#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 1.99 -0.34 4.33 4.76 -1.26 -4.44 118.16 123.19 1pms n LYS 432 Ca 0.00 -1.79 0.02 0.00 -2.87 0.00 0.00 58.31 53.68 1pms n LYS 432 Cb 0.00 -1.78 0.15 0.00 -1.84 0.00 0.00 35.03 31.56 1pms n LYS 432 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1pms n GLN 433 N 0.56 2.44 -0.22 1.97 6.02 -1.26 -4.28 117.38 122.61 1pms n GLN 433 Ca 0.36 -1.18 0.26 0.00 -0.01 0.00 0.00 57.00 56.43 1pms n GLN 433 Cb 0.58 -1.78 0.65 0.00 1.02 0.00 0.00 30.24 30.71 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 1.49 0.15 0.08 1.08 3.38 -2.00 0.70 115.31 120.18 1pms h LEU 434 Ca 0.01 0.02 -0.26 0.00 0.09 0.00 0.00 57.88 57.74 1pms h LEU 434 Cb 1.08 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1pms h LEU 434 CO 0.19 0.05 -1.23 0.00 0.09 0.00 0.00 178.44 177.54 1pms h ALA 435 N 1.56 0.23 0.00 1.53 0.00 -1.98 -3.12 119.26 117.48 1pms h ALA 435 Ca 0.46 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1pms h ALA 435 Cb 1.60 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1pms h ALA 435 CO -0.08 1.11 0.00 -0.89 0.00 0.00 0.00 179.25 179.39 1pms n ILE 436 N -3.44 0.36 0.19 0.00 2.08 0.20 -2.49 119.36 116.27 1pms n ILE 436 Ca -0.07 0.09 0.09 0.00 0.56 0.00 0.00 62.75 63.41 1pms n ILE 436 Cb 1.00 -0.68 0.19 0.00 -0.75 0.00 0.00 39.64 39.41 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 0.00 0.00 0.30 0.38 3.11 -0.35 -3.28 116.57 116.73 1pms h LYS 437 Ca 0.00 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1pms h LYS 437 Cb 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.63 1pms h LYS 437 CO 0.00 0.22 -0.14 0.87 -2.81 0.00 0.00 179.45 177.58 1pms h LYS 438 N 0.00 -0.39 -1.39 1.90 1.57 -1.60 -2.90 116.57 113.77 1pms h LYS 438 Ca -0.00 0.03 0.40 0.00 -1.87 0.00 0.00 60.65 59.21 1pms h LYS 438 Cb 1.07 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 33.41 1pms h LYS 438 CO 0.03 -0.26 1.22 1.98 -0.57 0.00 0.00 179.45 181.85 1pms h MET 439 N -0.71 0.00 0.50 3.15 4.05 -1.69 0.26 114.93 120.49 1pms h MET 439 Ca -0.04 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 1pms h MET 439 Cb 0.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 1pms h MET 439 CO 0.07 0.00 -0.24 -0.91 0.23 0.00 0.00 176.91 176.06 1pms h ASN 440 N 0.00 -0.57 0.30 1.39 4.21 -1.58 -1.25 115.58 118.08 1pms h ASN 440 Ca 0.66 0.02 0.00 0.00 1.21 0.00 0.00 56.30 58.19 1pms h ASN 440 Cb 3.08 0.15 0.00 0.00 -1.12 0.00 0.00 38.32 40.43 1pms h ASN 440 CO -0.01 -0.16 0.00 -0.62 -1.29 0.00 0.00 177.43 175.35 1pms n GLU 441 N -5.21 0.03 0.03 0.81 1.02 0.64 -2.30 120.64 115.65 1pms n GLU 441 Ca -0.08 0.30 -0.21 0.00 -0.02 0.00 0.00 57.16 57.15 1pms n GLU 441 Cb 0.27 -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 0.75 0.00 -3.67 2.04 -0.60 -2.76 117.51 113.27 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 0.15 2.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1pms h ILE 442 CO 0.00 0.86 -0.01 1.56 0.00 0.00 0.00 178.15 180.57 1pms h GLN 443 N 0.08 0.00 0.04 2.37 4.20 -0.80 -0.60 115.11 120.40 1pms h GLN 443 Ca -0.38 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 57.97 1pms h GLN 443 Cb 2.05 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.79 1pms h GLN 443 CO 0.12 0.01 -2.11 1.63 -0.67 0.00 0.00 178.83 177.81 1pms n LYS 444 N -3.11 0.69 0.00 1.46 4.76 -1.19 -2.92 118.16 117.85 1pms n LYS 444 Ca -0.00 0.19 0.15 0.00 -2.87 0.00 0.00 58.31 55.78 1pms n LYS 444 Cb 0.25 -1.65 0.76 0.00 -1.84 0.00 0.00 35.03 32.55 1pms n LYS 444 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1pms n ASN 445 N -3.18 0.14 -0.12 4.39 2.85 -1.04 -3.63 115.26 114.67 1pms n ASN 445 Ca -0.32 -0.44 -0.19 0.00 -0.11 0.00 0.00 54.58 53.52 1pms n ASN 445 Cb 1.06 -0.17 -0.10 0.00 1.24 0.00 0.00 39.78 41.80 1pms n ASN 445 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pms n ILE 446 N -1.12 1.36 0.00 -1.44 0.13 -0.25 -4.87 119.36 113.17 1pms n ILE 446 Ca 0.16 -0.48 0.00 0.00 -1.10 0.00 0.00 62.75 61.34 1pms n ILE 446 Cb 0.22 -1.46 0.00 0.00 -0.84 0.00 0.00 39.64 37.56 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 -3.43 0.00 0.00 9.51 -0.08 -1.15 -3.96 116.55 117.44 1pms n ASP 447 Ca -0.44 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 52.84 1pms n ASP 447 Cb 0.92 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.38 