 0.00 39.64 38.51 1pms n ILE 446 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1pms n ASP 447 N 0.00 0.00 0.00 7.28 8.00 -0.01 -3.27 116.55 128.55 1pms n ASP 447 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1pms n ASP 447 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1pms n ASP 447 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pms n GLY 448 N 0.00 -1.93 0.00 0.44 0.00 -1.26 -4.54 105.19 97.90 1pms n GLY 448 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 46.02 46.98 1pms n GLY 448 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1pms n TRP 449 N 0.00 -0.01 -3.77 1.61 4.27 -1.20 -4.61 117.44 113.72 1pms n TRP 449 Ca 0.00 0.00 -0.30 0.00 -3.89 0.00 0.00 57.50 53.31 1pms n TRP 449 Cb 0.00 0.00 -0.13 0.00 -1.36 0.00 0.00 31.31 29.82 1pms n TRP 449 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 1pms s GLU 450 N -0.21 1.50 0.10 -2.67 2.02 -1.26 -4.55 118.70 113.63 1pms s GLU 450 Ca 0.00 -2.22 0.00 0.00 0.02 0.00 0.00 54.97 52.77 1pms s GLU 450 Cb 0.00 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.62 1pms s GLU 450 CO 0.00 -1.16 0.00 0.41 0.02 0.00 0.00 175.26 174.53 1pms n GLY 451 N 3.36 -1.78 2.71 -1.39 0.00 -1.26 -4.85 105.19 101.98 1pms n GLY 451 Ca 0.08 0.57 -0.30 0.00 0.00 0.00 0.00 46.02 46.38 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 -2.60 3.48 0.00 1.61 3.00 -1.26 -4.16 118.16 118.23 1pms n LYS 452 Ca 0.00 -4.56 0.00 0.00 -0.00 0.00 0.00 58.31 53.75 1pms n LYS 452 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 35.03 32.76 1pms n LYS 452 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1pms n ASP 453 N -0.36 -0.71 -3.14 3.14 9.92 -1.26 -4.68 116.55 119.46 1pms n ASP 453 Ca 0.38 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.45 1pms n ASP 453 Cb 0.48 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.92 1pms n ASP 453 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1pms n ILE 454 N -1.70 -0.34 -0.24 0.53 5.41 -1.26 -1.59 119.36 120.17 1pms n ILE 454 Ca 0.00 -4.04 0.00 0.00 1.00 0.00 0.00 62.75 59.71 1pms n ILE 454 Cb 0.00 -0.69 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 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 0.76 1.51 0.26 7.39 0.00 -1.26 -4.53 105.19 109.31 1pms n GLY 455 Ca 0.22 -1.65 -0.08 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.28 0.00 1.61 4.15 -1.85 0.34 115.11 119.08 1pms h GLN 456 Ca 0.00 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1pms h GLN 456 Cb 0.00 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.75 1pms h GLN 456 CO 0.00 -0.19 0.00 0.00 -1.93 0.00 0.00 178.83 176.71 1pms n ASN 459 N -1.18 0.00 -0.07 0.00 5.15 -0.62 -4.35 115.26 114.19 1pms n ASN 459 Ca -0.02 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.96 1pms n ASN 459 Cb 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.76 1pms n ASN 459 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1pms n GLU 460 N 0.00 0.00 0.00 1.20 0.00 -1.26 -4.75 120.64 115.83 1pms n GLU 460 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1pms n GLU 460 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1pms n GLU 460 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.13 179.10 1pms n PHE 461 N 0.00 0.00 0.00 -1.84 -1.74 -1.26 -4.67 117.46 107.95 1pms n PHE 461 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1pms n PHE 461 Cb 0.09 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.09 1pms n PHE 461 CO 0.00 0.00 0.00 -0.89 -0.56 0.00 0.00 176.76 175.31 1pms n ILE 462 N 0.00 0.00 -3.69 1.97 2.08 -1.26 -4.44 119.36 114.02 1pms n ILE 462 Ca 0.00 0.00 -0.28 0.00 0.56 0.00 0.00 62.75 63.03 1pms n ILE 462 Cb 0.00 0.00 -0.16 0.00 -0.75 0.00 0.00 39.64 38.73 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 0.55 -0.29 0.38 -1.94 -1.01 -4.75 119.30 112.24 1pms s MET 463 Ca 0.00 -0.56 -0.01 0.00 -1.71 