#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 4.77 -0.53 -1.46 0.00 -1.26 -4.68 118.16 115.00 1pms n LYS 432 Ca 0.00 -3.92 -0.09 0.00 0.00 0.00 0.00 58.31 54.30 1pms n LYS 432 Cb 0.00 -2.52 0.09 0.00 0.00 0.00 0.00 35.03 32.60 1pms n LYS 432 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1pms n GLN 433 N 0.82 1.66 0.30 1.64 6.02 -1.26 -4.33 117.38 122.22 1pms n GLN 433 Ca 0.55 -1.34 0.20 0.00 -0.01 0.00 0.00 57.00 56.40 1pms n GLN 433 Cb 0.27 -1.55 1.08 0.00 1.02 0.00 0.00 30.24 31.05 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 1.07 0.00 0.04 1.08 3.38 -1.99 0.25 115.31 119.14 1pms h LEU 434 Ca 0.26 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.91 1pms h LEU 434 Cb 1.77 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.48 1pms h LEU 434 CO 0.47 0.00 -1.83 0.00 0.09 0.00 0.00 178.44 177.17 1pms n ALA 435 N -2.01 1.30 1.01 1.53 0.00 -1.26 -3.74 120.51 117.34 1pms n ALA 435 Ca -0.03 -0.73 0.13 0.00 0.00 0.00 0.00 53.44 52.82 1pms n ALA 435 Cb 0.06 -0.77 0.48 0.00 0.00 0.00 0.00 19.45 19.23 1pms n ALA 435 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1pms n ILE 436 N -3.18 0.00 0.23 0.00 5.41 -0.29 -3.14 119.36 118.38 1pms n ILE 436 Ca -0.22 -0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.64 1pms n ILE 436 Cb 1.05 -0.22 0.09 0.00 -0.71 0.00 0.00 39.64 39.85 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 0.01 0.00 -0.31 0.38 3.11 -0.69 -3.33 116.57 115.75 1pms h LYS 437 Ca 0.00 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.76 1pms h LYS 437 Cb 0.50 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.72 1pms h LYS 437 CO 0.00 0.00 -0.14 -0.22 -2.81 0.00 0.00 179.45 176.28 1pms h LYS 438 N 0.00 0.63 -0.88 1.90 3.64 -1.63 -3.01 116.57 117.23 1pms h LYS 438 Ca 0.00 -0.27 0.21 0.00 -1.27 0.00 0.00 60.65 59.32 1pms h LYS 438 Cb 0.95 -0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 32.63 1pms h LYS 438 CO 0.00 0.85 0.37 0.00 -2.27 0.00 0.00 179.45 178.40 1pms h MET 439 N 0.39 0.38 0.86 1.90 -0.00 -1.72 0.48 114.93 117.23 1pms h MET 439 Ca 0.07 -0.02 -0.04 0.00 -0.00 0.00 0.00 59.70 59.71 1pms h MET 439 Cb 0.66 -0.09 0.00 0.00 -0.00 0.00 0.00 31.60 32.17 1pms h MET 439 CO 0.04 0.25 -0.45 -0.91 -0.00 0.00 0.00 176.91 175.84 1pms h ASN 440 N 0.39 -1.10 0.26 -0.10 4.21 -1.71 0.13 115.58 117.66 1pms h ASN 440 Ca 0.54 0.05 0.00 0.00 1.21 0.00 0.00 56.30 58.10 1pms h ASN 440 Cb 1.01 0.30 0.00 0.00 -1.12 0.00 0.00 38.32 38.50 1pms h ASN 440 CO -0.52 -0.74 0.00 1.21 -1.29 0.00 0.00 177.43 176.09 1pms n GLU 441 N -5.62 0.03 0.02 0.81 2.13 -0.61 -1.56 120.64 115.85 1pms n GLU 441 Ca -0.15 0.32 0.03 0.00 0.66 0.00 0.00 57.16 58.01 1pms n GLU 441 Cb 0.49 -1.50 -0.09 0.00 0.27 0.00 0.00 31.44 30.61 1pms n GLU 441 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1pms n ILE 442 N -1.44 0.89 1.05 6.31 5.41 0.16 -1.44 119.36 130.29 1pms n ILE 442 Ca 0.03 -0.65 0.12 0.00 1.00 0.00 0.00 62.75 63.24 1pms n ILE 442 Cb 0.09 -0.50 0.15 0.00 -0.71 0.00 0.00 39.64 38.68 1pms n ILE 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pms n GLN 443 N -2.72 0.28 0.00 0.38 1.13 0.33 -4.10 117.38 112.68 1pms n GLN 443 Ca -0.09 -0.19 0.00 0.00 -1.94 0.00 0.00 57.00 54.78 1pms n GLN 443 Cb 0.77 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.63 1pms n GLN 443 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1pms n LYS 444 N -1.20 2.35 0.00 -1.09 3.00 -0.99 -4.09 118.16 116.14 1pms n LYS 444 Ca 0.07 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 58.52 1pms n LYS 444 Cb 0.35 -0.87 0.60 0.00 0.00 0.00 0.00 35.03 35.11 1pms n LYS 444 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1pms n ASN 445 N -1.38 0.62 0.00 3.14 5.15 -0.52 -3.93 115.26 118.33 1pms n ASN 445 Ca 0.00 -0.76 0.00 0.00 -0.60 0.00 0.00 54.58 53.22 1pms n ASN 445 Cb 0.21 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 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 -0.79 0.00 -4.30 -1.44 0.00 -1.26 -4.92 119.36 106.65 1pms n ILE 446 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.91 1pms n ILE 446 Cb 0.28 1.70 0.00 0.00 0.00 0.00 0.00 39.64 41.62 1pms n ILE 446 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1pms n ASP 447 N 0.00 0.00 -3.28 9.51 2.03 -1.25 -4.65 116.55 118.91 1pms n ASP 447 Ca 0.00 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.24 1pms n