#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 1.22 -0.44 4.33 5.02 -1.26 -3.74 118.16 123.30 1pms n LYS 432 Ca 0.00 -0.35 -0.05 0.00 -2.02 0.00 0.00 58.31 55.89 1pms n LYS 432 Cb 0.00 -1.16 0.10 0.00 -0.02 0.00 0.00 35.03 33.95 1pms n LYS 432 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1pms n GLN 433 N -0.29 1.86 -0.31 1.97 6.02 -1.26 -4.33 117.38 121.04 1pms n GLN 433 Ca 0.07 -1.20 0.08 0.00 -0.01 0.00 0.00 57.00 55.94 1pms n GLN 433 Cb 0.10 -1.58 0.30 0.00 1.02 0.00 0.00 30.24 30.08 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 1.20 0.81 -0.76 1.08 3.38 -2.00 0.46 115.31 119.48 1pms h LEU 434 Ca 0.16 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 1pms h LEU 434 Cb 1.51 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 1pms h LEU 434 CO 0.35 0.44 -0.53 0.00 0.09 0.00 0.00 178.44 178.79 1pms h ALA 435 N 1.56 0.94 0.00 1.53 0.00 -1.94 -2.56 119.26 118.79 1pms h ALA 435 Ca 0.45 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pms h ALA 435 Cb 0.52 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1pms h ALA 435 CO -0.22 0.66 -0.15 -0.89 0.00 0.00 0.00 179.25 178.66 1pms n ILE 436 N -3.63 0.28 0.11 0.00 2.08 0.12 -3.22 119.36 115.10 1pms n ILE 436 Ca -0.01 -0.15 -0.01 0.00 0.56 0.00 0.00 62.75 63.14 1pms n ILE 436 Cb 0.59 -0.40 -0.01 0.00 -0.75 0.00 0.00 39.64 39.08 1pms n ILE 436 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1pms h LYS 437 N 0.00 0.00 0.47 0.38 6.56 0.08 -3.31 116.57 120.75 1pms h LYS 437 Ca 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.57 1pms h LYS 437 Cb 0.63 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.29 1pms h LYS 437 CO 0.00 0.69 -0.23 0.87 -2.06 0.00 0.00 179.45 178.72 1pms h LYS 438 N 0.00 -0.61 -1.58 3.15 1.57 -1.53 -2.33 116.57 115.24 1pms h LYS 438 Ca -0.01 0.04 0.46 0.00 -1.87 0.00 0.00 60.65 59.27 1pms h LYS 438 Cb 1.50 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 33.89 1pms h LYS 438 CO 0.09 -0.34 1.33 -0.12 -0.57 0.00 0.00 179.45 179.85 1pms n MET 439 N -5.30 0.01 0.09 3.15 1.56 -1.25 -0.22 117.12 115.16 1pms n MET 439 Ca -0.11 1.05 -0.07 0.00 -0.27 0.00 0.00 57.70 58.29 1pms n MET 439 Cb 0.30 -2.50 -0.04 0.00 2.15 0.00 0.00 33.22 33.13 1pms n MET 439 CO 0.00 0.00 0.00 -0.91 -0.73 0.00 0.00 175.97 174.33 1pms h ASN 440 N 0.00 -0.28 0.24 6.12 4.21 -1.57 -1.93 115.58 122.37 1pms h ASN 440 Ca 0.75 -0.10 0.00 0.00 1.21 0.00 0.00 56.30 58.16 1pms h ASN 440 Cb 3.41 0.07 0.00 0.00 -1.12 0.00 0.00 38.32 40.68 1pms h ASN 440 CO -0.01 0.21 0.00 -0.62 -1.29 0.00 0.00 177.43 175.72 1pms n GLU 441 N -4.99 0.01 -0.07 0.81 1.02 0.69 -1.87 120.64 116.24 1pms n GLU 441 Ca -0.06 0.37 -0.10 0.00 -0.02 0.00 0.00 57.16 57.36 1pms n GLU 441 Cb 0.19 -1.50 -0.06 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 0.66 0.00 -3.67 2.04 -0.71 -1.82 117.51 114.01 1pms h ILE 442 Ca 0.00 -1.60 0.00 0.00 1.00 0.00 0.00 64.86 64.26 1pms h ILE 442 Cb 0.12 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1pms h ILE 442 CO 0.00 0.22 0.00 1.67 0.00 0.00 0.00 178.15 180.04 1pms n GLN 443 N -4.62 0.02 -0.08 2.37 7.27 -0.73 -2.73 117.38 118.87 1pms n GLN 443 Ca -0.11 0.32 -0.23 0.00 0.07 0.00 0.00 57.00 57.05 1pms n GLN 443 Cb 0.34 -1.54 -0.12 0.00 2.41 0.00 0.00 30.24 31.33 1pms n GLN 443 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1pms n LYS 444 N -1.58 0.64 0.02 3.69 4.76 -0.78 -0.37 118.16 124.55 1pms n LYS 444 Ca 0.03 0.35 0.03 0.00 -2.87 0.00 0.00 58.31 55.85 1pms n LYS 444 Cb 0.14 -1.65 0.16 0.00 -1.84 0.00 0.00 35.03 31.84 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 -3.92 0.09 0.00 4.39 2.85 -0.68 -3.05 115.26 114.94 1pms n ASN 445 Ca -0.39 0.54 0.00 0.00 -0.11 0.00 0.00 54.58 54.62 1pms n ASN 445 Cb 0.88 -0.55 0.00 0.00 1.24 0.00 0.00 39.78 41.35 1pms n ASN 445 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1pms n ILE 446 N -1.62 0.00 -0.50 -1.44 -5.35 -1.16 -4.77 119.36 104.53 1pms n