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 -1.41 1.42 0.27 0.00 -1.26 -4.99 105.19 99.22 1pms n GLY 448 Ca 0.00 0.46 -0.11 0.00 0.00 0.00 0.00 46.02 46.37 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 0.06 -3.50 1.61 2.14 -1.25 -4.69 117.44 111.80 1pms n TRP 449 Ca 0.00 -1.11 -0.24 0.00 2.07 0.00 0.00 57.50 58.22 1pms n TRP 449 Cb 0.00 -0.00 -0.13 0.00 -0.81 0.00 0.00 31.31 30.36 1pms n TRP 449 CO 0.00 0.00 0.00 -1.83 2.07 0.00 0.00 177.69 177.93 1pms s GLU 450 N -2.66 0.21 0.00 -2.67 -1.05 -1.26 -3.53 118.70 107.75 1pms s GLU 450 Ca 0.09 -0.27 0.00 0.00 -0.15 0.00 0.00 54.97 54.63 1pms s GLU 450 Cb 0.00 -1.10 0.00 0.00 -0.44 0.00 0.00 34.13 32.59 1pms s GLU 450 CO 0.06 -0.94 0.00 0.41 0.95 0.00 0.00 175.26 175.75 1pms n GLY 451 N 5.28 -1.72 3.18 -3.83 0.00 -0.71 -4.90 105.19 102.48 1pms n GLY 451 Ca -0.05 0.60 -0.11 0.00 0.00 0.00 0.00 46.02 46.46 1pms n GLY 451 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pms s LYS 452 N 0.00 0.94 0.00 1.61 2.20 -1.26 -4.81 119.74 118.43 1pms s LYS 452 Ca 0.00 -1.43 0.00 0.00 -0.36 0.00 0.00 55.97 54.18 1pms s LYS 452 Cb 0.00 -0.05 0.00 0.00 -1.51 0.00 0.00 37.83 36.27 1pms s LYS 452 CO 0.00 -0.15 0.00 -3.47 -0.36 0.00 0.00 175.35 171.37 1pms n ASP 453 N -0.12 0.00 0.00 1.43 2.03 -1.26 -4.69 116.55 113.94 1pms n ASP 453 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 1pms n ASP 453 Cb 0.63 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.03 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 0.00 0.00 -3.49 5.18 5.41 -1.26 -4.90 119.36 120.30 1pms n ILE 454 Ca 0.00 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.33 1pms n ILE 454 Cb 0.00 -0.06 -0.06 0.00 -0.71 0.00 0.00 39.64 38.80 1pms n ILE 454 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1pms s GLY 455 N -1.49 2.32 0.56 7.39 0.00 -1.26 -4.90 107.32 109.94 1pms s GLY 455 Ca 0.00 -2.91 0.34 0.00 0.00 0.00 0.00 44.72 42.15 1pms s GLY 455 CO 0.00 1.16 1.78 -1.61 0.00 0.00 0.00 173.10 174.43 1pms h GLN 456 N 8.02 0.00 0.00 2.90 5.75 -1.94 -0.60 115.11 129.24 1pms h GLN 456 Ca -0.09 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 1pms h GLN 456 Cb 1.04 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.59 1pms h GLN 456 CO 0.82 0.00 0.00 0.00 -2.65 0.00 0.00 178.83 177.00 1pms n ASN 459 N -0.25 0.00 -1.94 0.00 5.03 -0.37 -4.45 115.26 113.28 1pms n ASN 459 Ca 0.12 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.57 1pms n ASN 459 Cb 0.94 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.70 1pms n ASN 459 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1pms n GLU 460 N 0.00 -2.30 0.00 3.52 0.28 -1.00 -4.22 120.64 116.93 1pms n GLU 460 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1pms n GLU 460 Cb 0.00 -4.01 0.00 0.00 1.43 0.00 0.00 31.44 28.86 1pms n GLU 460 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1pms n PHE 461 N -1.91 0.00 0.17 -1.84 3.01 -1.26 -3.89 117.46 111.74 1pms n PHE 461 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.54 1pms n PHE 461 Cb 0.33 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.68 1pms n PHE 461 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 1pms n ILE 462 N 0.00 0.00 -3.76 4.37 5.41 -0.95 -1.75 119.36 122.68 1pms n ILE 462 Ca 0.00 -0.31 -0.30 0.00 1.00 0.00 0.00 62.75 63.14 1pms n ILE 462 Cb 0.00 0.34 -0.15 0.00 -0.71 0.00 0.00 39.64 39.12 1pms n ILE 462 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1pms s MET 463 N -2.96 0.89 -0.30 0.38 -1.94 -1.17 -4.56 119.30 109.63 1pms s MET 463 Ca -0.03 -1.31 -0.01 0.00 -1.71 0.00 0.00 55.69 52.63 1pms s MET 463 Cb 0.11 -2.18 0.10 0.00 2.01 0.00 0.00 34.83 34.86 1pms s MET 463 CO 0.66 -1.01 0.09 -1.21 -0.01 0.00 0.00 175.02 173.54 1pms s GLU 464 N 1.34 0.75 0.00 2.03 2.02 -1.23 -0.33 118.70 123.29 1pms s GLU 464 Ca 0.11 -1.06 0.00 0.00 0.02 0.00 0.00 54.97 54.04 1pms s GLU 464 Cb -0.19 -2.04 0.00 0.00 0.10 0.00 0.00 34.13 32.00 1pms s GLU 464 CO -0.19 -0.96 0.00 0.41 0.02 0.00 0.00 175.26 174.54 1pms n GLY 465 N 4.84 -1.09 3.17 -1.39 0.00 -1.09 -4.23 105.19 105.39 1pms n GLY 465 Ca -0.02 0.68 -0.13 0.00 0.00 0.00 0.00 46.02 46.55 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 1.41 0.01 -0.00 2.61 -4.23 -1.26 -3.15 115.64 111.04 1pms s THR 466 Ca 0.00 -0.08 -0.16 0.00 -1.18 0.00 0.00 61.69 60.27 1pms s THR 466 Cb 0.00 -0.42 0.03 