ASP 447 Cb 0.31 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.67 1pms n ASP 447 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1pms s GLY 448 N -0.36 -0.69 0.00 0.27 0.00 -1.26 -4.49 107.32 100.79 1pms s GLY 448 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.69 1pms s GLY 448 CO 0.00 3.21 0.00 -2.67 0.00 0.00 0.00 173.10 173.64 1pms n TRP 449 N 4.79 -0.58 -1.99 1.90 2.14 -1.26 -5.03 117.44 117.41 1pms n TRP 449 Ca 0.07 0.00 0.04 0.00 2.07 0.00 0.00 57.50 59.68 1pms n TRP 449 Cb 0.51 0.00 0.13 0.00 -0.81 0.00 0.00 31.31 31.13 1pms n TRP 449 CO 0.00 0.00 0.00 -0.85 2.07 0.00 0.00 177.69 178.91 1pms n GLU 450 N 0.00 1.10 0.05 -2.67 0.28 -1.26 -4.30 120.64 113.83 1pms n GLU 450 Ca 0.00 -2.87 0.00 0.00 -0.16 0.00 0.00 57.16 54.13 1pms n GLU 450 Cb 0.00 -1.05 0.00 0.00 1.43 0.00 0.00 31.44 31.82 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 -0.48 -0.09 3.80 -1.84 0.00 -1.26 -4.96 105.19 100.35 1pms n GLY 451 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1pms n GLY 451 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pms s LYS 452 N -1.51 2.26 -0.07 1.61 1.02 -1.26 -5.05 119.74 116.74 1pms s LYS 452 Ca 0.00 0.80 -0.14 0.00 0.02 0.00 0.00 55.97 56.65 1pms s LYS 452 Cb 0.00 -1.93 0.03 0.00 -0.52 0.00 0.00 37.83 35.41 1pms s LYS 452 CO 0.00 -1.54 0.34 0.16 -0.92 0.00 0.00 175.35 173.39 1pms s ASP 453 N -3.78 -0.29 -0.03 2.83 1.47 -1.26 -4.59 116.67 111.02 1pms s ASP 453 Ca 0.60 0.41 0.08 0.00 1.18 0.00 0.00 52.55 54.82 1pms s ASP 453 Cb -0.15 0.52 -0.12 0.00 -0.34 0.00 0.00 42.92 42.83 1pms s ASP 453 CO 0.55 -0.29 0.13 0.00 0.68 0.00 0.00 175.17 176.24 1pms n ILE 454 N 2.06 0.19 -2.50 2.11 0.13 -1.26 -4.86 119.36 115.23 1pms n ILE 454 Ca -0.17 -0.24 -0.25 0.00 -1.10 0.00 0.00 62.75 60.99 1pms n ILE 454 Cb 0.57 -0.07 0.04 0.00 -0.84 0.00 0.00 39.64 39.34 1pms n ILE 454 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 1pms s GLY 455 N -3.32 1.67 -0.13 4.50 0.00 -1.26 -4.97 107.32 103.82 1pms s GLY 455 Ca -0.03 -0.96 -0.05 0.00 0.00 0.00 0.00 44.72 43.67 1pms s GLY 455 CO 0.34 -0.66 0.33 -0.18 0.00 0.00 0.00 173.10 172.93 1pms n GLN 456 N -2.54 0.75 -0.94 2.90 -0.06 -1.26 -4.59 117.38 111.65 1pms n GLN 456 Ca 0.06 0.25 -0.03 0.00 -2.00 0.00 0.00 57.00 55.28 1pms n GLN 456 Cb 0.59 -1.70 -0.03 0.00 -4.06 0.00 0.00 30.24 25.04 1pms n GLN 456 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1pms n ASN 459 N -0.08 0.00 -1.19 0.00 3.02 -1.11 -4.75 115.26 111.15 1pms n ASN 459 Ca -0.07 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.46 1pms n ASN 459 Cb 0.92 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 40.08 1pms n ASN 459 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1pms n GLU 460 N 0.00 -1.21 -2.24 3.52 0.28 -1.26 -3.44 120.64 116.29 1pms n GLU 460 Ca 0.00 0.11 -0.02 0.00 -0.16 0.00 0.00 57.16 57.09 1pms n GLU 460 Cb 0.00 -4.19 0.00 0.00 1.43 0.00 0.00 31.44 28.69 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 -1.26 -0.13 0.31 -1.84 3.72 -1.25 -4.67 117.46 112.32 1pms n PHE 461 Ca -0.02 0.06 0.19 0.00 -0.05 0.00 0.00 57.45 57.62 1pms n PHE 461 Cb 0.10 -0.15 0.98 0.00 -0.94 0.00 0.00 39.48 39.47 1pms n PHE 461 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1pms h ILE 462 N 0.73 0.12 -1.85 4.37 2.10 0.98 -3.33 117.51 120.64 1pms h ILE 462 Ca -0.04 0.00 -0.39 0.00 1.08 0.00 0.00 64.86 65.52 1pms h ILE 462 Cb 0.09 0.84 -0.30 0.00 -1.09 0.00 0.00 36.82 36.36 1pms h ILE 462 CO 0.02 0.00 -0.73 -0.04 -1.08 0.00 0.00 178.15 176.32 1pms s MET 463 N -4.25 0.83 -0.57 2.19 -1.94 -1.09 -4.95 119.30 109.53 1pms s MET 463 Ca -0.04 -1.32 -0.20 0.00 -1.71 0.00 0.00 55.69 52.42 1pms s MET 463 Cb 0.12 -0.78 0.08 0.00 2.01 0.00 0.00 34.83 36.26 1pms s MET 463 CO 0.39 -1.29 0.73 -1.21 -0.01 0.00 0.00 175.02 173.63 1pms s GLU 464 N 0.85 3.10 0.00 2.03 0.41 -1.25 -2.23 118.70 121.61 1pms s GLU 464 Ca 0.25 -1.02 0.00 0.00 -0.41 0.00 0.00 54.97 53.79 1pms s GLU 464 Cb -0.05 -4.19 0.00 0.00 -1.78 0.00 0.00 34.13 28.11 1pms s GLU 464 CO -0.09 -1.46 0.00 0.41 -0.49 0.00 0.00 175.26 173.63 1pms n GLY 465 N 5.24 1.59 2.89 -1.39 0.00 -1.17 -4.84 105.19 107.52 1pms n GLY 465 Ca -0.07 0.29 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 1.98 -0.03 0.01 2.61 -4.23 -1.26 -2.64 115.64 112.08 1pms s THR 466 Ca 0.00 0.12 -0.08 0.00 -1.18 0.00 0.00 61.69 60.55 1pms s THR 