0.00 0.00 55.69 53.41 1pms s MET 463 Cb 0.00 -1.92 0.13 0.00 2.01 0.00 0.00 34.83 35.06 1pms s MET 463 CO 0.00 -0.78 0.28 -1.21 -0.01 0.00 0.00 175.02 173.30 1pms s GLU 464 N 1.86 0.33 0.00 2.03 0.41 -1.26 -1.36 118.70 120.70 1pms s GLU 464 Ca 0.03 -0.22 0.00 0.00 -0.41 0.00 0.00 54.97 54.37 1pms s GLU 464 Cb -0.17 -0.71 0.00 0.00 -1.78 0.00 0.00 34.13 31.47 1pms s GLU 464 CO -0.16 -1.04 0.00 0.41 -0.49 0.00 0.00 175.26 173.98 1pms n GLY 465 N 5.24 -1.23 3.11 -1.39 0.00 -1.16 -4.71 105.19 105.05 1pms n GLY 465 Ca -0.02 0.68 -0.13 0.00 0.00 0.00 0.00 46.02 46.56 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 -0.01 0.00 2.61 -4.23 -1.26 -2.93 115.64 109.82 1pms s THR 466 Ca 0.00 0.04 -0.16 0.00 -1.18 0.00 0.00 61.69 60.39 1pms s THR 466 Cb 0.00 -0.35 0.03 0.00 1.34 0.00 0.00 72.50 73.51 1pms s THR 466 CO 0.00 0.02 0.34 -0.22 -0.54 0.00 0.00 174.62 174.21 1pms s LEU 467 N 0.42 0.75 0.48 4.79 1.98 -1.06 -4.54 118.68 121.51 1pms s LEU 467 Ca -0.02 0.04 0.07 0.00 -2.89 0.00 0.00 54.13 51.33 1pms s LEU 467 Cb -0.04 1.39 0.01 0.00 0.66 0.00 0.00 46.19 48.22 1pms s LEU 467 CO -0.02 -0.52 0.43 0.28 -1.89 0.00 0.00 176.35 174.63 1pms s THR 468 N -1.73 2.21 -0.84 3.68 -1.32 -0.16 -2.45 115.64 115.04 1pms s THR 468 Ca -0.11 -1.37 0.00 0.00 -1.21 0.00 0.00 61.69 59.01 1pms s THR 468 Cb -0.03 -2.58 0.34 0.00 -1.51 0.00 0.00 72.50 68.72 1pms s THR 468 CO 0.02 0.00 1.66 -1.14 -2.21 0.00 0.00 174.62 172.95 1pms n ARG 469 N -1.70 4.08 -0.33 7.08 3.00 -1.26 -1.11 116.66 126.42 1pms n ARG 469 Ca 0.03 -4.35 0.02 0.00 -0.00 0.00 0.00 57.85 53.55 1pms n ARG 469 Cb 0.63 -2.35 -0.01 0.00 0.00 0.00 0.00 32.46 30.73 1pms n ARG 469 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1pms n VAL 470 N -0.28 -0.39 0.00 5.15 0.31 -1.18 -4.81 118.33 117.14 1pms n VAL 470 Ca 0.45 0.25 0.00 0.00 -0.01 0.00 0.00 64.34 65.04 1pms n VAL 470 Cb 0.32 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 32.84 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 -2.19 1.96 7.00 2.92 0.00 -1.26 -4.87 105.19 108.75 1pms n GLY 471 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 0.00 -0.49 4.61 0.00 -1.26 -4.92 120.51 118.44 1pms n ALA 472 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1pms n ALA 472 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 0.00 0.00 -1.26 -4.70 118.16 112.20 1pms n LYS 473 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 1pms n LYS 473 Cb 0.00 -2.10 0.00 0.00 0.00 0.00 0.00 35.03 32.93 1pms n LYS 473 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 1pms n HIS 474 N -2.00 0.00 -0.25 5.64 -0.00 -1.26 -5.17 115.22 112.18 1pms n HIS 474 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1pms n HIS 474 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1pms n HIS 474 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1pms n GLU 475 N 0.00 0.72 -4.05 1.57 0.28 -1.26 -4.95 120.64 112.94 1pms n GLU 475 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.92 1pms n GLU 475 Cb 0.00 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 32.78 1pms n GLU 475 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 1pms s ARG 476 N -0.77 0.76 0.76 3.44 3.03 -1.02 -4.96 118.95 120.18 1pms s ARG 476 Ca 0.00 -1.22 -0.15 0.00 2.03 0.00 0.00 55.73 56.39 1pms s ARG 476 Cb 0.00 0.25 0.00 0.00 -1.03 0.00 0.00 34.95 34.18 1pms s ARG 476 CO 0.00 -0.19 0.77 0.72 -1.13 0.00 0.00 175.30 175.47 1pms n HIS 477 N 0.01 -0.04 -3.79 5.89 8.25 -0.23 -2.56 115.22 122.76 1pms n HIS 477 Ca -0.12 0.36 -0.13 0.00 -0.26 0.00 0.00 57.72 57.58 1pms n HIS 477 Cb 0.62 -1.99 -0.11 0.00 1.12 0.00 0.00 29.99 29.64 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 -1.97 0.02 -0.30 1.59 -1.09 -1.15 -1.41 121.20 116.89 1pms s ILE 478 Ca 0.68 -0.19 -0.03 0.00 -2.23 0.00 0.00 60.65 58.88 1pms s ILE 478 Cb -0.32 -0.45 0.10 0.00 -1.58 0.00 0.00 42.46 