0.00 1.34 0.00 0.00 72.50 73.45 1pms s THR 466 CO 0.00 -0.04 0.35 -0.22 -0.54 0.00 0.00 174.62 174.16 1pms s LEU 467 N -0.07 0.69 -0.13 4.79 1.98 -1.18 -4.64 118.68 120.13 1pms s LEU 467 Ca -0.02 0.08 -0.15 0.00 -2.89 0.00 0.00 54.13 51.15 1pms s LEU 467 Cb -0.03 1.43 -0.05 0.00 0.66 0.00 0.00 46.19 48.21 1pms s LEU 467 CO 0.01 -0.51 0.35 0.28 -1.89 0.00 0.00 176.35 174.59 1pms s THR 468 N -1.65 5.25 -0.99 3.68 -1.32 -0.04 -1.81 115.64 118.75 1pms s THR 468 Ca -0.11 0.68 -0.18 0.00 -1.21 0.00 0.00 61.69 60.87 1pms s THR 468 Cb -0.04 -3.68 0.13 0.00 -1.51 0.00 0.00 72.50 67.41 1pms s THR 468 CO 0.03 0.40 1.21 -0.60 -2.21 0.00 0.00 174.62 173.45 1pms s ARG 469 N 0.28 3.70 0.56 7.08 3.52 -1.26 -0.91 118.95 131.92 1pms s ARG 469 Ca 0.20 -1.90 -0.14 0.00 -0.13 0.00 0.00 55.73 53.76 1pms s ARG 469 Cb -0.14 -4.97 -0.12 0.00 -1.56 0.00 0.00 34.95 28.16 1pms s ARG 469 CO 0.07 -1.80 -0.33 1.33 -0.81 0.00 0.00 175.30 173.76 1pms n VAL 470 N 5.39 0.00 -0.49 7.11 0.24 -1.10 -2.90 118.33 126.57 1pms n VAL 470 Ca 0.27 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1pms n VAL 470 Cb 0.48 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 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 2.28 0.75 3.04 7.63 0.00 -1.26 -4.98 105.19 112.65 1pms n GLY 471 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.37 -0.43 -1.42 4.61 0.00 -1.14 -5.05 121.76 115.96 1pms s ALA 472 Ca 0.00 0.54 -0.08 0.00 0.00 0.00 0.00 51.96 52.41 1pms s ALA 472 Cb 0.00 -0.32 0.06 0.00 0.00 0.00 0.00 23.12 22.86 1pms s ALA 472 CO 0.00 -0.09 2.46 1.17 0.00 0.00 0.00 175.76 179.29 1pms n LYS 473 N 3.15 3.96 0.00 0.00 4.81 -1.26 -4.67 118.16 124.16 1pms n LYS 473 Ca -0.14 -3.00 0.00 0.00 -0.87 0.00 0.00 58.31 54.30 1pms n LYS 473 Cb 0.58 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.82 1pms n LYS 473 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1pms n HIS 474 N 3.15 0.00 -0.15 5.64 8.25 -1.26 -5.16 115.22 125.69 1pms n HIS 474 Ca 0.62 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 58.04 1pms n HIS 474 Cb 0.28 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.43 1pms n HIS 474 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1pms n GLU 475 N 0.00 -0.14 -3.74 -0.41 1.02 -1.26 -4.65 120.64 111.45 1pms n GLU 475 Ca 0.00 -0.19 -0.13 0.00 -0.02 0.00 0.00 57.16 56.82 1pms n GLU 475 Cb 0.00 -0.40 -0.10 0.00 -0.02 0.00 0.00 31.44 30.92 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 -1.91 0.55 0.46 3.49 1.81 -0.75 -4.80 118.95 117.80 1pms s ARG 476 Ca 0.09 0.22 -0.25 0.00 -1.72 0.00 0.00 55.73 54.06 1pms s ARG 476 Cb -0.02 0.25 -0.08 0.00 -0.45 0.00 0.00 34.95 34.66 1pms s ARG 476 CO 0.07 -0.11 1.44 1.58 -0.68 0.00 0.00 175.30 177.59 1pms n HIS 477 N 2.16 2.70 -4.18 -0.53 -0.00 -0.92 -3.10 115.22 111.35 1pms n HIS 477 Ca -0.17 0.44 -0.13 0.00 0.46 0.00 0.00 57.72 58.32 1pms n HIS 477 Cb 0.57 -2.46 -0.10 0.00 -0.12 0.00 0.00 29.99 27.87 1pms n HIS 477 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1pms s ILE 478 N -1.20 0.89 -0.14 3.57 1.01 -1.19 -1.46 121.20 122.69 1pms s ILE 478 Ca 0.62 -1.77 -0.11 0.00 0.00 0.00 0.00 60.65 59.39 1pms s ILE 478 Cb -0.45 -1.50 0.04 0.00 0.01 0.00 0.00 42.46 40.57 1pms s ILE 478 CO 0.57 -0.67 0.36 -0.36 0.00 0.00 0.00 174.94 174.84 1pms s PHE 479 N -2.88 -0.44 0.05 3.97 0.08 -0.73 -2.69 117.98 115.34 1pms s PHE 479 Ca 0.08 1.02 -0.15 0.00 0.12 0.00 0.00 56.93 58.00 1pms s PHE 479 Cb 0.00 0.16 0.03 0.00 -0.57 0.00 0.00 43.02 42.63 1pms s PHE 479 CO -0.01 -0.23 0.34 -1.17 -0.10 0.00 0.00 175.22 174.05 1pms s LEU 480 N 0.57 0.71 -0.22 -0.37 0.20 0.55 0.09 118.68 120.21 1pms s LEU 480 Ca -0.03 -0.15 -0.04 0.00 0.69 0.00 0.00 54.13 54.61 1pms s LEU 480 Cb -0.05 1.50 0.11 0.00 -0.43 0.00 0.00 46.19 47.33 1pms s LEU 480 CO -0.03 -0.65 0.34 0.72 -0.29 0.00 0.00 176.35 176.44 1pms s PHE 481 N -2.63 -0.68 0.00 5.38 -0.12 -0.32 -2.25 117.98 117.35 1pms s PHE 481 Ca -0.04 0.84 0.00 0.00 -0.05 0.00 0.00 56.93 57.68 1pms s PHE 481 Cb -0.01 -0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.37 1pms s PHE 481 CO -0.04 -0.63 0.00 -3.47 -0.05 0.00 0.00 175.22 171.04 1pms n ASP 482 N 5.36 0.00 -1.68 1.98 2.03 -1.26 -0.49 116.55 122.49 1pms n ASP 482 Ca -0.05 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.09 1pms n ASP 482 Cb 0.50 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.96 