466 Cb 0.00 -0.15 0.00 0.00 1.34 0.00 0.00 72.50 73.69 1pms s THR 466 CO 0.00 0.05 0.15 -0.22 -0.54 0.00 0.00 174.62 174.05 1pms s LEU 467 N 0.68 1.54 0.00 4.79 1.98 -1.17 -4.47 118.68 122.03 1pms s LEU 467 Ca -0.05 -0.28 0.00 0.00 -2.89 0.00 0.00 54.13 50.90 1pms s LEU 467 Cb -0.07 0.73 0.00 0.00 0.66 0.00 0.00 46.19 47.51 1pms s LEU 467 CO -0.03 -0.43 0.00 1.07 -1.89 0.00 0.00 176.35 175.07 1pms n THR 468 N 1.19 0.00 -3.77 3.68 5.66 0.18 -2.86 114.28 118.36 1pms n THR 468 Ca -0.21 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.46 1pms n THR 468 Cb 0.57 -0.40 -0.09 0.00 -1.55 0.00 0.00 70.33 68.86 1pms n THR 468 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1pms s ARG 469 N -1.72 2.86 3.15 1.09 0.52 -1.26 -1.10 118.95 122.49 1pms s ARG 469 Ca 0.00 -3.28 0.00 0.00 -0.52 0.00 0.00 55.73 51.93 1pms s ARG 469 Cb 0.00 -3.70 0.00 0.00 0.52 0.00 0.00 34.95 31.77 1pms s ARG 469 CO 0.00 -1.27 0.00 0.28 0.02 0.00 0.00 175.30 174.33 1pms n VAL 470 N 2.21 0.00 -1.74 3.52 0.31 -0.99 -3.96 118.33 117.68 1pms n VAL 470 Ca 0.20 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 64.13 1pms n VAL 470 Cb 0.36 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.28 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 0.00 4.67 3.96 2.92 0.00 -1.26 -4.06 105.19 111.41 1pms n GLY 471 Ca 0.00 -1.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.01 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 0.96 3.68 -1.27 4.61 0.00 -1.25 -5.01 121.76 123.47 1pms s ALA 472 Ca 0.57 -1.13 0.14 0.00 0.00 0.00 0.00 51.96 51.54 1pms s ALA 472 Cb 0.16 -2.23 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 1pms s ALA 472 CO -0.07 -0.75 0.78 1.63 0.00 0.00 0.00 175.76 177.35 1pms n LYS 473 N -2.40 1.83 -3.50 0.00 5.02 -1.26 -4.73 118.16 113.12 1pms n LYS 473 Ca 0.06 -0.71 -0.27 0.00 -2.02 0.00 0.00 58.31 55.38 1pms n LYS 473 Cb 0.59 -1.21 -0.10 0.00 -0.02 0.00 0.00 35.03 34.29 1pms n LYS 473 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1pms n HIS 474 N -0.23 0.54 -0.81 2.13 1.44 -1.26 -5.12 115.22 111.92 1pms n HIS 474 Ca 0.06 -3.66 -0.30 0.00 -2.01 0.00 0.00 57.72 51.81 1pms n HIS 474 Cb 0.30 -0.10 0.26 0.00 0.12 0.00 0.00 29.99 30.56 1pms n HIS 474 CO 0.00 0.00 0.00 -1.83 -2.81 0.00 0.00 176.34 171.70 1pms s GLU 475 N -0.68 -1.90 0.06 -1.40 1.03 -1.26 -4.92 118.70 109.64 1pms s GLU 475 Ca 0.32 0.01 -0.03 0.00 0.03 0.00 0.00 54.97 55.30 1pms s GLU 475 Cb 0.04 -1.51 -0.03 0.00 -0.80 0.00 0.00 34.13 31.83 1pms s GLU 475 CO -0.17 -4.17 0.02 1.03 -1.33 0.00 0.00 175.26 170.64 1pms s ARG 476 N -5.28 0.68 0.64 -4.83 3.00 -1.14 -5.00 118.95 107.03 1pms s ARG 476 Ca 0.70 -1.19 -0.18 0.00 0.00 0.00 0.00 55.73 55.07 1pms s ARG 476 Cb -0.11 0.24 -0.02 0.00 0.00 0.00 0.00 34.95 35.06 1pms s ARG 476 CO 0.57 -0.15 1.08 0.72 0.00 0.00 0.00 175.30 177.52 1pms n HIS 477 N 0.06 1.18 -4.11 -0.53 8.25 -0.58 -3.07 115.22 116.44 1pms n HIS 477 Ca -0.14 0.42 -0.08 0.00 -0.26 0.00 0.00 57.72 57.66 1pms n HIS 477 Cb 0.61 -2.17 -0.10 0.00 1.12 0.00 0.00 29.99 29.45 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 -1.52 0.38 -0.27 1.59 -1.09 -1.08 -1.57 121.20 117.63 1pms s ILE 478 Ca 0.78 -1.77 -0.01 0.00 -2.23 0.00 0.00 60.65 57.43 1pms s ILE 478 Cb -0.39 -1.46 0.13 0.00 -1.58 0.00 0.00 42.46 39.16 1pms s ILE 478 CO 0.45 -0.91 0.31 -0.36 -1.23 0.00 0.00 174.94 173.20 1pms s PHE 479 N -3.58 -0.56 -0.20 3.97 0.08 -0.76 -3.02 117.98 113.91 1pms s PHE 479 Ca 0.06 0.11 -0.21 0.00 0.12 0.00 0.00 56.93 57.02 1pms s PHE 479 Cb 0.05 -0.33 -0.02 0.00 -0.57 0.00 0.00 43.02 42.15 1pms s PHE 479 CO -0.07 -0.85 0.62 -1.17 -0.10 0.00 0.00 175.22 173.65 1pms s LEU 480 N 2.41 4.14 -0.74 -0.37 2.96 -0.95 -2.32 118.68 123.82 1pms s LEU 480 Ca 0.10 0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 54.79 1pms s LEU 480 Cb -0.14 -2.88 0.22 0.00 0.50 0.00 0.00 46.19 43.89 1pms s LEU 480 CO -0.26 -0.28 2.33 0.49 -1.32 0.00 0.00 176.35 177.31 1pms n PHE 481 N 5.09 2.39 -2.22 5.38 3.01 -0.51 0.13 117.46 130.74 1pms n PHE 481 Ca -0.01 -2.22 -0.01 0.00 1.01 0.00 0.00 57.45 56.21 1pms n PHE 481 Cb 0.50 -1.30 -0.00 0.00 -0.01 0.00 0.00 39.48 38.66 1pms n PHE 481 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1pms n ASP 482 N 0.19 -1.11 0.00 4.37 5.75 -1.23 -2.76 116.55 121.76 1pms n ASP 482 Ca 0.52 0.39 0.00 0.00 -0.01 0.00 0.00 54.79 55.69 