40.21 1pms s ILE 478 CO 0.55 -0.11 0.13 -0.36 -1.23 0.00 0.00 174.94 173.93 1pms s PHE 479 N -0.38 0.69 -0.24 3.97 0.08 -0.73 -3.00 117.98 118.39 1pms s PHE 479 Ca -0.05 -1.17 0.02 0.00 0.12 0.00 0.00 56.93 55.85 1pms s PHE 479 Cb -0.03 -1.10 0.05 0.00 -0.57 0.00 0.00 43.02 41.37 1pms s PHE 479 CO 0.01 -0.84 -0.14 -1.17 -0.10 0.00 0.00 175.22 172.99 1pms s LEU 480 N 1.86 3.04 0.13 -0.37 0.20 -0.47 0.18 118.68 123.25 1pms s LEU 480 Ca 0.10 -1.17 -0.16 0.00 0.69 0.00 0.00 54.13 53.59 1pms s LEU 480 Cb -0.17 -1.52 -0.07 0.00 -0.43 0.00 0.00 46.19 43.99 1pms s LEU 480 CO -0.30 -0.13 0.56 -0.36 -0.29 0.00 0.00 176.35 175.83 1pms s PHE 481 N 1.16 3.67 0.13 5.38 0.08 0.28 -2.39 117.98 126.28 1pms s PHE 481 Ca -0.05 1.14 0.06 0.00 0.12 0.00 0.00 56.93 58.21 1pms s PHE 481 Cb -0.18 -2.42 0.45 0.00 -0.57 0.00 0.00 43.02 40.30 1pms s PHE 481 CO -0.07 0.47 0.56 -0.40 -0.10 0.00 0.00 175.22 175.68 1pms n ASP 482 N 1.07 0.10 -0.09 1.36 5.75 -1.26 0.05 116.55 123.52 1pms n ASP 482 Ca -0.07 0.59 -0.11 0.00 -0.01 0.00 0.00 54.79 55.19 1pms n ASP 482 Cb 0.51 -0.28 -0.11 0.00 -1.03 0.00 0.00 41.12 40.22 1pms n ASP 482 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pms n GLY 483 N -1.11 -0.53 3.92 6.12 0.00 -1.26 -4.55 105.19 107.78 1pms n GLY 483 Ca 0.13 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 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 -5.73 4.21 0.03 0.99 1.98 0.11 -0.81 118.68 119.46 1pms s LEU 484 Ca -0.18 0.06 0.06 0.00 -2.89 0.00 0.00 54.13 51.18 1pms s LEU 484 Cb 0.06 -2.78 -0.02 0.00 0.66 0.00 0.00 46.19 44.11 1pms s LEU 484 CO 0.56 0.01 -0.17 -0.32 -1.89 0.00 0.00 176.35 174.54 1pms s MET 485 N -3.47 1.20 0.07 1.98 -2.45 -0.20 0.98 119.30 117.41 1pms s MET 485 Ca 0.34 -0.81 -0.14 0.00 -1.25 0.00 0.00 55.69 53.83 1pms s MET 485 Cb -0.10 -1.25 0.02 0.00 1.25 0.00 0.00 34.83 34.75 1pms s MET 485 CO 0.28 0.32 0.32 0.42 1.05 0.00 0.00 175.02 177.40 1pms s ILE 486 N -0.75 0.09 -0.15 10.11 1.01 0.13 -1.24 121.20 130.39 1pms s ILE 486 Ca 0.05 -0.72 -0.11 0.00 0.00 0.00 0.00 60.65 59.87 1pms s ILE 486 Cb -0.08 -1.05 0.05 0.00 0.01 0.00 0.00 42.46 41.39 1pms s ILE 486 CO 0.01 -0.40 0.39 0.00 0.00 0.00 0.00 174.94 174.94 1pms s LYS 489 N 1.22 1.42 0.24 0.00 2.20 -1.25 -1.07 119.74 122.50 1pms s LYS 489 Ca -0.06 -2.08 -0.31 0.00 -0.36 0.00 0.00 55.97 53.17 1pms s LYS 489 Cb -0.14 -2.59 -0.13 0.00 -1.51 0.00 0.00 37.83 33.46 1pms s LYS 489 CO -0.02 -1.12 1.47 0.43 -0.36 0.00 0.00 175.35 175.74 1pms n SER 490 N 3.58 3.01 -4.73 1.43 7.64 -1.26 -4.77 113.62 118.51 1pms n SER 490 Ca 0.07 1.14 -0.42 0.00 1.01 0.00 0.00 58.87 60.66 1pms n SER 490 Cb 0.35 -1.46 -0.03 0.00 -1.01 0.00 0.00 64.21 62.06 1pms n SER 490 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1pms s ASN 491 N 0.41 6.48 -0.68 6.43 4.22 -1.26 -4.95 114.94 125.59 1pms s ASN 491 Ca 0.69 2.77 0.03 0.00 -2.14 0.00 0.00 52.86 54.20 1pms s ASN 491 Cb -0.62 -2.61 0.17 0.00 1.28 0.00 0.00 41.25 39.47 1pms s ASN 491 CO 0.48 -0.88 0.48 -1.00 -2.04 0.00 0.00 177.10 174.14 1pms s HIS 492 N 0.79 3.51 0.00 1.54 3.76 -1.26 -4.99 115.29 118.64 1pms s HIS 492 Ca 0.69 -3.17 0.00 0.00 -0.15 0.00 0.00 55.06 52.43 1pms s HIS 492 Cb -0.46 -2.89 0.00 0.00 1.11 0.00 0.00 32.58 30.34 1pms s HIS 492 CO 0.36 -0.66 0.00 0.41 -0.85 0.00 0.00 174.74 174.00 1pms n GLY 493 N 2.51 4.04 3.75 -2.22 0.00 -1.26 -5.10 105.19 106.91 1pms n GLY 493 Ca 0.15 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 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 -5.11 2.06 0.00 1.61 -0.21 -1.26 -5.04 119.66 111.72 1pms s GLN 494 Ca 0.00 1.24 0.00 0.00 0.02 0.00 0.00 55.36 56.62 1pms s GLN 494 Cb 0.00 -1.87 0.00 0.00 1.00 0.00 0.00 33.01 32.14 1pms s GLN 494 CO 0.00 -1.80 0.00 -0.35 -2.12 0.00 0.00 175.29 171.02 1pms n PRO 495 N -3.61 0.23 0.05 2.91 -0.04 -1.26 -4.96 135.00 128.31 