ILE 446 Ca 0.01 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 1pms n ILE 446 Cb 0.05 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 37.60 1pms n ILE 446 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1pms n ASP 447 N -1.16 0.00 0.00 7.28 2.03 0.50 -3.90 116.55 121.29 1pms n ASP 447 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1pms n ASP 447 Cb 0.20 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.60 1pms n ASP 447 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pms n GLY 448 N -2.00 -0.07 2.82 0.27 0.00 -1.24 -4.87 105.19 100.11 1pms n GLY 448 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pms n GLY 448 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1pms n TRP 449 N 0.00 0.00 0.11 1.61 8.01 -1.25 -4.39 117.44 121.53 1pms n TRP 449 Ca 0.00 0.00 -0.04 0.00 -1.31 0.00 0.00 57.50 56.15 1pms n TRP 449 Cb 0.00 -1.16 0.13 0.00 -2.01 0.00 0.00 31.31 28.27 1pms n TRP 449 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.69 174.77 1pms n GLU 450 N -0.85 2.13 0.13 -0.99 2.13 -1.26 -4.53 120.64 117.39 1pms n GLU 450 Ca 0.00 -1.33 0.00 0.00 0.66 0.00 0.00 57.16 56.49 1pms n GLU 450 Cb 0.24 -1.67 0.00 0.00 0.27 0.00 0.00 31.44 30.28 1pms n GLU 450 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1pms n GLY 451 N 0.03 -1.57 0.00 8.31 0.00 -1.26 -5.10 105.19 105.60 1pms n GLY 451 Ca 0.19 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1pms n GLY 451 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pms n LYS 452 N -3.21 3.27 -3.77 1.61 5.02 -1.26 -5.15 118.16 114.66 1pms n LYS 452 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.26 1pms n LYS 452 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 1pms n LYS 452 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1pms s ASP 453 N -1.00 -0.12 0.00 4.39 2.15 -1.26 -4.67 116.67 116.16 1pms s ASP 453 Ca 0.00 -0.44 0.00 0.00 0.43 0.00 0.00 52.55 52.54 1pms s ASP 453 Cb 0.00 0.46 0.00 0.00 -0.30 0.00 0.00 42.92 43.08 1pms s ASP 453 CO 0.00 -0.87 0.00 2.30 -0.17 0.00 0.00 175.17 176.43 1pms n ILE 454 N -0.52 0.00 -3.81 4.11 -6.64 -1.26 -4.87 119.36 106.37 1pms n ILE 454 Ca -0.06 0.00 -0.28 0.00 -1.77 0.00 0.00 62.75 60.64 1pms n ILE 454 Cb 0.61 -0.40 -0.16 0.00 -1.44 0.00 0.00 39.64 38.24 1pms n ILE 454 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 1pms s GLY 455 N -2.26 0.86 0.15 3.28 0.00 0.52 -4.99 107.32 104.87 1pms s GLY 455 Ca 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 44.72 43.75 1pms s GLY 455 CO 0.00 1.21 1.74 -1.61 0.00 0.00 0.00 173.10 174.44 1pms h GLN 456 N 8.16 0.65 0.00 2.90 4.15 -1.96 -2.04 115.11 126.98 1pms h GLN 456 Ca -0.18 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.15 1pms h GLN 456 Cb 1.11 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.68 1pms h GLN 456 CO 0.36 0.54 0.00 0.00 -1.93 0.00 0.00 178.83 177.80 1pms n ASN 459 N 6.10 -1.72 0.00 0.00 3.02 -1.26 -4.29 115.26 117.12 1pms n ASN 459 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1pms n ASN 459 Cb 0.48 -0.83 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 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 -0.89 4.00 -3.20 3.52 0.28 -0.77 0.19 120.64 123.78 1pms n GLU 460 Ca 0.00 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.72 1pms n GLU 460 Cb 0.43 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.24 1pms n GLU 460 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1pms n PHE 461 N 0.00 3.78 0.13 -1.84 1.16 -1.26 -4.64 117.46 114.79 1pms n PHE 461 Ca 0.00 -4.02 0.02 0.00 -1.87 0.00 0.00 57.45 51.58 1pms n PHE 461 Cb 0.00 -0.56 0.01 0.00 -1.61 0.00 0.00 39.48 37.32 1pms n PHE 461 CO 0.00 0.00 0.00 0.97 -1.87 0.00 0.00 176.76 175.86 1pms h ILE 462 N 3.08 0.92 -2.52 1.97 2.10 -1.95 -3.40 117.51 117.71 1pms h ILE 462 Ca 0.18 -2.31 -0.52 0.00 1.08 0.00 0.00 64.86 63.29 1pms h ILE 462 Cb 0.59 2.45 -0.38 0.00 -1.09 0.00 0.00 36.82 38.39 1pms h ILE 462 CO 