1pms n ASP 482 Cb 0.36 -1.14 0.00 0.00 -1.03 0.00 0.00 41.12 39.31 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 -0.43 0.22 3.79 6.12 0.00 -1.26 -4.77 105.19 108.86 1pms n GLY 483 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 3.64 -0.31 0.99 2.96 -1.14 0.72 118.68 125.54 1pms s LEU 484 Ca 0.00 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.51 1pms s LEU 484 Cb 0.00 -2.18 0.10 0.00 0.50 0.00 0.00 46.19 44.61 1pms s LEU 484 CO 0.00 -0.10 0.11 -0.32 -1.32 0.00 0.00 176.35 174.72 1pms s MET 485 N -3.84 0.64 0.27 1.98 -2.45 -0.98 -1.42 119.30 113.50 1pms s MET 485 Ca 0.34 -1.01 0.07 0.00 -1.25 0.00 0.00 55.69 53.84 1pms s MET 485 Cb -0.07 -1.84 -0.03 0.00 1.25 0.00 0.00 34.83 34.13 1pms s MET 485 CO 0.24 -1.00 0.20 0.96 1.05 0.00 0.00 175.02 176.47 1pms s ILE 486 N 1.65 4.12 0.01 10.11 -0.00 -0.98 -0.72 121.20 135.40 1pms s ILE 486 Ca 0.10 -1.44 -0.13 0.00 -0.00 0.00 0.00 60.65 59.18 1pms s ILE 486 Cb -0.17 -3.30 0.02 0.00 -0.00 0.00 0.00 42.46 39.00 1pms s ILE 486 CO -0.26 -0.31 0.27 0.00 -0.00 0.00 0.00 174.94 174.64 1pms n LYS 489 N 0.11 0.00 -1.69 0.00 0.00 -1.26 -1.52 118.16 113.80 1pms n LYS 489 Ca -0.14 0.00 -0.44 0.00 0.00 0.00 0.00 58.31 57.73 1pms n LYS 489 Cb 0.61 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.62 1pms n LYS 489 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1pms n SER 490 N 0.00 2.98 -0.00 3.14 3.41 -1.26 -4.70 113.62 117.19 1pms n SER 490 Ca 0.00 1.15 -0.00 0.00 -0.26 0.00 0.00 58.87 59.76 1pms n SER 490 Cb 0.00 -1.47 -0.00 0.00 -0.26 0.00 0.00 64.21 62.48 1pms n SER 490 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1pms h ASN 491 N 4.19 0.00 -1.37 4.04 -0.73 -1.89 -3.37 115.58 116.44 1pms h ASN 491 Ca -0.45 0.00 -0.61 0.00 1.87 0.00 0.00 56.30 57.11 1pms h ASN 491 Cb 1.27 0.00 -0.20 0.00 0.27 0.00 0.00 38.32 39.66 1pms h ASN 491 CO 0.75 0.04 0.80 1.41 -0.37 0.00 0.00 177.43 180.06 1pms n HIS 492 N -2.22 2.10 -0.79 0.67 8.25 -1.26 -5.00 115.22 116.96 1pms n HIS 492 Ca -0.00 -2.16 0.11 0.00 -0.26 0.00 0.00 57.72 55.41 1pms n HIS 492 Cb 0.00 -1.37 -0.03 0.00 1.12 0.00 0.00 29.99 29.71 1pms n HIS 492 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pms n GLY 493 N 0.56 -1.03 3.67 -1.41 0.00 -1.26 -4.48 105.19 101.25 1pms n GLY 493 Ca 0.51 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.70 4.32 0.80 1.61 -0.21 -1.26 -4.99 119.66 118.22 1pms s GLN 494 Ca 0.00 1.09 -0.12 0.00 0.02 0.00 0.00 55.36 56.35 1pms s GLN 494 Cb 0.00 -3.57 0.07 0.00 1.00 0.00 0.00 33.01 30.51 1pms s GLN 494 CO 0.00 -0.34 1.13 -1.25 -2.12 0.00 0.00 175.29 172.71 1pms s PRO 495 N 2.18 2.09 0.12 2.91 0.04 -1.26 -4.98 135.00 136.10 1pms s PRO 495 Ca 0.40 0.33 -0.19 0.00 0.04 0.00 0.00 61.00 61.58 1pms s PRO 495 Cb -0.17 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 1pms s PRO 495 CO 0.13 -1.55 1.77 0.00 0.04 0.00 0.00 177.00 177.39 1pms h ARG 496 N -1.03 0.26 -1.66 4.56 3.08 -1.98 -3.45 114.38 114.15 1pms h ARG 496 Ca -0.47 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 59.61 1pms h ARG 496 Cb 1.30 -0.06 -0.23 0.00 0.08 0.00 0.00 29.97 31.06 1pms h ARG 496 CO 0.63 0.17 0.44 -0.48 -1.07 0.00 0.00 179.97 179.67 1pms s LEU 497 N -10.19 -0.46 0.44 3.04 2.34 -1.26 -5.16 118.68 107.44 1pms s LEU 497 Ca -0.13 0.63 -0.21 0.00 0.06 0.00 0.00 54.13 54.48 1pms s LEU 497 Cb 0.09 2.01 -0.10 0.00 -0.56 0.00 0.00 46.19 47.62 1pms s LEU 497 CO 0.69 -0.33 0.99 -2.16 -1.06 0.00 0.00 176.35 174.48 1pms s PRO 498 N -0.70 4.10 0.00 1.48 0.04 -1.26 -3.89 135.00 134.77 1pms s PRO 498 Ca -0.02 1.24 0.00 0.00 0.04 0.00 0.00 61.00 62.26 1pms s PRO 498 Cb -0.02 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1pms s PRO 498 CO 0.01 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.30 1pms n GLY 499 N -0.38 0.71 0.74 0.56 0.00 -1.26 -4.95 105.19 100.61 1pms n GLY 499 Ca 0.07 -0.37 -0.02 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.50 2.29 -0.03 4.61 0.00 -1.25 -4.98 120.51 120.65 1pms n ALA 500 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.17 1pms n ALA 500 Cb 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 19.45 19.55 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 -3.39 0.92 0.00 0.00 7.64 -1.26 -5.12 113.62 112.41 1pms n SER 501 Ca -0.03 0.15 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1pms n SER 501 Cb 0.11 