1pms n PRO 495 Ca 0.10 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.47 1pms n PRO 495 Cb 0.53 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.04 1pms n PRO 495 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pms h ARG 496 N 0.00 0.39 -1.55 0.54 -0.00 -2.06 -3.46 114.38 108.23 1pms h ARG 496 Ca 0.00 -0.29 0.08 0.00 -0.50 0.00 0.00 59.98 59.27 1pms h ARG 496 Cb 0.00 0.05 -0.23 0.00 0.00 0.00 0.00 29.97 29.79 1pms h ARG 496 CO 0.00 0.92 0.55 -0.48 0.00 0.00 0.00 179.97 180.96 1pms s LEU 497 N -8.01 -0.37 0.92 3.04 0.05 -1.26 -5.17 118.68 107.88 1pms s LEU 497 Ca -0.06 0.41 -0.14 0.00 0.05 0.00 0.00 54.13 54.39 1pms s LEU 497 Cb 0.11 1.85 0.15 0.00 -2.05 0.00 0.00 46.19 46.25 1pms s LEU 497 CO 0.83 -0.33 1.19 -2.16 -0.55 0.00 0.00 176.35 175.33 1pms s PRO 498 N -1.08 1.08 0.00 1.48 0.04 -1.26 -4.19 135.00 131.06 1pms s PRO 498 Ca -0.02 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.06 1pms s PRO 498 Cb -0.01 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1pms s PRO 498 CO 0.01 -2.19 0.00 0.41 0.04 0.00 0.00 177.00 175.27 1pms n GLY 499 N -2.83 2.92 0.05 0.56 0.00 -1.26 -4.84 105.19 99.79 1pms n GLY 499 Ca 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 1pms n GLY 499 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pms h ALA 500 N 0.00 0.00 -2.86 4.61 0.00 -2.05 -3.46 119.26 115.50 1pms h ALA 500 Ca 0.00 -0.07 -0.64 0.00 0.00 0.00 0.00 54.91 54.20 1pms h ALA 500 Cb 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1pms h ALA 500 CO 0.00 0.03 -0.51 -1.54 0.00 0.00 0.00 179.25 177.23 1pms s SER 501 N -5.63 6.26 -0.58 0.00 1.04 -1.26 -5.05 113.70 108.48 1pms s SER 501 Ca -0.03 0.31 -0.24 0.00 0.48 0.00 0.00 55.95 56.47 1pms s SER 501 Cb -0.00 -1.94 0.04 0.00 0.10 0.00 0.00 66.02 64.23 1pms s SER 501 CO 0.08 0.25 0.99 -0.44 0.98 0.00 0.00 173.24 175.10 1pms s SER 502 N -1.96 6.31 0.01 7.02 0.01 -1.26 -4.66 113.70 119.17 1pms s SER 502 Ca 0.27 -0.42 -0.00 0.00 1.31 0.00 0.00 55.95 57.11 1pms s SER 502 Cb -0.13 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1pms s SER 502 CO 0.19 -1.32 0.01 0.00 0.41 0.00 0.00 173.24 172.53 1pms n ALA 503 N 7.69 -2.13 -1.98 1.44 0.00 -1.26 -4.64 120.51 119.63 1pms n ALA 503 Ca 0.01 0.54 -0.26 0.00 0.00 0.00 0.00 53.44 53.73 1pms n ALA 503 Cb 0.47 -1.52 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 1pms n ALA 503 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1pms s GLU 504 N -0.70 2.42 -0.10 0.00 -1.05 -1.26 -4.81 118.70 113.20 1pms s GLU 504 Ca -0.01 -0.09 -0.33 0.00 -0.15 0.00 0.00 54.97 54.39 1pms s GLU 504 Cb 0.00 -4.97 0.13 0.00 -0.44 0.00 0.00 34.13 28.85 1pms s GLU 504 CO 0.03 -3.48 1.27 -0.47 0.95 0.00 0.00 175.26 173.56 1pms s TYR 505 N 10.69 -0.07 0.05 4.83 5.04 -1.26 -4.83 117.35 131.79 1pms s TYR 505 Ca 0.73 -0.00 0.00 0.00 -2.44 0.00 0.00 57.07 55.36 1pms s TYR 505 Cb -0.08 0.53 0.00 0.00 0.35 0.00 0.00 41.96 42.76 1pms s TYR 505 CO 0.02 -0.22 0.00 -2.13 -1.34 0.00 0.00 175.55 171.88 1pms n ARG 506 N -0.32 -2.45 -2.66 4.97 3.00 -1.26 -5.05 116.66 112.90 1pms n ARG 506 Ca -0.05 2.03 -0.03 0.00 -0.00 0.00 0.00 57.85 59.80 1pms n ARG 506 Cb 0.61 -2.19 0.11 0.00 0.00 0.00 0.00 32.46 30.99 1pms n ARG 506 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1pms n LEU 507 N 0.85 -1.23 -4.50 6.15 0.00 -1.26 -5.04 117.00 111.97 1pms n LEU 507 Ca 0.00 -1.87 -0.30 0.00 0.00 0.00 0.00 56.01 53.84 1pms n LEU 507 Cb 0.00 0.99 -0.11 0.00 0.00 0.00 0.00 43.42 44.29 1pms n LEU 507 CO 0.00 1.59 -0.47 -1.59 0.00 0.00 0.00 177.39 176.91 1pms s LYS 508 N 0.05 1.97 0.41 1.96 -2.85 -1.26 -3.88 119.74 116.15 1pms s LYS 508 Ca 0.20 -1.07 0.07 0.00 -1.00 0.00 0.00 55.97 54.17 1pms s LYS 508 Cb 0.29 -2.19 -0.08 0.00 -2.06 0.00 0.00 37.83 33.79 1pms s LYS 508 CO -0.20 0.51 0.01 -1.83 0.10 0.00 0.00 175.35 173.95 1pms s GLU 509 N -1.89 1.96 0.05 