0.85 0.53 -0.79 -0.04 -1.08 0.00 0.00 178.15 177.61 1pms s MET 463 N -2.94 0.44 -0.35 2.19 -1.94 -0.94 -4.85 119.30 110.90 1pms s MET 463 Ca 0.04 -0.95 0.04 0.00 -1.71 0.00 0.00 55.69 53.10 1pms s MET 463 Cb 0.08 -1.13 0.10 0.00 2.01 0.00 0.00 34.83 35.89 1pms s MET 463 CO 0.75 -1.14 0.07 -1.21 -0.01 0.00 0.00 175.02 173.48 1pms s GLU 464 N 1.50 1.47 0.00 2.03 8.01 -1.26 -1.51 118.70 128.94 1pms s GLU 464 Ca 0.15 -1.89 0.00 0.00 0.01 0.00 0.00 54.97 53.24 1pms s GLU 464 Cb -0.19 -3.14 0.00 0.00 -4.31 0.00 0.00 34.13 26.48 1pms s GLU 464 CO -0.13 -0.96 0.00 0.41 0.01 0.00 0.00 175.26 174.60 1pms n GLY 465 N 4.19 -0.17 3.01 -1.39 0.00 -1.16 -4.63 105.19 105.03 1pms n GLY 465 Ca 0.04 0.55 -0.12 0.00 0.00 0.00 0.00 46.02 46.49 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 2.83 0.01 -0.00 2.61 -4.23 -1.26 -2.28 115.64 113.32 1pms s THR 466 Ca 0.00 -0.06 -0.15 0.00 -1.18 0.00 0.00 61.69 60.30 1pms s THR 466 Cb 0.00 -0.20 0.02 0.00 1.34 0.00 0.00 72.50 73.66 1pms s THR 466 CO 0.00 -0.03 0.32 -0.22 -0.54 0.00 0.00 174.62 174.15 1pms s LEU 467 N -0.05 0.79 0.45 4.79 1.98 -1.07 -4.47 118.68 121.11 1pms s LEU 467 Ca -0.01 0.04 0.07 0.00 -2.89 0.00 0.00 54.13 51.34 1pms s LEU 467 Cb -0.01 1.34 -0.01 0.00 0.66 0.00 0.00 46.19 48.17 1pms s LEU 467 CO 0.00 -0.50 0.34 0.28 -1.89 0.00 0.00 176.35 174.59 1pms s THR 468 N -1.64 2.29 -0.58 3.68 -1.32 -0.28 -2.54 115.64 115.27 1pms s THR 468 Ca -0.11 -1.46 -0.02 0.00 -1.21 0.00 0.00 61.69 58.89 1pms s THR 468 Cb -0.04 -2.76 0.35 0.00 -1.51 0.00 0.00 72.50 68.54 1pms s THR 468 CO 0.03 0.00 2.08 -1.14 -2.21 0.00 0.00 174.62 173.38 1pms n ARG 469 N -1.54 2.43 -0.60 7.08 0.63 -1.26 -0.88 116.66 122.53 1pms n ARG 469 Ca 0.01 -2.78 0.08 0.00 -0.92 0.00 0.00 57.85 54.24 1pms n ARG 469 Cb 0.63 -2.09 -0.02 0.00 0.45 0.00 0.00 32.46 31.43 1pms n ARG 469 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1pms n VAL 470 N -0.41 0.00 -3.90 5.15 3.14 -1.09 -4.61 118.33 116.61 1pms n VAL 470 Ca 0.52 0.02 -0.29 0.00 -2.96 0.00 0.00 64.34 61.63 1pms n VAL 470 Cb 0.58 -0.21 -0.01 0.00 -1.06 0.00 0.00 33.84 33.14 1pms n VAL 470 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pms n GLY 471 N -2.06 -0.41 3.53 7.55 0.00 -1.26 -4.87 105.19 107.67 1pms n GLY 471 Ca 0.00 0.19 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.99 -1.86 -1.49 4.61 0.00 -1.26 -5.03 121.76 112.74 1pms s ALA 472 Ca 0.23 1.05 0.12 0.00 0.00 0.00 0.00 51.96 53.36 1pms s ALA 472 Cb -0.13 0.34 0.10 0.00 0.00 0.00 0.00 23.12 23.43 1pms s ALA 472 CO 0.67 -0.70 0.88 0.36 0.00 0.00 0.00 175.76 176.97 1pms n LYS 473 N -0.24 0.68 -3.86 0.00 2.85 -1.26 -4.91 118.16 111.43 1pms n LYS 473 Ca -0.07 -1.22 -0.26 0.00 -1.05 0.00 0.00 58.31 55.70 1pms n LYS 473 Cb 0.61 -1.23 -0.17 0.00 -0.65 0.00 0.00 35.03 33.59 1pms n LYS 473 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1pms s HIS 474 N -1.00 1.30 0.12 5.58 2.46 -1.26 -5.14 115.29 117.35 1pms s HIS 474 Ca 0.14 -0.67 0.01 0.00 0.47 0.00 0.00 55.06 55.01 1pms s HIS 474 Cb 0.10 -1.13 0.02 0.00 -0.13 0.00 0.00 32.58 31.44 1pms s HIS 474 CO 0.15 -0.50 0.16 -0.85 -2.47 0.00 0.00 174.74 171.24 1pms n GLU 475 N 4.99 0.79 -3.93 2.88 0.28 -1.26 -4.75 120.64 119.64 1pms n GLU 475 Ca -0.11 -0.57 -0.08 0.00 -0.16 0.00 0.00 57.16 56.24 1pms n GLU 475 Cb 0.49 -0.07 -0.08 0.00 1.43 0.00 0.00 31.44 33.21 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 -2.62 0.80 0.63 3.44 3.03 -1.05 -4.97 118.95 118.22 1pms s ARG 476 Ca 0.12 -1.05 -0.18 0.00 2.03 0.00 0.00 55.73 56.65 1pms s ARG 476 Cb -0.01 0.31 -0.03 0.00 -1.03 0.00 0.00 34.95 34.19 1pms s ARG 476 CO 0.08 -0.23 1.08 0.72 -1.13 0.00 0.00 175.30 175.81 1pms n HIS 477 N -0.03 1.18 -4.00 5.89 8.25 -0.70 -2.58 115.22 123.22 1pms n HIS 477 Ca -0.14 0.42 -0.09 0.00 -0.26 0.00 0.00 57.72 57.66 1pms n HIS 477 Cb 0.62 -2.18 -0.11 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 -1.50 0.13 -0.31 1.59 -1.09 -0.96 -1.56 