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 6.08 2.62 0.27 0.00 -1.26 -4.68 105.19 108.23 1pms n GLY 483 Ca 0.00 -2.34 -0.29 0.00 0.00 0.00 0.00 46.02 43.40 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 -3.51 1.04 -0.61 0.99 0.20 0.36 -1.20 118.68 115.95 1pms s LEU 484 Ca 0.48 -1.25 -0.17 0.00 0.69 0.00 0.00 54.13 53.88 1pms s LEU 484 Cb 0.40 -0.50 0.13 0.00 -0.43 0.00 0.00 46.19 45.79 1pms s LEU 484 CO 0.01 -0.41 0.64 -0.32 -0.29 0.00 0.00 176.35 175.99 1pms s MET 485 N 1.95 3.11 0.38 1.98 -2.45 -0.39 -1.18 119.30 122.70 1pms s MET 485 Ca 0.07 -1.63 -0.01 0.00 -1.25 0.00 0.00 55.69 52.88 1pms s MET 485 Cb -0.16 -4.32 -0.03 0.00 1.25 0.00 0.00 34.83 31.56 1pms s MET 485 CO -0.27 -1.44 0.61 0.96 1.05 0.00 0.00 175.02 175.93 1pms s ILE 486 N 1.96 5.00 0.10 10.11 -4.36 0.11 -1.56 121.20 132.56 1pms s ILE 486 Ca 0.10 -0.32 -0.09 0.00 -0.26 0.00 0.00 60.65 60.08 1pms s ILE 486 Cb -0.24 -3.84 -0.00 0.00 1.25 0.00 0.00 42.46 39.62 1pms s ILE 486 CO 0.03 -0.61 0.20 0.00 0.24 0.00 0.00 174.94 174.80 1pms s LYS 489 N 2.16 3.16 0.88 0.00 0.00 -1.18 -2.17 119.74 122.59 1pms s LYS 489 Ca 0.08 -0.96 -0.12 0.00 0.00 0.00 0.00 55.97 54.98 1pms s LYS 489 Cb -0.16 -2.76 0.12 0.00 0.00 0.00 0.00 37.83 35.03 1pms s LYS 489 CO -0.32 0.27 1.12 -1.12 0.00 0.00 0.00 175.35 175.30 1pms s SER 490 N -4.02 3.79 -0.40 0.03 0.01 -1.26 -4.02 113.70 107.84 1pms s SER 490 Ca 0.38 1.08 -0.43 0.00 1.31 0.00 0.00 55.95 58.28 1pms s SER 490 Cb -0.09 -1.70 -0.18 0.00 0.21 0.00 0.00 66.02 64.26 1pms s SER 490 CO 0.29 -2.38 1.72 -0.46 0.41 0.00 0.00 173.24 172.81 1pms n ASN 491 N -3.67 1.73 -3.59 2.44 6.94 -1.26 -4.84 115.26 113.01 1pms n ASN 491 Ca 0.07 1.08 0.00 0.00 -0.02 0.00 0.00 54.58 55.71 1pms n ASN 491 Cb 0.58 -1.01 0.00 0.00 -2.36 0.00 0.00 39.78 37.00 1pms n ASN 491 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1pms n HIS 492 N 5.03 -0.28 0.00 -2.53 1.44 -1.26 -5.00 115.22 112.62 1pms n HIS 492 Ca 0.31 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.02 1pms n HIS 492 Cb 0.03 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.14 1pms n HIS 492 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1pms n GLY 493 N 2.07 0.65 3.83 -1.39 0.00 -1.26 -5.02 105.19 104.06 1pms n GLY 493 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 1.67 3.36 0.00 1.61 -0.21 -1.26 -5.06 119.66 119.78 1pms s GLN 494 Ca 0.00 1.01 0.00 0.00 0.02 0.00 0.00 55.36 56.39 1pms s GLN 494 Cb 0.00 -2.05 0.00 0.00 1.00 0.00 0.00 33.01 31.96 1pms s GLN 494 CO 0.00 -0.76 0.00 -0.35 -2.12 0.00 0.00 175.29 172.06 1pms n PRO 495 N -2.39 1.17 0.00 2.91 -0.04 -1.26 -5.06 135.00 130.33 1pms n PRO 495 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1pms n PRO 495 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 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 0.00 0.00 -0.10 0.54 1.74 -1.26 -4.95 116.66 112.63 1pms n ARG 496 Ca 0.00 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.86 1pms n ARG 496 Cb 0.00 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.32 1pms n ARG 496 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1pms n LEU 497 N -0.70 1.89 0.00 0.55 4.77 -1.26 -4.97 117.00 117.28 1pms n LEU 497 Ca 0.00 0.41 -0.05 0.00 -0.03 0.00 0.00 56.01 56.34 1pms n LEU 497 Cb 0.00 -0.97 0.03 0.00 -2.33 0.00 0.00 43.42 40.16 1pms n LEU 497 CO 0.00 0.31 0.14 -0.81 -1.33 0.00 0.00 177.39 175.70 1pms n PRO 498 N -4.39 -0.20 -1.27 3.23 -0.04 -1.26 -4.97 135.00 126.10 1pms n PRO 498 Ca -0.33 -0.34 -0.26 0.00 -0.04 0.00 0.00 63.50 62.53 1pms n PRO 498 Cb 0.70 -0.22 0.13 0.00 -0.04 0.00 0.00 33.50 34.08 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 3.59 5.23 1.64 0.55 0.00 -1.26 -4.61 105.19 110.33 1pms n GLY 499 Ca 0.03 -1.70 -0.04 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.03 -0.56 -2.93 4.61 0.00 -1.26 -4.88 120.51 114.46 1pms n ALA 500 Ca 0.56 -0.01 -0.32 0.00 0.00 0.00 0.00 53.44 53.68 1pms n ALA 500 Cb 1.15 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 1pms n ALA 500 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1pms n SER 501 N -1.57 5.30 0.00 0.00 7.64 -1.26 -4.51 113.62 119.21 1pms n SER 501 Ca -0.07 -3.64 0.00 0.00 1.01 0.00 0.00 58.87 56.18 1pms n SER 501 Cb 0.54 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 1pms n SER 501 