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 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 -3.56 0.00 -4.80 6.43 2.88 -1.26 -5.16 113.62 108.15 1pms n SER 502 Ca -0.13 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.08 1pms n SER 502 Cb 0.46 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.86 1pms n SER 502 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pms s ALA 503 N -1.18 3.64 -0.04 -1.46 0.00 -1.26 -4.94 121.76 116.53 1pms s ALA 503 Ca 0.00 -0.88 0.13 0.00 0.00 0.00 0.00 51.96 51.21 1pms s ALA 503 Cb 0.00 -1.60 0.24 0.00 0.00 0.00 0.00 23.12 21.75 1pms s ALA 503 CO 0.00 0.71 1.10 0.39 0.00 0.00 0.00 175.76 177.97 1pms n GLU 504 N 1.00 0.35 -2.54 0.00 -0.58 -1.26 -5.07 120.64 112.53 1pms n GLU 504 Ca -0.12 -1.82 -0.41 0.00 -0.42 0.00 0.00 57.16 54.40 1pms n GLU 504 Cb 0.52 -0.58 -0.04 0.00 -0.57 0.00 0.00 31.44 30.77 1pms n GLU 504 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 1pms s TYR 505 N -0.74 3.61 0.00 -0.32 5.04 -1.26 -4.43 117.35 119.25 1pms s TYR 505 Ca 0.20 1.60 0.00 0.00 -2.44 0.00 0.00 57.07 56.43 1pms s TYR 505 Cb 0.21 -3.25 0.00 0.00 0.35 0.00 0.00 41.96 39.27 1pms s TYR 505 CO -0.06 -0.54 0.00 2.89 -1.34 0.00 0.00 175.55 176.50 1pms n ARG 506 N 2.68 -1.30 -0.70 4.97 1.85 -1.26 -5.06 116.66 117.84 1pms n ARG 506 Ca 0.04 0.00 -0.26 0.00 -1.00 0.00 0.00 57.85 56.62 1pms n ARG 506 Cb 0.47 0.00 0.12 0.00 -1.05 0.00 0.00 32.46 32.00 1pms n ARG 506 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 1pms n LEU 507 N 0.00 -2.14 0.00 2.89 -0.00 -1.26 -4.34 117.00 112.14 1pms n LEU 507 Ca 0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 56.01 55.83 1pms n LEU 507 Cb 0.00 -0.75 0.00 0.00 -0.00 0.00 0.00 43.42 42.67 1pms n LEU 507 CO 0.00 -2.91 0.00 0.29 -0.00 0.00 0.00 177.39 174.77 1pms n LYS 508 N -0.60 0.00 -4.26 1.47 4.76 -0.56 -4.72 118.16 114.26 1pms n LYS 508 Ca 0.02 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.31 1pms n LYS 508 Cb 0.51 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.61 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 0.00 1.34 0.05 1.97 -1.05 -1.09 -5.00 118.70 114.92 1pms s GLU 509 Ca 0.00 -1.73 -0.14 0.00 -0.15 0.00 0.00 54.97 52.96 1pms s GLU 509 Cb 0.00 0.07 0.02 0.00 -0.44 0.00 0.00 34.13 33.79 1pms s GLU 509 CO 0.00 -0.39 0.31 -1.59 0.95 0.00 0.00 175.26 174.54 1pms s LYS 510 N -4.04 0.83 0.23 -4.83 -2.85 -1.26 -1.34 119.74 106.49 1pms s LYS 510 Ca 0.38 -0.53 -0.02 0.00 -1.00 0.00 0.00 55.97 54.80 1pms s LYS 510 Cb 0.07 0.36 0.01 0.00 -2.06 0.00 0.00 37.83 36.20 1pms s LYS 510 CO 0.14 -0.27 0.34 1.19 0.10 0.00 0.00 175.35 176.85 1pms n PHE 511 N 0.50 -1.17 -3.87 1.78 3.01 0.11 -4.98 117.46 112.84 1pms n PHE 511 Ca -0.18 -1.52 -0.35 0.00 1.01 0.00 0.00 57.45 56.41 1pms n PHE 511 Cb 0.60 0.38 -0.13 0.00 -0.01 0.00 0.00 39.48 40.32 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 -3.71 3.48 -1.14 1.38 0.08 -1.26 -2.30 117.98 114.50 1pms s PHE 512 Ca 0.18 -2.28 -0.09 0.00 0.12 0.00 0.00 56.93 54.86 1pms s PHE 512 Cb -0.01 -2.71 0.26 0.00 -0.57 0.00 0.00 43.02 39.99 1pms s PHE 512 CO 0.13 -0.90 1.25 -1.33 -0.10 0.00 0.00 175.22 174.28 1pms n MET 513 N 4.56 3.63 0.00 0.44 2.81 0.22 -4.48 117.12 124.30 1pms n MET 513 Ca -0.06 -4.32 0.00 0.00 -1.81 0.00 0.00 57.70 51.51 1pms n MET 513 Cb 0.42 -2.66 0.00 0.00 -0.71 0.00 0.00 33.22 30.28 1pms n MET 513 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1pms n ARG 514 N 3.15 0.03 -0.99 0.03 3.00 -1.20 -4.07 116.66 116.61 1pms n ARG 514 Ca 0.27 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 58.02 1pms n ARG 514 Cb 0.39 -0.51 0.25 0.00 0.00 0.00 0.00 32.46 32.59 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 -1.23 2.91 -4.42 5.56 0.00 -1.26 -4.90 118.16 114.82 1pms n LYS 515 Ca 0.00 -3.07 -0.24 0.00 -0.00 0.00 0.00 58.31 55.00 1pms n LYS 515 Cb 0.01 -2.10 -0.09 0.00 -0.00 0.00 0.00 35.03 32.85 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 -3.11 2.70 -0.03 0.58 -7.23 -1.26 -4.69 120.40 107.35 1pms s VAL 516 Ca 0.53 -2.24 0.03 0.00 -1.81 0.00 0.00 61.98 58.49 1pms s VAL 516 Cb 0.44 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.88 1pms s VAL 516 CO 0.10 -0.36 -0.11 -1.10 -0.31 0.00 0.00 175.10 173.32 1pms s GLN 517 N -3.58 1.21 -0.17 4.82 1.11 -1.26 -4.97 119.66 116.83 1pms s GLN 517 Ca 0.31 -0.38 -0.14 0.00 0.01 0.00 0.00 55.36 55.16 1pms s GLN 