121.20 117.50 1pms s ILE 478 Ca 0.79 -1.10 0.02 0.00 -2.23 0.00 0.00 60.65 58.13 1pms s ILE 478 Cb -0.40 -0.53 0.16 0.00 -1.58 0.00 0.00 42.46 40.11 1pms s ILE 478 CO 0.44 -0.60 0.39 -0.36 -1.23 0.00 0.00 174.94 173.58 1pms s PHE 479 N -1.97 -0.82 0.11 3.97 0.08 -0.85 -3.01 117.98 115.48 1pms s PHE 479 Ca -0.11 0.05 0.07 0.00 0.12 0.00 0.00 56.93 57.06 1pms s PHE 479 Cb -0.06 -0.24 -0.04 0.00 -0.57 0.00 0.00 43.02 42.11 1pms s PHE 479 CO -0.03 -0.98 -0.09 -1.17 -0.10 0.00 0.00 175.22 172.85 1pms s LEU 480 N 2.32 3.07 -0.15 -0.37 0.20 -0.57 -1.17 118.68 122.01 1pms s LEU 480 Ca 0.11 -0.39 -0.04 0.00 0.69 0.00 0.00 54.13 54.51 1pms s LEU 480 Cb -0.13 -1.85 0.05 0.00 -0.43 0.00 0.00 46.19 43.83 1pms s LEU 480 CO -0.26 0.17 0.06 0.72 -0.29 0.00 0.00 176.35 176.75 1pms s PHE 481 N -1.26 0.45 0.00 5.38 -0.12 -0.35 -2.22 117.98 119.86 1pms s PHE 481 Ca 0.22 -0.36 0.00 0.00 -0.05 0.00 0.00 56.93 56.74 1pms s PHE 481 Cb -0.11 -0.76 0.00 0.00 -0.63 0.00 0.00 43.02 41.52 1pms s PHE 481 CO 0.14 -0.47 0.00 -0.25 -0.05 0.00 0.00 175.22 174.59 1pms n ASP 482 N 5.21 0.00 -0.33 1.98 8.00 -1.26 -1.34 116.55 128.81 1pms n ASP 482 Ca -0.07 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.50 1pms n ASP 482 Cb 0.49 0.00 0.13 0.00 -0.02 0.00 0.00 41.12 41.71 1pms n ASP 482 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pms n GLY 483 N 0.00 4.03 2.95 0.44 0.00 -1.26 -4.79 105.19 106.56 1pms n GLY 483 Ca 0.00 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.34 4.15 -0.51 0.99 0.20 -0.45 0.38 118.68 121.09 1pms s LEU 484 Ca 0.28 -2.13 -0.23 0.00 0.69 0.00 0.00 54.13 52.75 1pms s LEU 484 Cb 0.26 -1.45 0.04 0.00 -0.43 0.00 0.00 46.19 44.61 1pms s LEU 484 CO -0.01 -0.37 0.83 -0.32 -0.29 0.00 0.00 176.35 176.19 1pms s MET 485 N 0.95 3.30 0.31 1.98 -2.45 -0.89 -1.21 119.30 121.28 1pms s MET 485 Ca 0.11 -0.36 0.02 0.00 -1.25 0.00 0.00 55.69 54.22 1pms s MET 485 Cb -0.19 -4.03 -0.03 0.00 1.25 0.00 0.00 34.83 31.83 1pms s MET 485 CO -0.11 -1.33 0.48 0.42 1.05 0.00 0.00 175.02 175.53 1pms s ILE 486 N 3.48 5.11 0.03 10.11 1.01 -0.32 -1.65 121.20 138.97 1pms s ILE 486 Ca 0.27 -0.68 -0.15 0.00 0.00 0.00 0.00 60.65 60.09 1pms s ILE 486 Cb -0.14 -3.84 0.02 0.00 0.01 0.00 0.00 42.46 38.52 1pms s ILE 486 CO 0.19 -0.46 0.33 0.00 0.00 0.00 0.00 174.94 175.00 1pms n LYS 489 N 5.25 3.37 -2.32 0.00 4.81 -1.23 -1.73 118.16 126.32 1pms n LYS 489 Ca -0.09 -2.95 -0.41 0.00 -0.87 0.00 0.00 58.31 54.00 1pms n LYS 489 Cb 0.50 -2.34 -0.03 0.00 0.02 0.00 0.00 35.03 33.18 1pms n LYS 489 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1pms s SER 490 N 0.17 7.03 0.35 3.14 0.01 -1.26 -4.02 113.70 119.12 1pms s SER 490 Ca 0.56 2.36 -0.03 0.00 1.31 0.00 0.00 55.95 60.15 1pms s SER 490 Cb 0.31 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 1pms s SER 490 CO -0.19 -0.38 0.60 0.20 0.41 0.00 0.00 173.24 173.88 1pms s ASN 491 N -0.18 6.35 -0.27 2.44 0.01 -1.26 -4.84 114.94 117.19 1pms s ASN 491 Ca 0.51 0.65 -0.40 0.00 -0.71 0.00 0.00 52.86 52.91 1pms s ASN 491 Cb -0.35 -2.12 -0.15 0.00 0.41 0.00 0.00 41.25 39.04 1pms s ASN 491 CO 0.41 -0.31 1.75 1.57 -1.51 0.00 0.00 177.10 179.01 1pms n HIS 492 N -1.55 2.07 0.00 2.20 -0.00 -1.26 -4.88 115.22 111.79 1pms n HIS 492 Ca -0.02 0.51 0.00 0.00 0.46 0.00 0.00 57.72 58.66 1pms n HIS 492 Cb 0.55 -2.47 0.00 0.00 -0.12 0.00 0.00 29.99 27.95 1pms n HIS 492 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1pms n GLY 493 N 4.21 0.20 3.44 1.57 0.00 -1.26 -4.89 105.19 108.46 1pms n GLY 493 Ca 0.26 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.83 1pms n GLY 493 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pms n GLN 494 N 0.00 0.18 0.00 1.61 10.64 -1.26 -4.88 117.38 123.67 1pms n GLN 494 Ca 0.00 0.02 0.00 0.00 -1.83 0.00 0.00 57.00 55.19 1pms n GLN 494 Cb 0.00 -1.75 0.00 0.00 -0.86 0.00 0.00 30.24 27.63 1pms n GLN 494 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 1pms