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1pms n SER 502 N 0.07 0.00 -3.19 6.43 2.88 -1.26 -5.02 113.62 113.53 1pms n SER 502 Ca 0.35 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.68 1pms n SER 502 Cb 0.35 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.77 1pms n SER 502 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pms n ALA 503 N -0.31 2.29 -2.64 -1.46 0.00 -1.26 -5.09 120.51 112.05 1pms n ALA 503 Ca 0.00 -3.47 -0.38 0.00 0.00 0.00 0.00 53.44 49.60 1pms n ALA 503 Cb 0.00 -0.87 -0.06 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.95 4.23 -1.37 0.00 -1.05 -1.26 -4.10 118.70 113.19 1pms s GLU 504 Ca 0.38 0.44 -0.08 0.00 -0.15 0.00 0.00 54.97 55.56 1pms s GLU 504 Cb 0.27 -3.37 0.03 0.00 -0.44 0.00 0.00 34.13 30.62 1pms s GLU 504 CO -0.09 0.32 1.05 0.98 0.95 0.00 0.00 175.26 178.47 1pms n TYR 505 N 3.09 -2.52 0.00 4.83 4.19 -1.26 -4.92 117.16 120.57 1pms n TYR 505 Ca -0.09 0.96 0.00 0.00 3.31 0.00 0.00 57.90 62.08 1pms n TYR 505 Cb 0.52 -4.71 0.00 0.00 0.49 0.00 0.00 39.34 35.63 1pms n TYR 505 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1pms n ARG 506 N -4.70 0.00 -4.74 2.98 0.00 -1.26 -4.87 116.66 104.07 1pms n ARG 506 Ca -0.07 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.54 1pms n ARG 506 Cb 0.58 0.00 -0.16 0.00 0.00 0.00 0.00 32.46 32.89 1pms n ARG 506 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1pms s LEU 507 N 0.00 1.92 -0.11 6.15 0.20 -1.26 -4.79 118.68 120.79 1pms s LEU 507 Ca 0.00 -0.31 -0.04 0.00 0.69 0.00 0.00 54.13 54.47 1pms s LEU 507 Cb 0.00 -0.86 0.06 0.00 -0.43 0.00 0.00 46.19 44.95 1pms s LEU 507 CO 0.00 0.15 0.18 -1.59 -0.29 0.00 0.00 176.35 174.80 1pms s LYS 508 N -0.03 0.07 0.35 1.98 -2.85 -1.26 -3.12 119.74 114.87 1pms s LYS 508 Ca -0.01 0.51 0.07 0.00 -1.00 0.00 0.00 55.97 55.54 1pms s LYS 508 Cb -0.10 -0.44 -0.02 0.00 -2.06 0.00 0.00 37.83 35.22 1pms s LYS 508 CO 0.01 -0.37 0.40 -1.83 0.10 0.00 0.00 175.35 173.66 1pms s GLU 509 N 2.31 2.89 -0.15 1.78 -1.05 -1.00 -4.92 118.70 118.56 1pms s GLU 509 Ca 0.03 -1.19 -0.12 0.00 -0.15 0.00 0.00 54.97 53.55 1pms s GLU 509 Cb -0.13 -2.64 0.05 0.00 -0.44 0.00 0.00 34.13 30.97 1pms s GLU 509 CO -0.07 0.03 0.39 -1.59 0.95 0.00 0.00 175.26 174.97 1pms s LYS 510 N -4.11 0.42 0.21 -4.83 0.00 -1.26 -1.18 119.74 108.99 1pms s LYS 510 Ca 0.44 0.62 0.02 0.00 0.00 0.00 0.00 55.97 57.06 1pms s LYS 510 Cb -0.07 0.12 -0.05 0.00 0.00 0.00 0.00 37.83 37.82 1pms s LYS 510 CO 0.29 -0.10 0.01 -0.06 0.00 0.00 0.00 175.35 175.50 1pms s PHE 511 N 0.67 1.38 -0.57 1.78 0.40 -0.60 -4.98 117.98 116.06 1pms s PHE 511 Ca -0.04 -1.01 -0.19 0.00 -0.60 0.00 0.00 56.93 55.09 1pms s PHE 511 Cb -0.05 -0.80 0.08 0.00 0.51 0.00 0.00 43.02 42.77 1pms s PHE 511 CO -0.04 -0.17 0.70 -0.06 0.70 0.00 0.00 175.22 176.35 1pms s PHE 512 N -3.59 2.98 -0.98 0.36 0.08 -1.26 -1.27 117.98 114.30 1pms s PHE 512 Ca 0.28 -0.75 -0.03 0.00 0.12 0.00 0.00 56.93 56.55 1pms s PHE 512 Cb 0.06 -3.87 0.25 0.00 -0.57 0.00 0.00 43.02 38.90 1pms s PHE 512 CO 0.07 -1.23 2.11 -1.33 -0.10 0.00 0.00 175.22 174.74 1pms n MET 513 N 6.42 4.28 0.00 0.44 2.81 -0.34 -4.29 117.12 126.43 1pms n MET 513 Ca -0.08 -3.86 0.00 0.00 -1.81 0.00 0.00 57.70 51.96 1pms n MET 513 Cb 0.44 -2.42 0.00 0.00 -0.71 0.00 0.00 33.22 30.53 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 0.33 3.20 -0.93 0.03 0.00 -1.25 -4.07 116.66 113.97 1pms n ARG 514 Ca 0.52 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 58.35 1pms n ARG 514 Cb 0.29 -0.73 0.17 0.00 -0.00 0.00 0.00 32.46 32.18 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 -1.17 2.06 -4.45 2.89 -0.00 -1.26 -4.95 118.16 111.27 1pms n LYS 515 Ca 0.00 -3.47 -0.24 0.00 -0.00 0.00 0.00 58.31 54.60 1pms n LYS 515 Cb 0.00 -1.79 -0.10 0.00 -0.00 0.00 0.00 35.03 33.14 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 -3.54 2.57 -0.03 0.58 -7.23 -1.26 -4.40 120.40 107.09 1pms s VAL 516 Ca 0.42 -2.32 0.02 0.00 -1.81 0.00 0.00 61.98 58.29 1pms s VAL 516 Cb 0.39 -2.41 0.01 0.00 0.56 0.00 0.00 36.38 34.93 1pms s VAL 516 CO -0.04 -0.37 -0.08 -1.10 -0.31 0.00 0.00 175.10 173.20 1pms s GLN 517 N -3.54 0.87 0.08 4.82 -0.21 -1.25 -4.96 119.66 115.46 1pms s GLN 517 Ca 0.31 -0.26 -0.18 0.00 0.02 0.00 0.00 55.36 55.25 1pms s GLN 517 Cb -0.04 -0.82 -0.07 0.00 1.00 0.00 0.00 33.01 33.08 1pms s GLN 517 CO 0.16 