517 Cb -0.04 -1.09 -0.04 0.00 -1.01 0.00 0.00 33.01 30.82 1pms s GLN 517 CO 0.17 0.13 0.32 -1.50 0.01 0.00 0.00 175.29 174.42 1pms s ILE 518 N 0.22 5.28 0.55 1.08 -1.16 -1.26 -2.77 121.20 123.14 1pms s ILE 518 Ca -0.04 0.59 0.04 0.00 -0.51 0.00 0.00 60.65 60.72 1pms s ILE 518 Cb -0.10 -3.66 0.03 0.00 0.61 0.00 0.00 42.46 39.34 1pms s ILE 518 CO 0.01 0.36 0.28 0.20 -2.81 0.00 0.00 174.94 172.98 1pms s ASN 519 N 0.60 4.46 0.32 4.50 0.01 -0.99 -4.93 114.94 118.91 1pms s ASN 519 Ca 0.17 -1.43 0.05 0.00 -0.71 0.00 0.00 52.86 50.94 1pms s ASN 519 Cb -0.13 0.57 -0.06 0.00 0.41 0.00 0.00 41.25 42.04 1pms s ASN 519 CO 0.05 -1.08 0.02 -0.62 -1.51 0.00 0.00 177.10 173.96 1pms s ASP 520 N -4.17 2.58 0.22 -1.22 2.15 -1.26 -2.43 116.67 112.54 1pms s ASP 520 Ca 0.22 -1.32 0.01 0.00 0.43 0.00 0.00 52.55 51.89 1pms s ASP 520 Cb -0.01 -0.13 -0.00 0.00 -0.30 0.00 0.00 42.92 42.47 1pms s ASP 520 CO 0.14 -0.52 0.03 0.29 -0.17 0.00 0.00 175.17 174.94 1pms n LYS 521 N -0.67 1.13 -2.62 4.34 4.76 -1.26 -4.90 118.16 118.94 1pms n LYS 521 Ca -0.03 -1.70 -0.28 0.00 -2.87 0.00 0.00 58.31 53.43 1pms n LYS 521 Cb 0.66 0.65 -0.01 0.00 -1.84 0.00 0.00 35.03 34.49 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 -1.43 4.79 -1.69 4.39 9.92 -1.26 -5.03 116.55 126.23 1pms n ASP 522 Ca -0.07 -3.71 0.00 0.00 -0.53 0.00 0.00 54.79 50.48 1pms n ASP 522 Cb 0.30 -0.53 0.00 0.00 -0.64 0.00 0.00 41.12 40.25 1pms n ASP 522 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1pms n ASP 523 N -0.39 0.00 -4.28 -2.24 5.75 -1.26 -5.07 116.55 109.06 1pms n ASP 523 Ca 0.37 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.87 1pms n ASP 523 Cb 0.54 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.48 1pms n ASP 523 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1pms s THR 524 N 0.00 1.87 0.66 2.12 -4.23 -1.24 -4.98 115.64 109.85 1pms s THR 524 Ca 0.00 -1.18 0.27 0.00 -1.18 0.00 0.00 61.69 59.60 1pms s THR 524 Cb 0.00 -1.59 0.27 0.00 1.34 0.00 0.00 72.50 72.53 1pms s THR 524 CO 0.00 0.36 1.82 0.28 -0.54 0.00 0.00 174.62 176.55 1pms h SER 525 N 5.09 0.00 -0.31 3.99 0.02 -1.99 0.28 113.55 120.63 1pms h SER 525 Ca -0.43 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.56 1pms h SER 525 Cb 1.14 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.64 1pms h SER 525 CO 0.45 0.00 0.08 -0.33 -1.14 0.00 0.00 176.83 175.89 1pms h GLU 526 N 0.00 0.19 0.00 3.45 5.08 -2.03 -3.48 114.58 117.79 1pms h GLU 526 Ca 0.01 -0.01 0.28 0.00 -1.00 0.00 0.00 59.36 58.64 1pms h GLU 526 Cb 0.83 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.99 1pms h GLU 526 CO -0.00 0.12 0.72 0.66 -1.00 0.00 0.00 179.01 179.51 1pms n TYR 527 N -5.07 -0.18 -0.89 4.33 4.01 0.09 -4.97 117.16 114.48 1pms n TYR 527 Ca 0.00 -0.46 0.00 0.00 -0.16 0.00 0.00 57.90 57.28 1pms n TYR 527 Cb 0.13 0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 1pms n TYR 527 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1pms n LYS 528 N -0.71 -0.09 -1.58 -0.72 3.00 -1.26 -3.60 118.16 113.19 1pms n LYS 528 Ca 0.04 0.02 -0.40 0.00 -0.00 0.00 0.00 58.31 57.98 1pms n LYS 528 Cb 0.43 -3.13 -0.02 0.00 0.00 0.00 0.00 35.03 32.32 1pms n LYS 528 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 1pms n HIS 529 N -2.12 2.66 -0.57 5.64 -0.00 -1.26 -4.75 115.22 114.83 1pms n HIS 529 Ca 0.00 -3.00 0.00 0.00 0.46 0.00 0.00 57.72 55.18 1pms n HIS 529 Cb 0.02 -2.34 0.00 0.00 -0.12 0.00 0.00 29.99 27.56 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 3.61 0.00 -2.85 1.57 0.00 -1.26 -4.86 120.51 116.72 1pms n ALA 530 Ca 0.69 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 54.03 1pms n ALA 530 Cb 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.64 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 3.32 0.04 -0.29 0.00 0.40 -0.91 -4.53 117.98 116.01 1pms s PHE 531 Ca 0.00 -0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.06 1pms s PHE 531 Cb 0.00 -0.01 0.09 0.00 0.51 0.00 0.00 43.02 43.61 1pms s PHE 531 CO 0.00 -0.46 0.05 -1.83 0.70 0.00 0.00 175.22 173.68 1pms s GLU 532 N -2.74 1.13 0.46 0.44 -1.05 -1.02 -2.34 118.70 113.59 1pms s GLU 532 Ca -0.04 -1.24 -0.03 0.00 -0.15 0.00 0.00 54.97 53.51 1pms s GLU 532 Cb -0.00 -2.47 -0.03 0.00 -0.44 0.00 0.00 34.13 31.19 1pms s GLU 532 CO -0.05 -0.86 0.74 0.42 0.95 0.00 0.00 175.26 176.46 1pms s ILE 533 N 1.38 4.69 0.04 1.83 1.01 -0.42 -2.33 121.20 127.40 1pms s ILE 533 Ca 0.06 -0.04 0.03 0.00 0.00 0.00 0.00 60.65 60.70 1pms s ILE 533 Cb -0.18 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 1pms s ILE 533 CO -0.15 -0.69 -0.09 -0.63 0.00 0.00 0.00 174.94 173.38 1pms s ILE 534 N -2.67 0.68 0.52 2.92 1.01 -1.11 0.66 121.20 123.21 1pms s ILE 534 Ca 0.47 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 1pms s ILE 534 Cb -0.10 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.69 1pms s ILE 534 CO 0.42 -0.20 0.79 -0.76 0.00 0.00 0.00 174.94 175.20 1pms s LEU 535 N -1.24 3.44 -0.16 2.97 1.43 -0.69 -4.00 118.68 120.44 1pms s LEU 535 Ca -0.05 0.54 0.17 0.00 -1.03 0.00 0.00 54.13 53.75 1pms s LEU 535 Cb -0.08 -3.39 0.75 0.00 0.03 0.00 0.00 46.19 43.50 1pms s LEU 535 CO 0.01 -0.88 1.67 2.29 0.23 0.00 0.00 176.35 179.67 1pms n LYS 536 N -2.34 4.13 -0.09 1.70 2.85 -1.26 -4.34 118.16 118.81 1pms n LYS 536 Ca 0.03 -2.94 -0.18 0.00 -1.05 0.00 0.00 58.31 54.17 1pms n LYS 536 Cb 0.57 -2.03 -0.06 0.00 -0.65 0.00 0.00 35.03 32.87 1pms n LYS 536 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1pms n ASP 537 N 0.96 1.38 0.00 -5.58 9.92 -1.26 -5.01 116.55 116.96 1pms n ASP 537 Ca 0.26 0.24 0.00 0.00 -0.53 0.00 0.00 54.79 54.76 1pms n ASP 537 Cb 0.99 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.91 1pms n ASP 537 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1pms n GLY 538 N 1.87 0.00 2.37 0.44 0.00 -1.26 -5.17 105.19 103.44 1pms n GLY 538 Ca -0.32 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.54 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 0.24 -3.72 1.61 4.13 -1.26 -5.03 115.26 111.23 1pms n ASN 539 Ca 0.00 -2.58 -0.16 0.00 1.68 0.00 0.00 54.58 53.52 1pms n ASN 539 Cb 0.00 1.00 -0.16 0.00 -1.54 0.00 0.00 39.78 39.08 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 -2.74 0.41 -1.23 6.41 1.04 -1.26 -1.71 113.70 114.62 1pms s SER 540 Ca 0.23 0.18 -0.12 0.00 0.48 0.00 0.00 55.95 56.72 1pms s SER 540 Cb 0.01 0.06 0.17 0.00 0.10 0.00 0.00 66.02 66.36 1pms s SER 540 CO 0.16 -0.19 1.58 0.52 0.98 0.00 0.00 173.24 176.29 1pms n VAL 541 N 4.70 4.29 -3.35 5.02 0.31 0.21 -4.89 118.33 124.62 1pms n VAL 541 Ca -0.17 -4.63 -0.38 0.00 -0.01 0.00 0.00 64.34 59.15 1pms n VAL 541 Cb 0.50 -2.43 -0.07 0.00 -0.91 0.00 0.00 33.84 30.94 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 1.18 5.20 0.26 2.52 1.01 -1.26 -1.30 121.20 128.81 1pms s ILE 542 Ca 0.42 0.84 0.02 0.00 0.00 0.00 0.00 60.65 61.93 1pms s ILE 542 Cb 0.01 -3.77 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 1pms s ILE 542 CO 0.00 0.30 0.08 0.72 0.00 0.00 0.00 174.94 176.04 1pms s PHE 543 N 0.90 1.60 -0.20 3.97 -0.71 -0.99 -2.35 117.98 120.20 1pms s PHE 543 Ca 0.23 -1.11 -0.06 0.00 -1.04 0.00 0.00 56.93 54.95 1pms s PHE 543 Cb -0.15 -0.96 0.10 0.00 -1.21 0.00 0.00 43.02 40.80 1pms s PHE 543 CO 0.09 -0.24 0.40 0.45 -1.34 0.00 0.00 175.22 174.57 1pms s SER 544 N -3.34 -0.09 0.46 1.98 0.15 -0.26 -2.13 113.70 110.48 1pms s SER 544 Ca 0.36 0.77 -0.20 0.00 0.70 0.00 0.00 55.95 57.58 1pms s SER 544 Cb 0.08 1.24 -0.10 0.00 -1.71 0.00 0.00 66.02 65.53 1pms s SER 544 CO 0.13 -0.25 0.99 0.00 1.20 0.00 0.00 173.24 175.31 1pms s ALA 545 N 2.58 2.97 -0.13 5.45 0.00 -1.26 -0.64 121.76 130.72 1pms s ALA 545 Ca 0.02 0.47 -0.03 0.00 0.00 0.00 0.00 51.96 52.42 1pms s ALA 545 Cb -0.13 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.75 1pms s ALA 545 CO -0.13 -0.10 2.70 1.63 0.00 0.00 0.00 175.76 179.86 1pms n LYS 546 N -0.87 1.72 -3.52 0.00 4.76 -1.26 -4.63 118.16 114.36 1pms n LYS 546 Ca 0.08 -1.02 -0.03 0.00 -2.87 0.00 0.00 58.31 54.47 1pms n LYS 546 Cb 0.53 -1.65 0.02 0.00 -1.84 0.00 0.00 35.03 32.09 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 1.54 -1.49 -0.09 4.39 7.64 -1.26 -5.01 113.62 119.33 1pms n SER 547 Ca 0.28 -1.78 -0.14 0.00 1.01 0.00 0.00 58.87 58.24 1pms n SER 547 Cb 0.67 2.42 -0.07 0.00 -1.01 0.00 0.00 64.21 66.22 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 -1.09 0.64 -0.06 -0.43 0.00 -1.26 -3.34 120.51 114.97 1pms n ALA 548 Ca -0.12 -0.48 -0.07 0.00 0.00 0.00 0.00 53.44 52.78 1pms n ALA 548 Cb 0.50 -0.26 0.12 0.00 0.00 0.00 0.00 19.45 19.81 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 0.70 -0.26 0.00 5.08 -1.97 -2.43 114.58 114.70 1pms h GLU 549 Ca -0.19 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 1pms h GLU 