n PRO 495 N 8.30 1.17 0.11 2.61 -0.04 -1.26 -4.83 135.00 141.06 1pms n PRO 495 Ca 0.59 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 64.13 1pms n PRO 495 Cb 0.08 0.00 0.41 0.00 -0.04 0.00 0.00 33.50 33.95 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 0.10 -3.61 0.54 3.00 -1.26 -4.61 116.66 110.82 1pms n ARG 496 Ca 0.00 0.57 -0.15 0.00 -0.01 0.00 0.00 57.85 58.26 1pms n ARG 496 Cb 0.00 -1.81 -0.07 0.00 0.00 0.00 0.00 32.46 30.58 1pms n ARG 496 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1pms s LEU 497 N -4.05 -0.58 0.70 0.55 2.34 -1.26 -5.16 118.68 111.22 1pms s LEU 497 Ca -0.01 1.12 -0.11 0.00 0.06 0.00 0.00 54.13 55.18 1pms s LEU 497 Cb 0.05 2.38 0.01 0.00 -0.56 0.00 0.00 46.19 48.07 1pms s LEU 497 CO 0.16 -0.37 1.08 -2.16 -1.06 0.00 0.00 176.35 174.00 1pms s PRO 498 N -0.21 2.87 0.00 1.48 0.04 -1.26 -4.08 135.00 133.83 1pms s PRO 498 Ca -0.04 0.63 0.00 0.00 0.04 0.00 0.00 61.00 61.63 1pms s PRO 498 Cb -0.03 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1pms s PRO 498 CO 0.04 -1.07 0.00 0.41 0.04 0.00 0.00 177.00 176.42 1pms n GLY 499 N -2.61 2.99 0.00 0.56 0.00 -1.26 -4.93 105.19 99.94 1pms n GLY 499 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1pms n GLY 499 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pms n ALA 500 N 0.00 0.00 -2.56 4.61 0.00 -1.26 -4.93 120.51 116.37 1pms n ALA 500 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 1pms n ALA 500 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1pms n ALA 500 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pms s SER 501 N -1.56 4.52 0.31 0.00 0.15 -1.26 -5.14 113.70 110.71 1pms s SER 501 Ca 0.00 -0.79 0.00 0.00 0.70 0.00 0.00 55.95 55.86 1pms s SER 501 Cb 0.00 -0.71 0.00 0.00 -1.71 0.00 0.00 66.02 63.60 1pms s SER 501 CO 0.00 -0.20 0.00 -1.20 1.20 0.00 0.00 173.24 173.04 1pms n SER 502 N -1.03 0.00 -0.05 5.45 7.64 -1.26 -4.80 113.62 119.58 1pms n SER 502 Ca -0.04 -0.36 -0.14 0.00 1.01 0.00 0.00 58.87 59.34 1pms n SER 502 Cb 0.61 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.69 1pms n SER 502 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pms h ALA 503 N -1.78 0.00 -4.68 -0.43 0.00 -1.96 -3.39 119.26 107.02 1pms h ALA 503 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1pms h ALA 503 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1pms h ALA 503 CO 0.00 -0.03 -1.03 -1.91 0.00 0.00 0.00 179.25 176.28 1pms n GLU 504 N -4.63 -5.03 -4.42 0.00 2.13 -1.26 -4.23 120.64 103.19 1pms n GLU 504 Ca -0.10 3.68 -0.26 0.00 0.66 0.00 0.00 57.16 61.14 1pms n GLU 504 Cb 0.44 -4.68 -0.12 0.00 0.27 0.00 0.00 31.44 27.36 1pms n GLU 504 CO 0.00 0.00 0.00 1.52 -0.41 0.00 0.00 177.13 178.24 1pms s TYR 505 N -0.59 2.26 0.00 4.31 1.13 -1.26 -4.11 117.35 119.08 1pms s TYR 505 Ca -0.03 -0.36 0.00 0.00 -1.41 0.00 0.00 57.07 55.26 1pms s TYR 505 Cb 0.00 -1.11 0.00 0.00 -1.10 0.00 0.00 41.96 39.76 1pms s TYR 505 CO 0.09 0.51 0.00 0.54 -2.51 0.00 0.00 175.55 174.18 1pms n ARG 506 N 0.17 3.25 -3.06 -3.49 5.12 -1.26 -4.97 116.66 112.43 1pms n ARG 506 Ca -0.12 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.49 1pms n ARG 506 Cb 0.56 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.82 1pms n ARG 506 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1pms s LEU 507 N 0.00 3.96 0.06 0.55 0.20 -1.26 -4.86 118.68 117.34 1pms s LEU 507 Ca 0.00 1.09 0.10 0.00 0.69 0.00 0.00 54.13 56.01 1pms s LEU 507 Cb 0.00 -3.93 -0.03 0.00 -0.43 0.00 0.00 46.19 41.80 1pms s LEU 507 CO 0.00 -0.28 -0.26 -1.59 -0.29 0.00 0.00 176.35 173.93 1pms s LYS 508 N -3.45 1.74 0.35 1.98 0.00 -1.26 -3.49 119.74 115.61 1pms s LYS 508 Ca 0.51 -1.15 0.07 0.00 0.00 0.00 0.00 55.97 55.40 1pms s LYS 508 Cb -0.10 -1.97 -0.07 0.00 0.00 0.00 0.00 37.83 35.68 1pms s LYS 508 CO 0.26 0.50 -0.03 -1.83 0.00 0.00 0.00 175.35 174.26 1pms s GLU 509 N -1.40 1.79 -0.12 1.78 -1.05 -1.05 -4.99 118.70 113.65 1pms s GLU 509 Ca 0.12 -1.97 -0.13 0.00 -0.15 0.00 0.00 54.97 52.84 1pms s GLU 509 Cb -0.10 -1.45 0.03 0.00 -0.44 0.00 0.00 34.13 32.18 1pms s GLU 509 CO 0.03 0.00 0.37 -1.59 0.95 0.00 0.00 175.26 175.02 1pms s LYS 510 N -3.71 0.46 0.29 -4.83 0.00 -1.26 -1.55 119.74 109.15 1pms s LYS 510 Ca 0.33 0.44 0.03 0.00 0.00 0.00 0.00 55.97 56.77 1pms s LYS 510 Cb 0.06 0.22 -0.06 0.00 0.00 0.00 0.00 37.83 38.06 1pms s LYS 510 CO 0.16 -0.07 0.06 -0.06 0.00 0.00 0.00 175.35 175.44 1pms s PHE 511 N 0.02 1.80 -0.61 1.78 0.40 -0.66 -5.01 117.98 115.70 1pms s PHE 511 Ca -0.02 -1.01 -0.15 0.00 -0.60 0.00 0.00 56.93 55.15 1pms s PHE 511 Cb -0.03 -1.13 0.15 0.00 0.51 0.00 0.00 43.02 42.52 1pms s PHE 511 CO 0.01 -0.09 0.56 -0.06 0.70 0.00 0.00 175.22 176.34 1pms s PHE 512 N -3.43 3.38 -1.28 0.36 0.08 -1.26 -2.10 117.98 113.72 1pms s PHE 512 Ca 0.36 -1.49 -0.06 0.00 0.12 0.00 0.00 56.93 55.86 1pms s PHE 512 Cb 0.08 -3.79 0.16 0.00 -0.57 0.00 0.00 43.02 38.90 1pms s PHE 512 CO 0.14 -1.01 2.19 -0.12 -0.10 0.00 0.00 175.22 176.32 1pms n MET 513 N 4.92 4.46 0.00 0.44 1.56 0.16 -4.28 117.12 124.38 1pms n MET 513 Ca -0.07 -3.63 0.00 0.00 -0.27 0.00 0.00 57.70 53.73 1pms n MET 513 Cb 0.42 -2.67 0.00 0.00 2.15 0.00 0.00 33.22 33.11 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 2.01 2.36 -1.10 2.12 3.00 -1.24 -4.11 116.66 119.71 1pms n ARG 514 Ca 0.55 0.00 -0.16 0.00 -0.01 0.00 0.00 57.85 58.23 1pms n ARG 514 Cb 0.28 -0.84 0.17 0.00 0.00 0.00 0.00 32.46 32.06 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 -1.61 2.18 -4.43 5.56 -0.00 -1.26 -4.85 118.16 113.75 1pms n LYS 515 Ca 0.00 -3.20 -0.24 0.00 -0.00 0.00 0.00 58.31 54.87 1pms n LYS 515 Cb 0.34 -2.03 -0.09 0.00 -0.00 0.00 0.00 35.03 33.25 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 -3.52 2.69 -0.03 0.58 -7.23 -1.26 -3.96 120.40 107.67 1pms s VAL 516 Ca 0.52 -2.27 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 1pms s VAL 516 Cb 0.45 -2.46 -0.00 0.00 0.56 0.00 0.00 36.38 34.93 1pms s VAL 516 CO 0.04 -0.38 -0.12 -1.10 -0.31 0.00 0.00 175.10 173.23 1pms s GLN 517 N -3.56 1.17 0.13 4.82 1.11 -1.21 -4.93 119.66 117.18 1pms s GLN 517 Ca 0.31 -0.41 -0.17 0.00 0.01 0.00 0.00 55.36 55.09 1pms s GLN 517 Cb -0.05 -1.07 -0.07 0.00 -1.01 0.00 0.00 33.01 30.81 1pms s GLN 517 CO 0.16 0.19 0.59 -1.50 0.01 0.00 0.00 175.29 174.74 1pms s ILE 518 N 0.02 4.75 -0.43 1.08 2.07 -1.26 -2.24 121.20 125.20 1pms s ILE 518 Ca -0.01 1.08 0.03 0.00 -1.41 0.00 0.00 60.65 60.34 1pms s ILE 518 Cb -0.08 -3.83 0.12 0.00 0.13 0.00 0.00 42.46 38.80 1pms s ILE 518 CO 0.01 0.38 0.19 0.20 -1.91 0.00 0.00 174.94 173.80 1pms s ASN 519 N -1.44 4.16 0.68 4.50 -0.87 -0.78 -4.92 114.94 116.26 1pms s ASN 519 Ca 0.35 -2.52 -0.17 0.00 -1.57 0.00 0.00 52.86 48.95 1pms s ASN 519 Cb -0.17 -1.34 -0.01 0.00 -0.02 0.00 0.00 41.25 39.71 1pms s ASN 519 CO 0.19 -0.30 1.09 -0.67 -2.57 0.00 0.00 177.10 174.85 1pms n ASP 520 N 3.73 1.12 -4.75 -1.22 2.03 -1.26 -3.01 116.55 113.19 1pms n ASP 520 Ca 0.05 0.75 -0.23 0.00 0.52 0.00 0.00 54.79 55.88 1pms n ASP 520 Cb 0.36 -1.46 -0.06 0.00 -0.72 0.00 0.00 41.12 39.24 1pms n ASP 520 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1pms s LYS 521 N -3.27 2.38 -0.46 -0.67 2.20 -1.26 -4.93 119.74 113.73 1pms s LYS 521 Ca 0.77 -1.58 -0.02 0.00 -0.36 0.00 0.00 55.97 54.78 1pms s LYS 521 Cb -0.37 -2.18 0.24 0.00 -1.51 0.00 0.00 37.83 34.01 1pms s LYS 521 CO 0.46 0.04 2.19 -0.25 -0.36 0.00 0.00 175.35 177.43 1pms n ASP 522 N -1.22 6.81 -2.13 1.43 8.00 -1.26 -4.94 116.55 123.25 1pms n ASP 522 Ca -0.02 -3.30 0.00 0.00 0.71 0.00 0.00 54.79 52.18 1pms n ASP 522 Cb 0.62 -1.08 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 1pms n ASP 522 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1pms n ASP 523 N 0.14 -0.18 -4.70 -2.24 8.00 -1.26 -5.04 116.55 111.26 1pms n ASP 523 Ca 0.43 -0.88 -0.35 0.00 0.71 0.00 0.00 54.79 54.70 1pms n ASP 523 Cb 0.57 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.58 