0.08 0.56 -1.50 -2.12 0.00 0.00 175.29 172.47 1pms s ILE 518 N 0.27 4.77 -0.30 1.08 2.07 -1.26 -2.70 121.20 125.14 1pms s ILE 518 Ca -0.04 1.13 0.02 0.00 -1.41 0.00 0.00 60.65 60.35 1pms s ILE 518 Cb -0.09 -3.86 0.08 0.00 0.13 0.00 0.00 42.46 38.73 1pms s ILE 518 CO 0.00 0.49 0.01 0.20 -1.91 0.00 0.00 174.94 173.74 1pms s ASN 519 N -1.23 4.38 -0.02 4.50 -0.87 0.13 -4.90 114.94 116.93 1pms s ASN 519 Ca 0.30 -1.71 -0.30 0.00 -1.57 0.00 0.00 52.86 49.58 1pms s ASN 519 Cb -0.18 -1.38 -0.06 0.00 -0.02 0.00 0.00 41.25 39.60 1pms s ASN 519 CO 0.19 -0.32 1.65 1.51 -2.57 0.00 0.00 177.10 177.56 1pms s ASP 520 N 1.17 6.66 0.69 -1.22 -4.77 -1.26 -1.94 116.67 115.99 1pms s ASP 520 Ca 0.03 2.29 0.01 0.00 -3.30 0.00 0.00 52.55 51.59 1pms s ASP 520 Cb -0.19 -2.54 0.13 0.00 -1.09 0.00 0.00 42.92 39.23 1pms s ASP 520 CO -0.10 -0.91 0.90 0.29 0.70 0.00 0.00 175.17 176.05 1pms n LYS 521 N 6.76 0.04 -3.38 2.11 4.76 -1.26 -4.98 118.16 122.21 1pms n LYS 521 Ca 0.17 -2.55 -0.26 0.00 -2.87 0.00 0.00 58.31 52.80 1pms n LYS 521 Cb 0.42 -0.56 -0.08 0.00 -1.84 0.00 0.00 35.03 32.97 1pms n LYS 521 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1pms n ASP 522 N -2.84 1.91 -0.09 4.39 8.00 -1.26 -4.69 116.55 121.96 1pms n ASP 522 Ca 0.15 -3.03 -0.13 0.00 0.71 0.00 0.00 54.79 52.49 1pms n ASP 522 Cb 0.54 -0.66 -0.08 0.00 -0.02 0.00 0.00 41.12 40.90 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 4.37 -1.70 -4.45 -2.24 5.19 -1.87 -3.40 116.42 112.33 1pms h ASP 523 Ca 0.15 0.22 -0.65 0.00 -0.62 0.00 0.00 57.03 56.14 1pms h ASP 523 Cb 0.78 0.69 -0.30 0.00 0.18 0.00 0.00 39.33 40.68 1pms h ASP 523 CO 0.64 -0.42 -0.87 0.42 -3.12 0.00 0.00 179.24 175.88 1pms s THR 524 N -5.73 1.81 0.41 0.35 -4.23 -1.10 -4.98 115.64 102.18 1pms s THR 524 Ca -0.15 -0.98 0.29 0.00 -1.18 0.00 0.00 61.69 59.68 1pms s THR 524 Cb 0.09 -1.51 0.29 0.00 1.34 0.00 0.00 72.50 72.71 1pms s THR 524 CO 0.62 0.51 1.87 -1.28 -0.54 0.00 0.00 174.62 175.81 1pms h SER 525 N 5.63 0.00 -0.24 3.99 0.87 -2.00 0.85 113.55 122.65 1pms h SER 525 Ca -0.40 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 59.97 1pms h SER 525 Cb 1.14 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1pms h SER 525 CO 0.47 0.00 -0.61 -0.33 -0.53 0.00 0.00 176.83 175.83 1pms h GLU 526 N 0.00 0.83 0.00 2.24 4.39 -1.95 -3.48 114.58 116.61 1pms h GLU 526 Ca 0.00 -0.58 0.08 0.00 0.34 0.00 0.00 59.36 59.20 1pms h GLU 526 Cb 0.39 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 1pms h GLU 526 CO 0.00 1.20 0.30 0.98 -1.16 0.00 0.00 179.01 180.33 1pms n TYR 527 N -4.01 -1.03 -1.66 4.33 9.36 0.29 -5.18 117.16 119.27 1pms n TYR 527 Ca -0.06 -0.68 0.00 0.00 3.32 0.00 0.00 57.90 60.48 1pms n TYR 527 Cb 0.66 0.33 0.00 0.00 -0.63 0.00 0.00 39.34 39.70 1pms n TYR 527 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1pms n LYS 528 N -0.37 1.26 0.00 2.98 5.02 -1.26 -2.69 118.16 123.09 1pms n LYS 528 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1pms n LYS 528 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.32 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 -0.79 -0.31 -1.33 2.13 -0.00 -1.26 -4.73 115.22 108.92 1pms n HIS 529 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1pms n HIS 529 Cb 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 1pms n HIS 529 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1pms n ALA 530 N -1.75 0.00 -2.66 1.57 0.00 -1.26 -4.55 120.51 111.86 1pms n ALA 530 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1pms n ALA 530 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 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 0.00 0.09 -0.31 0.00 0.40 -0.45 -4.37 117.98 113.35 1pms s PHE 531 Ca 0.00 -0.47 -0.02 0.00 -0.60 0.00 0.00 56.93 55.84 1pms s PHE 531 Cb 0.00 -0.02 0.10 0.00 0.51 0.00 0.00 43.02 43.61 1pms s PHE 531 CO 0.00 -0.54 0.11 -2.00 0.70 0.00 0.00 175.22 173.49 1pms s GLU 532 N -3.61 0.58 0.36 0.44 -6.30 -0.82 -2.60 118.70 106.75 1pms s GLU 532 Ca 0.03 -0.94 0.01 0.00 -2.50 0.00 0.00 54.97 51.56 1pms s GLU 532 Cb 0.04 -1.78 -0.03 0.00 0.00 0.00 0.00 34.13 32.36 1pms s GLU 532 CO -0.10 -1.00 0.56 0.42 0.02 0.00 0.00 175.26 175.17 1pms s ILE 533 N 1.73 4.82 0.05 -3.70 1.01 -0.36 -0.69 121.20 124.06 1pms s ILE 533 Ca 0.10 -0.52 0.04 0.00 0.00 0.00 0.00 60.65 60.26 1pms s ILE 533 Cb -0.17 