549 Cb 0.93 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 1pms h GLU 549 CO -0.12 0.87 0.03 0.93 -1.00 0.00 0.00 179.01 179.72 1pms h GLU 550 N 0.62 0.38 0.48 2.33 5.08 -1.95 0.47 114.58 121.98 1pms h GLU 550 Ca 0.09 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1pms h GLU 550 Cb 0.71 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1pms h GLU 550 CO 0.05 0.39 -0.23 0.87 -1.00 0.00 0.00 179.01 179.09 1pms h LYS 551 N 0.37 -0.62 0.00 2.33 1.57 -1.45 -2.92 116.57 115.85 1pms h LYS 551 Ca 0.09 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1pms h LYS 551 Cb 0.21 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1pms h LYS 551 CO 0.00 -0.41 0.00 0.09 -0.57 0.00 0.00 179.45 178.56 1pms n ASN 552 N -4.76 0.00 0.13 0.86 3.02 -1.00 -3.08 115.26 110.43 1pms n ASN 552 Ca -0.08 0.45 -0.06 0.00 -0.03 0.00 0.00 54.58 54.86 1pms n ASN 552 Cb 0.25 -0.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.92 1pms n ASN 552 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1pms h ASN 553 N 0.00 -0.33 -0.73 6.41 -0.26 0.12 -2.60 115.58 118.19 1pms h ASN 553 Ca 0.00 0.01 0.01 0.00 -0.56 0.00 0.00 56.30 55.76 1pms h ASN 553 Cb 0.15 0.08 -0.04 0.00 -1.06 0.00 0.00 38.32 37.46 1pms h ASN 553 CO 0.00 -0.01 0.48 -0.50 -1.06 0.00 0.00 177.43 176.35 1pms h TRP 554 N -0.83 0.92 -0.77 1.19 4.06 -1.51 -1.32 115.95 117.69 1pms h TRP 554 Ca -0.04 0.02 0.02 0.00 2.06 0.00 0.00 58.89 60.96 1pms h TRP 554 Cb 0.29 -0.31 -0.04 0.00 -1.00 0.00 0.00 29.16 28.10 1pms h TRP 554 CO 0.02 0.58 0.51 1.98 -3.56 0.00 0.00 178.44 177.98 1pms h MET 555 N 1.00 0.96 0.03 0.49 1.85 -1.62 -2.06 114.93 115.57 1pms h MET 555 Ca 0.27 -0.06 -0.23 0.00 -0.61 0.00 0.00 59.70 59.08 1pms h MET 555 Cb -0.11 -0.22 -0.00 0.00 0.43 0.00 0.00 31.60 31.70 1pms h MET 555 CO -0.06 0.63 -0.99 0.00 -0.40 0.00 0.00 176.91 176.10 1pms h ALA 556 N 1.54 0.36 0.00 0.39 0.00 -0.87 -3.01 119.26 117.67 1pms h ALA 556 Ca 0.30 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1pms h ALA 556 Cb -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1pms h ALA 556 CO -0.08 0.90 0.00 0.00 0.00 0.00 0.00 179.25 180.07 1pms h ALA 557 N 0.80 1.00 0.00 0.00 0.00 -0.60 0.17 119.26 120.63 1pms h ALA 557 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1pms h ALA 557 Cb 1.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1pms h ALA 557 CO 0.16 0.00 -0.33 -0.07 0.00 0.00 0.00 179.25 179.01 1pms h LEU 558 N 0.00 0.00 -0.93 0.00 3.38 -1.33 -3.29 115.31 113.14 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 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1pms h LEU 558 CO 0.00 0.61 0.00 -0.38 0.09 0.00 0.00 178.44 178.76 1pms n ILE 559 N -4.42 1.14 -0.07 1.22 -0.00 -1.16 -1.71 119.36 114.36 1pms n ILE 559 Ca -0.05 0.54 -0.14 0.00 -0.00 0.00 0.00 62.75 63.11 1pms n ILE 559 Cb 0.17 -1.51 -0.05 0.00 -0.00 0.00 0.00 39.64 38.24 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 0.73 0.29 4.38 0.02 -0.77 -2.84 113.55 115.35 1pms h SER 560 Ca 0.00 -0.52 -0.24 0.00 -0.84 0.00 0.00 61.79 60.19 1pms h SER 560 Cb 0.10 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 62.44 1pms h SER 560 CO 0.00 1.11 -0.99 -0.07 -1.14 0.00 0.00 176.83 175.74 1pms h LEU 561 N 0.37 0.60 -0.81 5.07 -0.00 -1.40 -3.23 115.31 115.91 1pms h LEU 561 Ca 0.02 -0.49 0.10 0.00 -0.00 0.00 0.00 57.88 57.51 1pms h LEU 561 Cb 0.96 -0.19 -0.08 0.00 -0.00 0.00 0.00 40.66 41.36 1pms h LEU 561 CO 0.08 1.30 0.45 -0.61 -0.00 0.00 0.00 178.44 179.66 1pms h GLN 562 N 0.25 0.71 -1.10 1.13 4.15 -1.45 0.23 115.11 119.03 1pms h GLN 562 Ca -0.10 -0.04 0.37 0.00 0.77 0.00 0.00 58.65 59.65 1pms h GLN 562 Cb 1.63 -0.16 -0.14 0.00 0.21 0.00 0.00 27.48 29.02 1pms h GLN 562 CO 0.18 0.47 0.66 1.88 -1.93 0.00 0.00 178.83 180.09 1pms h TYR 563 N 0.74 0.77 0.00 3.99 -1.99 -1.51 -3.40 116.97 115.56 1pms h TYR 563 Ca 0.40 0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.16 1pms h TYR 563 Cb 0.40 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 38.94 1pms h TYR 563 CO -0.07 -0.21 0.00 2.89 -0.00 0.00 0.00 178.16 180.76 1pms n ARG 564 N -4.94 0.00 0.00 4.88 0.00 -0.18 -5.16 116.66 111.27 1pms n ARG 564 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.19 1pms n ARG 564 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.62 1pms n ARG 564 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06