1pms n ASP 523 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1pms s THR 524 N -0.97 4.67 0.66 -3.53 -4.23 -1.26 -4.95 115.64 106.03 1pms s THR 524 Ca 0.00 -0.10 0.29 0.00 -1.18 0.00 0.00 61.69 60.70 1pms s THR 524 Cb 0.00 -3.02 0.30 0.00 1.34 0.00 0.00 72.50 71.12 1pms s THR 524 CO 0.00 0.56 1.90 0.28 -0.54 0.00 0.00 174.62 176.82 1pms h SER 525 N 5.66 0.00 0.11 3.99 0.02 -1.96 0.29 113.55 121.65 1pms h SER 525 Ca -0.46 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.20 1pms h SER 525 Cb 1.19 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.76 1pms h SER 525 CO 0.60 0.00 -1.20 -0.33 -1.14 0.00 0.00 176.83 174.76 1pms h GLU 526 N 0.00 0.62 0.00 3.45 5.08 -2.01 -3.46 114.58 118.27 1pms h GLU 526 Ca 0.02 -0.82 -0.15 0.00 -1.00 0.00 0.00 59.36 57.41 1pms h GLU 526 Cb 0.73 0.27 0.07 0.00 0.50 0.00 0.00 28.75 30.31 1pms h GLU 526 CO -0.00 1.37 0.10 0.66 -1.00 0.00 0.00 179.01 180.14 1pms n TYR 527 N -3.82 -3.67 -0.21 4.33 4.01 0.10 -4.91 117.16 112.99 1pms n TYR 527 Ca -0.13 -0.41 -0.12 0.00 -0.16 0.00 0.00 57.90 57.08 1pms n TYR 527 Cb 0.97 -0.40 -0.09 0.00 -0.31 0.00 0.00 39.34 39.50 1pms n TYR 527 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1pms h LYS 528 N 0.00 -0.26 -5.22 -0.72 6.56 -1.89 -3.46 116.57 111.59 1pms h LYS 528 Ca -0.16 0.02 -0.15 0.00 -1.06 0.00 0.00 60.65 59.30 1pms h LYS 528 Cb 0.46 0.06 0.12 0.00 -0.57 0.00 0.00 32.23 32.29 1pms h LYS 528 CO 0.11 -0.17 -0.51 1.58 -2.06 0.00 0.00 179.45 178.39 1pms n HIS 529 N -5.21 -2.43 -1.23 -1.35 -0.00 -1.26 -4.93 115.22 98.82 1pms n HIS 529 Ca -0.02 0.88 0.00 0.00 -0.00 0.00 0.00 57.72 58.58 1pms n HIS 529 Cb 0.30 -3.96 0.00 0.00 -0.00 0.00 0.00 29.99 26.33 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 -2.61 0.00 -3.59 1.57 0.00 -1.26 -4.85 120.51 109.78 1pms n ALA 530 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.27 1pms n ALA 530 Cb 0.57 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.89 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 2.74 -0.28 -0.47 0.00 0.40 -1.07 -4.37 117.98 114.93 1pms s PHE 531 Ca 0.00 0.68 -0.11 0.00 -0.60 0.00 0.00 56.93 56.90 1pms s PHE 531 Cb 0.00 0.03 0.11 0.00 0.51 0.00 0.00 43.02 43.67 1pms s PHE 531 CO 0.00 -0.19 0.36 -1.21 0.70 0.00 0.00 175.22 174.88 1pms s GLU 532 N 0.99 2.67 0.46 0.44 2.02 -1.16 -2.73 118.70 121.39 1pms s GLU 532 Ca -0.07 -1.63 -0.04 0.00 0.02 0.00 0.00 54.97 53.25 1pms s GLU 532 Cb -0.09 -3.99 -0.03 0.00 0.10 0.00 0.00 34.13 30.12 1pms s GLU 532 CO -0.06 -1.15 0.74 0.42 0.02 0.00 0.00 175.26 175.23 1pms s ILE 533 N 1.46 4.80 0.07 -1.63 1.09 -0.52 -1.88 121.20 124.60 1pms s ILE 533 Ca 0.04 0.01 0.04 0.00 -1.10 0.00 0.00 60.65 59.64 1pms s ILE 533 Cb -0.26 -3.81 -0.03 0.00 -1.06 0.00 0.00 42.46 37.30 1pms s ILE 533 CO 0.02 -0.73 -0.11 -0.63 -0.10 0.00 0.00 174.94 173.38 1pms s ILE 534 N -2.66 0.89 0.42 2.92 1.01 -0.95 0.19 121.20 123.01 1pms s ILE 534 Ca 0.46 -1.33 -0.05 0.00 0.00 0.00 0.00 60.65 59.73 1pms s ILE 534 Cb -0.10 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 1pms s ILE 534 CO 0.43 -0.37 0.70 -0.76 0.00 0.00 0.00 174.94 174.95 1pms s LEU 535 N -1.89 3.79 -0.15 2.97 1.43 -0.79 -3.35 118.68 120.69 1pms s LEU 535 Ca -0.02 0.83 0.13 0.00 -1.03 0.00 0.00 54.13 54.03 1pms s LEU 535 Cb -0.08 -3.73 0.64 0.00 0.03 0.00 0.00 46.19 43.05 1pms s LEU 535 CO 0.01 -0.45 1.51 0.29 0.23 0.00 0.00 176.35 177.94 1pms n LYS 536 N -1.87 3.81 -0.08 1.70 5.02 -1.25 -4.22 118.16 121.26 1pms n LYS 536 Ca -0.01 -2.49 -0.18 0.00 -2.02 0.00 0.00 58.31 53.61 1pms n LYS 536 Cb 0.55 -1.99 -0.06 0.00 -0.02 0.00 0.00 35.03 33.51 1pms n LYS 536 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1pms n ASP 537 N 0.68 1.21 0.00 4.39 2.03 -1.26 -5.01 116.55 118.59 1pms n ASP 537 Ca 0.22 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.74 1pms n ASP 537 Cb 0.92 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.81 1pms n