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 1pms s ILE 533 CO -0.28 -0.48 -0.11 -0.63 0.00 0.00 0.00 174.94 173.44 1pms s ILE 534 N -2.35 0.85 0.38 2.92 1.01 -1.10 0.54 121.20 123.46 1pms s ILE 534 Ca 0.42 -1.04 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 1pms s ILE 534 Cb -0.10 -0.83 -0.05 0.00 0.01 0.00 0.00 42.46 41.49 1pms s ILE 534 CO 0.36 -0.18 0.69 -0.76 0.00 0.00 0.00 174.94 175.05 1pms s LEU 535 N -1.37 3.87 -0.12 2.97 1.43 -0.71 -3.90 118.68 120.85 1pms s LEU 535 Ca -0.03 0.91 0.11 0.00 -1.03 0.00 0.00 54.13 54.09 1pms s LEU 535 Cb -0.09 -3.79 0.52 0.00 0.03 0.00 0.00 46.19 42.86 1pms s LEU 535 CO 0.01 -0.37 1.34 0.29 0.23 0.00 0.00 176.35 177.85 1pms n LYS 536 N -1.44 3.26 -0.08 1.70 5.02 -1.26 -4.11 118.16 121.25 1pms n LYS 536 Ca 0.00 -2.02 -0.16 0.00 -2.02 0.00 0.00 58.31 54.12 1pms n LYS 536 Cb 0.54 -1.87 -0.06 0.00 -0.02 0.00 0.00 35.03 33.63 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 0.54 1.34 0.00 4.39 8.00 -1.26 -5.01 116.55 124.54 1pms n ASP 537 Ca 0.18 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.84 1pms n ASP 537 Cb 0.77 -0.43 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 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 2.12 0.00 0.47 0.44 0.00 -1.26 -5.17 105.19 101.79 1pms n GLY 538 Ca -0.30 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.69 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 0.22 -3.71 1.61 4.13 -1.26 -5.02 115.26 111.22 1pms n ASN 539 Ca 0.00 -1.32 -0.15 0.00 1.68 0.00 0.00 54.58 54.80 1pms n ASN 539 Cb 0.00 0.21 -0.15 0.00 -1.54 0.00 0.00 39.78 38.31 1pms n ASN 539 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1pms s SER 540 N -1.34 0.24 -1.21 6.41 1.04 -1.26 -1.74 113.70 115.84 1pms s SER 540 Ca 0.05 0.32 -0.12 0.00 0.48 0.00 0.00 55.95 56.67 1pms s SER 540 Cb 0.00 0.23 0.19 0.00 0.10 0.00 0.00 66.02 66.54 1pms s SER 540 CO 0.03 -0.19 1.46 0.52 0.98 0.00 0.00 173.24 176.05 1pms n VAL 541 N 4.67 4.35 -3.62 5.02 0.31 0.19 -4.89 118.33 124.37 1pms n VAL 541 Ca -0.18 -4.81 -0.36 0.00 -0.01 0.00 0.00 64.34 58.98 1pms n VAL 541 Cb 0.51 -2.45 -0.08 0.00 -0.91 0.00 0.00 33.84 30.90 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 0.86 5.34 0.31 2.52 1.01 -1.26 -1.23 121.20 128.75 1pms s ILE 542 Ca 0.40 0.35 0.06 0.00 0.00 0.00 0.00 60.65 61.46 1pms s ILE 542 Cb -0.02 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 1pms s ILE 542 CO -0.00 0.37 0.24 0.72 0.00 0.00 0.00 174.94 176.27 1pms s PHE 543 N 0.72 1.65 -0.18 3.97 -0.71 -1.07 -2.73 117.98 119.63 1pms s PHE 543 Ca 0.11 -1.60 -0.07 0.00 -1.04 0.00 0.00 56.93 54.33 1pms s PHE 543 Cb -0.13 -0.71 0.08 0.00 -1.21 0.00 0.00 43.02 41.06 1pms s PHE 543 CO 0.03 -0.81 0.40 -1.54 -1.34 0.00 0.00 175.22 171.96 1pms s SER 544 N -3.34 -0.28 0.31 1.98 1.04 -0.09 -1.34 113.70 111.98 1pms s SER 544 Ca 0.40 0.92 -0.27 0.00 0.48 0.00 0.00 55.95 57.47 1pms s SER 544 Cb 0.03 1.09 -0.09 0.00 0.10 0.00 0.00 66.02 67.15 1pms s SER 544 CO 0.24 -0.22 0.99 0.00 0.98 0.00 0.00 173.24 175.24 1pms s ALA 545 N 2.18 3.25 -0.09 5.32 0.00 -1.26 -0.86 121.76 130.30 1pms s ALA 545 Ca -0.04 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 52.55 1pms s ALA 545 Cb -0.11 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1pms s ALA 545 CO -0.12 0.05 2.32 1.63 0.00 0.00 0.00 175.76 179.63 1pms n LYS 546 N 0.76 1.40 -2.83 0.00 4.76 -1.26 -4.65 118.16 116.34 1pms n LYS 546 Ca 0.01 -0.60 0.00 0.00 -2.87 0.00 0.00 58.31 54.85 1pms n LYS 546 Cb 0.48 -1.35 0.01 0.00 -1.84 0.00 0.00 35.03 32.33 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 1.41 -0.69 -0.10 4.39 7.64 -1.26 -5.01 113.62 120.01 1pms n SER 547 Ca 0.16 -1.23 -0.17 0.00 1.01 0.00 0.00 58.87 58.64 1pms n SER 547 Cb 0.59 1.08 -0.08 0.00 -1.01 0.00 0.00 64.21 64.79 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 -1.94 0.70 -0.19 -0.43 0.00 -1.26 -3.41 120.51 113.98 1pms n ALA 548 Ca -0.06 -0.51 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 1pms n ALA 548 Cb 0.29 -0.34 0.02 0.00 0.00 0.00 0.00 19.45 19.42 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 1.00 -0.48 0.00 4.39 -1.98 -2.56 114.58 113.95 1pms h GLU 549 Ca -0.26 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.12 1pms h GLU 549 Cb 1.07 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.61 1pms h GLU 549 CO -0.15 1.01 