1.78 -1.05 -0.68 -4.95 118.70 113.94 1pms s GLU 509 Ca 0.17 -2.11 -0.09 0.00 -0.15 0.00 0.00 54.97 52.79 1pms s GLU 509 Cb -0.11 -1.64 0.00 0.00 -0.44 0.00 0.00 34.13 31.95 1pms s GLU 509 CO 0.09 -0.05 0.19 -1.59 0.95 0.00 0.00 175.26 174.85 1pms s LYS 510 N -3.71 0.73 0.00 -4.83 0.00 -1.26 -1.24 119.74 109.42 1pms s LYS 510 Ca 0.35 -0.72 0.00 0.00 0.00 0.00 0.00 55.97 55.60 1pms s LYS 510 Cb 0.10 0.30 0.00 0.00 0.00 0.00 0.00 37.83 38.23 1pms s LYS 510 CO 0.18 -0.21 0.00 1.19 0.00 0.00 0.00 175.35 176.50 1pms n PHE 511 N 0.50 -0.25 -3.98 1.78 3.01 -0.38 -4.94 117.46 113.21 1pms n PHE 511 Ca -0.18 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 57.94 1pms n PHE 511 Cb 0.60 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.92 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 -3.70 3.15 -1.25 1.38 0.08 -1.26 -1.03 117.98 115.35 1pms s PHE 512 Ca 0.00 -1.82 -0.11 0.00 0.12 0.00 0.00 56.93 55.12 1pms s PHE 512 Cb 0.00 -2.04 0.17 0.00 -0.57 0.00 0.00 43.02 40.58 1pms s PHE 512 CO 0.00 -0.79 1.67 -0.12 -0.10 0.00 0.00 175.22 175.89 1pms n MET 513 N 4.60 3.52 0.00 0.44 1.56 0.01 -4.27 117.12 122.98 1pms n MET 513 Ca -0.15 -3.68 0.00 0.00 -0.27 0.00 0.00 57.70 53.59 1pms n MET 513 Cb 0.45 -2.97 0.00 0.00 2.15 0.00 0.00 33.22 32.85 1pms n MET 513 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 1pms n ARG 514 N 4.64 0.00 -1.14 2.12 3.00 -1.26 -4.22 116.66 119.80 1pms n ARG 514 Ca 0.38 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 58.03 1pms n ARG 514 Cb 0.39 -0.42 0.18 0.00 0.00 0.00 0.00 32.46 32.60 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 -1.37 2.18 -4.18 5.56 0.00 -1.26 -4.96 118.16 114.14 1pms n LYS 515 Ca 0.00 -3.10 -0.27 0.00 -0.00 0.00 0.00 58.31 54.94 1pms n LYS 515 Cb 0.00 -2.09 -0.07 0.00 -0.00 0.00 0.00 35.03 32.87 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 -3.40 3.87 -0.05 0.58 -7.23 -1.26 -4.14 120.40 108.77 1pms s VAL 516 Ca 0.54 -1.31 -0.02 0.00 -1.81 0.00 0.00 61.98 59.38 1pms s VAL 516 Cb 0.46 -2.94 0.03 0.00 0.56 0.00 0.00 36.38 34.50 1pms s VAL 516 CO 0.07 -0.07 0.11 -1.10 -0.31 0.00 0.00 175.10 173.79 1pms s GLN 517 N -2.87 0.06 0.12 4.82 -0.21 -1.25 -4.92 119.66 115.41 1pms s GLN 517 Ca 0.28 0.29 -0.17 0.00 0.02 0.00 0.00 55.36 55.78 1pms s GLN 517 Cb -0.10 -0.17 -0.07 0.00 1.00 0.00 0.00 33.01 33.67 1pms s GLN 517 CO 0.19 -0.15 0.58 -1.50 -2.12 0.00 0.00 175.29 172.29 1pms s ILE 518 N 1.02 4.77 -0.52 1.08 2.07 -1.26 -2.44 121.20 125.92 1pms s ILE 518 Ca -0.08 1.06 0.04 0.00 -1.41 0.00 0.00 60.65 60.25 1pms s ILE 518 Cb -0.11 -3.82 0.14 0.00 0.13 0.00 0.00 42.46 38.80 1pms s ILE 518 CO -0.04 0.38 0.28 0.20 -1.91 0.00 0.00 174.94 173.85 1pms s ASN 519 N -1.44 4.13 -0.85 4.50 -0.87 -0.10 -4.92 114.94 115.40 1pms s ASN 519 Ca 0.34 -3.01 -0.29 0.00 -1.57 0.00 0.00 52.86 48.33 1pms s ASN 519 Cb -0.17 -1.45 -0.18 0.00 -0.02 0.00 0.00 41.25 39.43 1pms s ASN 519 CO 0.19 -0.22 2.61 -0.67 -2.57 0.00 0.00 177.10 176.44 1pms n ASP 520 N 3.09 0.87 -3.07 -1.22 2.03 -1.26 -3.05 116.55 113.93 1pms n ASP 520 Ca 0.08 -0.04 -0.34 0.00 0.52 0.00 0.00 54.79 55.01 1pms n ASP 520 Cb 0.33 -1.11 -0.03 0.00 -0.72 0.00 0.00 41.12 39.59 1pms n ASP 520 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1pms n LYS 521 N 8.61 3.70 -3.15 -0.67 4.81 -1.26 -4.70 118.16 125.50 1pms n LYS 521 Ca 0.58 -2.94 0.04 0.00 -0.87 0.00 0.00 58.31 55.12 1pms n LYS 521 Cb 0.18 -2.44 -0.00 0.00 0.02 0.00 0.00 35.03 32.79 1pms n LYS 521 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1pms s ASP 522 N 0.49 -1.50 0.61 3.14 1.11 -1.26 -4.88 116.67 114.38 1pms s ASP 522 Ca 0.57 0.06 0.25 0.00 0.18 0.00 0.00 52.55 53.61 1pms s ASP 522 Cb 0.26 1.94 1.03 0.00 1.07 0.00 0.00 42.92 47.22 1pms s ASP 522 CO -0.14 -0.26 1.46 0.44 1.18 0.00 0.00 175.17 177.85 1pms h ASP 523 N 7.78 0.00 -0.46 0.27 5.19 -1.84 -3.46 116.42 123.91 1pms h ASP 523 Ca -0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1pms h ASP 523 Cb 1.