0.29 0.93 -1.16 0.00 0.00 179.01 179.93 1pms h GLU 550 N 0.88 0.64 0.71 2.33 4.39 -1.95 0.54 114.58 122.12 1pms h GLU 550 Ca 0.16 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.77 1pms h GLU 550 Cb 0.57 -0.14 0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1pms h GLU 550 CO 0.03 0.45 -0.34 0.87 -1.16 0.00 0.00 179.01 178.86 1pms h LYS 551 N 0.66 -0.92 0.00 2.33 1.57 -1.48 -2.31 116.57 116.42 1pms h LYS 551 Ca 0.17 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1pms h LYS 551 Cb -0.03 0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1pms h LYS 551 CO -0.03 -0.58 0.00 0.09 -0.57 0.00 0.00 179.45 178.35 1pms n ASN 552 N -5.44 0.00 0.13 0.86 3.02 -1.06 -2.71 115.26 110.06 1pms n ASN 552 Ca -0.13 0.33 -0.06 0.00 -0.03 0.00 0.00 54.58 54.69 1pms n ASN 552 Cb 0.39 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 1pms n ASN 552 CO 0.00 0.00 0.00 -1.13 -2.62 0.00 0.00 177.26 173.51 1pms h ASN 553 N 0.00 -0.31 -0.27 6.41 -0.00 0.66 -0.61 115.58 121.46 1pms h ASN 553 Ca 0.00 0.01 -0.10 0.00 -0.00 0.00 0.00 56.30 56.21 1pms h ASN 553 Cb 0.21 0.08 -0.02 0.00 -0.00 0.00 0.00 38.32 38.60 1pms h ASN 553 CO 0.00 -0.05 -0.18 -0.50 -0.00 0.00 0.00 177.43 176.70 1pms h TRP 554 N -0.72 0.80 -0.72 0.67 4.06 -1.58 -1.76 115.95 116.71 1pms h TRP 554 Ca -0.04 -0.16 -0.02 0.00 2.06 0.00 0.00 58.89 60.73 1pms h TRP 554 Cb 0.28 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 28.21 1pms h TRP 554 CO 0.04 0.84 0.36 1.98 -3.56 0.00 0.00 178.44 178.10 1pms h MET 555 N 0.64 1.01 0.07 0.49 1.85 -1.61 -2.79 114.93 114.60 1pms h MET 555 Ca 0.10 -0.13 -0.27 0.00 -0.61 0.00 0.00 59.70 58.80 1pms h MET 555 Cb 0.65 -0.19 0.01 0.00 0.43 0.00 0.00 31.60 32.50 1pms h MET 555 CO 0.05 0.76 -1.13 0.00 -0.40 0.00 0.00 176.91 176.19 1pms h ALA 556 N 1.39 0.15 0.00 0.39 0.00 -0.77 -3.12 119.26 117.30 1pms h ALA 556 Ca 0.25 -0.77 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 1pms h ALA 556 Cb 0.07 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1pms h ALA 556 CO -0.04 0.79 -0.00 0.00 0.00 0.00 0.00 179.25 180.00 1pms h ALA 557 N 0.51 1.23 0.00 0.00 0.00 -1.08 0.31 119.26 120.23 1pms h ALA 557 Ca -0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pms h ALA 557 Cb 1.80 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1pms h ALA 557 CO 0.20 0.01 -0.03 -0.07 0.00 0.00 0.00 179.25 179.36 1pms h LEU 558 N 0.00 0.00 0.00 0.00 3.38 -1.44 -2.92 115.31 114.33 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 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1pms h LEU 558 CO 0.00 0.35 0.00 -0.38 0.09 0.00 0.00 178.44 178.50 1pms n ILE 559 N -3.86 1.46 -0.07 1.22 -0.00 -1.17 -0.92 119.36 116.02 1pms n ILE 559 Ca -0.00 0.37 -0.14 0.00 -0.00 0.00 0.00 62.75 62.97 1pms n ILE 559 Cb 0.02 -1.24 -0.12 0.00 -0.00 0.00 0.00 39.64 38.29 1pms n ILE 559 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 1pms h SER 560 N 0.00 0.00 0.83 4.38 0.02 -0.44 -3.33 113.55 115.02 1pms h SER 560 Ca 0.00 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 1pms h SER 560 Cb 0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1pms h SER 560 CO 0.00 1.03 -0.17 0.18 -1.14 0.00 0.00 176.83 176.73 1pms n LEU 561 N -4.60 0.17 -0.12 5.07 7.99 -1.02 -3.73 117.00 120.75 1pms n LEU 561 Ca -0.12 0.33 -0.10 0.00 -0.01 0.00 0.00 56.01 56.11 1pms n LEU 561 Cb 0.47 -0.42 -0.02 0.00 -0.11 0.00 0.00 43.42 43.35 1pms n LEU 561 CO 0.30 0.04 0.79 -0.61 -1.51 0.00 0.00 177.39 176.41 1pms h GLN 562 N 0.00 0.62 -1.49 3.23 -0.00 -1.13 0.57 115.11 116.90 1pms h GLN 562 Ca 0.00 -0.19 0.43 0.00 -0.00 0.00 0.00 58.65 58.90 1pms h GLN 562 Cb 0.50 -0.06 -0.06 0.00 0.00 0.00 0.00 27.48 27.86 1pms h GLN 562 CO 0.00 0.72 1.08 1.88 0.00 0.00 0.00 178.83 182.51 1pms h TYR 563 N 0.44 0.00 0.00 3.99 -1.99 -1.68 -3.30 116.97 114.43 1pms h TYR 563 Ca 0.10 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.83 1pms h TYR 563 Cb 0.43 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.16 1pms h TYR 563 CO 0.03 0.00 0.00 2.89 -0.00 0.00 0.00 178.16 181.08 1pms n ARG 564 N -4.07 0.00 0.00 4.88 0.00 -0.95 -5.19 116.66 111.34 1pms n ARG 564 Ca 0.33 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 58.27 1pms n ARG 564 Cb 1.55 -0.05 0.53 0.00 -0.00 0.00 0.00 32.46 34.49 1pms n ARG 564 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08