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.70 1pms h ASP 523 CO 0.12 0.00 0.00 0.35 -3.12 0.00 0.00 179.24 176.59 1pms n THR 524 N -3.28 0.00 -0.87 0.35 -2.24 -1.03 -4.79 114.28 102.43 1pms n THR 524 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1pms n THR 524 Cb 1.22 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 1pms n THR 524 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1pms n SER 525 N -3.24 -1.07 0.00 3.42 2.88 -1.26 -4.15 113.62 110.20 1pms n SER 525 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1pms n SER 525 Cb 0.00 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 1pms n SER 525 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1pms n GLU 526 N -1.89 0.00 -3.81 -1.46 0.28 -1.26 -5.14 120.64 107.36 1pms n GLU 526 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.88 1pms n GLU 526 Cb 0.05 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.82 1pms n GLU 526 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1pms s TYR 527 N -1.53 -0.12 0.00 -1.84 2.02 -1.26 -5.17 117.35 109.45 1pms s TYR 527 Ca 0.00 0.20 0.00 0.00 -0.37 0.00 0.00 57.07 56.90 1pms s TYR 527 Cb 0.00 0.04 0.00 0.00 -0.40 0.00 0.00 41.96 41.60 1pms s TYR 527 CO 0.00 -0.30 0.00 0.36 -1.57 0.00 0.00 175.55 174.04 1pms n LYS 528 N 1.68 1.42 0.00 -0.62 2.85 -1.26 -2.46 118.16 119.77 1pms n LYS 528 Ca -0.20 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.06 1pms n LYS 528 Cb 0.56 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.94 1pms n LYS 528 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1pms n HIS 529 N 0.00 0.00 -1.48 5.58 8.25 -1.26 -5.05 115.22 121.26 1pms n HIS 529 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1pms n HIS 529 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 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 0.00 0.00 -3.07 -1.41 0.00 -1.26 -4.69 120.51 110.07 1pms n ALA 530 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1pms n ALA 530 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 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 0.02 0.05 -0.31 0.00 0.08 -1.04 -4.34 117.98 112.43 1pms s PHE 531 Ca 0.00 -0.13 0.02 0.00 0.12 0.00 0.00 56.93 56.94 1pms s PHE 531 Cb 0.00 -0.06 0.08 0.00 -0.57 0.00 0.00 43.02 42.47 1pms s PHE 531 CO 0.00 -0.24 -0.00 -1.83 -0.10 0.00 0.00 175.22 173.05 1pms s GLU 532 N -1.18 1.93 0.39 0.44 4.04 -1.17 -2.65 118.70 120.50 1pms s GLU 532 Ca -0.13 -1.60 -0.01 0.00 0.04 0.00 0.00 54.97 53.27 1pms s GLU 532 Cb -0.07 -3.12 -0.03 0.00 0.02 0.00 0.00 34.13 30.93 1pms s GLU 532 CO 0.01 -0.78 0.62 0.42 -1.84 0.00 0.00 175.26 173.69 1pms s ILE 533 N 1.04 4.88 0.09 1.83 1.09 -0.66 -0.92 121.20 128.56 1pms s ILE 533 Ca 0.01 -0.34 0.07 0.00 -1.10 0.00 0.00 60.65 59.29 1pms s ILE 533 Cb -0.20 -3.80 -0.03 0.00 -1.06 0.00 0.00 42.46 37.37 1pms s ILE 533 CO -0.06 -0.58 -0.17 -0.63 -0.10 0.00 0.00 174.94 173.40 1pms s ILE 534 N -2.44 1.41 0.47 2.92 1.01 -1.02 0.65 121.20 124.19 1pms s ILE 534 Ca 0.43 -1.48 -0.03 0.00 0.00 0.00 0.00 60.65 59.57 1pms s ILE 534 Cb -0.10 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 1pms s ILE 534 CO 0.38 -0.18 0.74 -0.76 0.00 0.00 0.00 174.94 175.12 1pms s LEU 535 N -1.93 3.65 -0.16 2.97 1.43 -0.73 -3.84 118.68 120.06 1pms s LEU 535 Ca 0.03 0.72 0.13 0.00 -1.03 0.00 0.00 54.13 53.99 1pms s LEU 535 Cb -0.09 -3.63 0.67 0.00 0.03 0.00 0.00 46.19 43.17 1pms s LEU 535 CO 0.03 -0.61 1.54 0.29 0.23 0.00 0.00 176.35 177.84 1pms n LYS 536 N -2.19 3.97 -0.07 1.70 5.02 -1.26 -4.26 118.16 121.07 1pms n LYS 536 Ca 0.00 -2.60 -0.15 0.00 -2.02 0.00 0.00 58.31 53.54 1pms n LYS 536 Cb 0.56 -2.03 -0.05 0.00 -0.02 0.00 0.00 35.03 33.49 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 0.69 1.13 0.00 4.39 8.00 -1.26 -5.02 116.55 124.48 1pms n ASP 537 Ca 0.23 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.92 1pms n ASP 537 Cb 0.96 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 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 2.08 0.00 0.20 0.44 0.00 -1.26 -5.17 105.19 101.48 1pms n GLY 538 Ca -0.28 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 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 0.13 -3.71 1.61 5.03 -1.26 -5.03 115.26 112.03 1pms n ASN 539 Ca 0.00 -1.14 -0.16 0.00 0.87 0.00 0.00 54.58 54.15 1pms n ASN 539 Cb 0.00 0.10 -0.16 0.00 -1.02 0.00 0.00 39.78 38.70 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 -1.15 0.43 -1.21 6.41 1.04 -1.26 -1.78 113.70 116.18 1pms s SER 540 Ca 0.02 0.20 -0.13 0.00 0.48 0.00 0.00 55.95 56.52 1pms s SER 540 Cb 0.00 0.08 0.18 0.00 0.10 0.00 0.00 66.02 66.38 1pms s SER 540 CO 0.02 -0.19 1.47 0.52 0.98 0.00 0.00 173.24 176.04 1pms n VAL 541 N 4.74 4.31 -3.51 5.02 0.31 0.21 -4.88 118.33 124.53 1pms n VAL 541 Ca -0.16 -4.76 -0.38 0.00 -0.01 0.00 0.00 64.34 59.03 1pms n VAL 541 Cb 0.50 -2.45 -0.09 0.00 -0.91 0.00 0.00 33.84 30.89 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 1.08 5.26 0.36 2.52 1.01 -1.25 -1.65 121.20 128.54 1pms s ILE 542 Ca 0.41 0.39 0.04 0.00 0.00 0.00 0.00 60.65 61.49 1pms s ILE 542 Cb -0.02 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 1pms s ILE 542 CO -0.00 0.25 0.13 0.72 0.00 0.00 0.00 174.94 176.04 1pms s PHE 543 N 1.57 1.75 -0.20 3.97 -0.71 -1.08 -3.08 117.98 120.19 1pms s PHE 543 Ca 0.12 -1.28 -0.06 0.00 -1.04 0.00 0.00 56.93 54.67 1pms s PHE 543 Cb -0.15 -1.07 0.10 0.00 -1.21 0.00 0.00 43.02 40.69 1pms s PHE 543 CO 0.08 -0.35 0.40 -1.54 -1.34 0.00 0.00 175.22 172.47 1pms s SER 544 N -3.51 -0.11 0.38 1.98 1.04 -0.27 -2.51 113.70 110.70 1pms s SER 544 Ca 0.30 0.81 -0.24 0.00 0.48 0.00 0.00 55.95 57.30 1pms s SER 544 Cb 0.04 1.25 -0.10 0.00 0.10 0.00 0.00 66.02 67.32 1pms s SER 544 CO 0.16 -0.25 0.99 0.00 0.98 0.00 0.00 173.24 175.12 1pms s ALA 545 N 2.58 3.11 -0.11 5.32 0.00 -1.26 -0.98 121.76 130.42 1pms s ALA 545 Ca 0.01 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.51 1pms s ALA 545 Cb -0.13 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.73 1pms s ALA 545 CO -0.13 0.00 2.66 1.63 0.00 0.00 0.00 175.76 179.92 1pms n LYS 546 N -0.03 1.65 -3.84 0.00 4.76 -1.26 -4.52 118.16 114.92 1pms n LYS 546 Ca 0.05 -0.90 -0.02 0.00 -2.87 0.00 0.00 58.31 54.57 1pms n LYS 546 Cb 0.51 -1.59 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 0.45 -1.37 0.00 0.00 177.40 176.48 1pms s SER 547 N 1.49 -0.04 -0.05 4.39 0.15 -1.26 -4.99 113.70 113.40 1pms s SER 547 Ca 0.35 -0.47 0.13 0.00 0.70 0.00 0.00 55.95 56.66 1pms s SER 547 Cb 0.20 0.39 -0.23 0.00 -1.71 0.00 0.00 66.02 64.68 1pms s SER 547 CO -0.03 -0.76 0.63 0.00 1.20 0.00 0.00 173.24 174.28 1pms n ALA 548 N -0.66 1.53 0.04 5.45 0.00 -1.26 -2.90 120.51 122.71 1pms n ALA 548 Ca -0.03 -0.79 -0.04 0.00 0.00 0.00 0.00 53.44 52.57 1pms n ALA 548 Cb 0.60 -0.81 -0.09 0.00 0.00 0.00 0.00 19.45 19.14 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 0.00 0.00 0.13 0.00 4.11 -1.97 -3.06 114.58 113.79 1pms h GLU 549 Ca -0.29 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 58.86 1pms h GLU 549 Cb 2.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.26 1pms h GLU 549 CO 0.07 0.62 -1.23 0.93 0.07 0.00 0.00 179.01 179.48 1pms h GLU 550 N 0.00 0.34 -0.42 1.06 5.08 -1.93 -0.44 114.58 118.27 1pms h GLU 550 Ca -0.12 -0.54 -0.10 0.00 -1.00 0.00 0.00 59.36 57.60 1pms h GLU 550 Cb 1.74 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 31.17 1pms h GLU 550 CO 0.09 1.24 -0.14 1.57 -1.00 0.00 0.00 179.01 180.76 1pms h LYS 551 N 0.12 0.83 -0.00 2.33 2.10 -1.63 -2.43 116.57 117.89 1pms h LYS 551 Ca -0.14 -0.34 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1pms h LYS 551 Cb 1.94 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 33.23 1pms h LYS 551 CO 0.21 0.97 -0.16 -1.71 -2.00 0.00 0.00 179.45 176.76 1pms n ASN 552 N -4.27 0.16 0.03 7.07 2.85 -1.16 -2.83 115.26 117.12 1pms n ASN 552 Ca -0.01 0.24 -0.04 0.00 -0.11 0.00 0.00 54.58 54.66 1pms n ASN 552 Cb 0.40 -0.26 -0.03 0.00 1.24 0.00 0.00 39.78 41.13 1pms n ASN 552 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 1pms h ASN 553 N 0.01 -0.16 -0.38 1.20 4.21 -0.59 -1.25 115.58 118.62 1pms h ASN 553 Ca 0.00 -0.09 -0.09 0.00 1.21 0.00 0.00 56.30 57.33 1pms h ASN 553 Cb 0.50 0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.72 1pms h ASN 553 CO 0.00 0.36 -0.08 -0.50 -1.29 0.00 0.00 177.43 175.92 1pms h TRP 554 N -1.03 0.88 -0.39 1.19 4.06 -1.62 -0.92 115.95 118.13 1pms h TRP 554 Ca -0.02 -0.15 -0.01 0.00 2.06 0.00 0.00 58.89 60.76 1pms h TRP 554 Cb 0.24 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.15 1pms h TRP 554 CO 0.03 0.85 0.19 1.98 -3.56 0.00 0.00 178.44 177.93 1pms h MET 555 N 0.74 0.56 -0.01 0.49 1.85 -1.64 -2.58 114.93 114.34 1pms h MET 555 Ca 0.13 -0.08 -0.12 0.00 -0.61 0.00 0.00 59.70 59.02 1pms h MET 555 Cb 0.56 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.48 1pms h MET 555 CO 0.03 0.50 -0.55 0.00 -0.40 0.00 0.00 176.91 176.49 1pms h ALA 556 N 1.04 1.06 0.00 0.39 0.00 -0.99 -2.53 119.26 118.23 1pms h ALA 556 Ca 0.13 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1pms h ALA 556 Cb 0.12 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1pms h ALA 556 CO -0.02 0.69 -0.07 0.00 0.00 0.00 0.00 179.25 179.86 1pms h ALA 557 N 1.41 1.12 0.00 0.00 0.00 -0.79 0.33 119.26 121.34 1pms h ALA 557 Ca -0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1pms h ALA 557 Cb 0.98 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1pms h ALA 557 CO 0.07 0.08 -0.00 -0.07 0.00 0.00 0.00 179.25 179.33 1pms h LEU 558 N 0.00 -0.01 -0.30 0.00 3.38 -1.11 -3.16 115.31 114.11 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 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1pms h LEU 558 CO 0.01 0.26 0.00 -0.38 0.09 0.00 0.00 178.44 178.42 1pms n ILE 559 N -3.47 1.37 0.06 1.22 -0.00 -1.17 -1.51 119.36 115.86 1pms n ILE 559 Ca -0.00 0.41 -0.11 0.00 -0.00 0.00 0.00 62.75 63.06 1pms n ILE 559 Cb 0.00 -1.32 0.01 0.00 -0.00 0.00 0.00 39.64 38.33 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 0.48 0.05 4.38 0.87 -0.40 -2.33 113.55 116.60 1pms h SER 560 Ca 0.00 -0.34 -0.06 0.00 -1.23 0.00 0.00 61.79 60.16 1pms h SER 560 Cb 0.13 -0.14 0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1pms h SER 560 CO 0.00 1.09 -0.28 -0.07 -0.53 0.00 0.00 176.83 177.04 1pms h LEU 561 N 0.26 0.15 -1.15 2.23 3.38 -1.23 -3.30 115.31 115.65 1pms h LEU 561 Ca -0.04 -0.98 0.13 0.00 0.09 0.00 0.00 57.88 57.08 1pms h LEU 561 Cb 1.38 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 42.00 1pms h LEU 561 CO 0.13 1.13 0.60 -0.61 0.09 0.00 0.00 178.44 179.79 1pms h GLN 562 N -0.80 0.81 -0.67 1.13 5.75 -1.58 -1.00 115.11 118.76 1pms h GLN 562 Ca -0.05 -0.05 0.14 0.00 -0.15 0.00 0.00 58.65 58.54 1pms h GLN 562 Cb 1.21 -0.18 -0.12 0.00 1.07 0.00 0.00 27.48 29.46 1pms h GLN 562 CO 0.05 0.54 -0.10 1.88 -2.65 0.00 0.00 178.83 178.54 1pms h TYR 563 N 0.83 -0.23 0.00 3.99 -1.99 -1.49 -3.40 116.97 114.68 1pms h TYR 563 Ca 0.48 0.06 0.00 0.00 2.00 0.00 0.00 58.73 61.26 1pms h TYR 563 Cb 0.62 0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.56 1pms h TYR 563 CO -0.00 -0.25 0.00 2.89 -0.00 0.00 0.00 178.16 180.79 1pms n ARG 564 N -5.40 0.00 0.00 4.88 0.00 -0.49 -5.13 116.66 110.52 1pms n ARG 564 Ca 0.09 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 58.08 1pms n ARG 564 Cb 0.37 0.00 0.82 0.00 -0.00 0.00 0.00 32.46 33.65 1pms n ARG 564 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08