ASP 537 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pms n GLY 538 N 1.94 0.00 0.07 0.27 0.00 -1.26 -5.17 105.19 101.04 1pms n GLY 538 Ca -0.33 0.00 -0.00 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 -3.72 1.61 4.13 -1.26 -5.03 115.26 111.22 1pms n ASN 539 Ca 0.00 -1.05 -0.13 0.00 1.68 0.00 0.00 54.58 55.08 1pms n ASN 539 Cb 0.00 0.03 -0.13 0.00 -1.54 0.00 0.00 39.78 38.14 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 -1.05 -0.08 -0.99 6.41 1.04 -1.26 -1.89 113.70 115.87 1pms s SER 540 Ca 0.01 0.48 -0.12 0.00 0.48 0.00 0.00 55.95 56.80 1pms s SER 540 Cb 0.00 0.40 0.24 0.00 0.10 0.00 0.00 66.02 66.76 1pms s SER 540 CO 0.01 -0.18 0.99 -0.69 0.98 0.00 0.00 173.24 174.35 1pms s VAL 541 N 1.48 5.73 -0.22 5.02 1.01 0.13 -4.88 120.40 128.67 1pms s VAL 541 Ca -0.07 -2.90 -0.09 0.00 0.00 0.00 0.00 61.98 58.92 1pms s VAL 541 Cb -0.11 -4.58 -0.04 0.00 0.00 0.00 0.00 36.38 31.65 1pms s VAL 541 CO -0.08 -1.16 0.10 -0.63 0.00 0.00 0.00 175.10 173.33 1pms s ILE 542 N -0.33 4.90 0.34 2.22 -1.09 -1.26 -1.43 121.20 124.55 1pms s ILE 542 Ca 0.26 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.73 1pms s ILE 542 Cb -0.09 -3.26 -0.04 0.00 -1.58 0.00 0.00 42.46 37.49 1pms s ILE 542 CO -0.08 0.39 0.12 0.72 -1.23 0.00 0.00 174.94 174.86 1pms s PHE 543 N 0.90 1.73 -0.20 3.97 -0.71 -1.10 -2.68 117.98 119.88 1pms s PHE 543 Ca 0.05 -1.24 -0.07 0.00 -1.04 0.00 0.00 56.93 54.64 1pms s PHE 543 Cb -0.13 -1.05 0.10 0.00 -1.21 0.00 0.00 43.02 40.72 1pms s PHE 543 CO 0.03 -0.32 0.42 0.45 -1.34 0.00 0.00 175.22 174.46 1pms s SER 544 N -3.47 -0.24 0.45 1.98 0.15 -0.06 -2.61 113.70 109.91 1pms s SER 544 Ca 0.32 0.94 -0.21 0.00 0.70 0.00 0.00 55.95 57.70 1pms s SER 544 Cb 0.05 1.35 -0.10 0.00 -1.71 0.00 0.00 66.02 65.61 1pms s SER 544 CO 0.16 -0.24 0.97 0.00 1.20 0.00 0.00 173.24 175.33 1pms s ALA 545 N 2.61 3.00 -0.12 5.45 0.00 -1.26 -1.12 121.76 130.33 1pms s ALA 545 Ca -0.00 0.44 -0.03 0.00 0.00 0.00 0.00 51.96 52.37 1pms s ALA 545 Cb -0.12 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 1pms s ALA 545 CO -0.13 0.01 2.60 1.63 0.00 0.00 0.00 175.76 179.87 1pms n LYS 546 N -0.75 1.63 -3.86 0.00 4.76 -1.26 -4.64 118.16 114.04 1pms n LYS 546 Ca 0.08 -0.89 -0.02 0.00 -2.87 0.00 0.00 58.31 54.61 1pms n LYS 546 Cb 0.54 -1.56 0.01 0.00 -1.84 0.00 0.00 35.03 32.17 1pms n LYS 546 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1pms s SER 547 N 1.46 -0.02 -0.05 4.39 0.01 -1.26 -5.00 113.70 113.23 1pms s SER 547 Ca 0.34 -0.50 0.14 0.00 1.31 0.00 0.00 55.95 57.24 1pms s SER 547 Cb 0.19 0.40 -0.22 0.00 0.21 0.00 0.00 66.02 66.60 1pms s SER 547 CO -0.03 -0.78 0.62 0.00 0.41 0.00 0.00 173.24 173.47 1pms n ALA 548 N -0.69 1.56 0.09 1.44 0.00 -1.26 -3.27 120.51 118.38 1pms n ALA 548 Ca -0.03 -0.80 -0.23 0.00 0.00 0.00 0.00 53.44 52.39 1pms n ALA 548 Cb 0.60 -0.79 -0.15 0.00 0.00 0.00 0.00 19.45 19.10 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 0.42 0.00 0.00 4.11 -1.97 -3.10 114.58 114.04 1pms h GLU 549 Ca -0.30 -0.71 -0.06 0.00 0.07 0.00 0.00 59.36 58.36 1pms h GLU 549 Cb 1.98 0.27 -0.01 0.00 0.50 0.00 0.00 28.75 31.49 1pms h GLU 549 CO 0.07 1.33 -0.28 0.93 0.07 0.00 0.00 179.01 181.13 1pms h GLU 550 N 0.11 0.00 0.06 1.06 5.08 -1.94 0.39 114.58 119.35 1pms h GLU 550 Ca -0.31 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1pms h GLU 550 Cb 2.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.36 1pms h GLU 550 CO 0.20 0.28 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.24 1pms h LYS 551 N 0.00 -0.08 0.00 2.33 3.64 -1.62 -2.97 116.57 117.88 1pms h LYS 551 Ca -0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1pms h LYS 551 Cb 0.56 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1pms h LYS 551 CO 0.04 0.42 0.00 0.09 -2.27 0.00 0.00 179.45 177.73 1pms n ASN 552 N -4.88 0.00 0.08 4.20 3.02 -1.13 -2.96 115.26 113.60 1pms n ASN 552 Ca -0.09 0.44 -0.05 0.00 -0.03 0.00 0.00 54.58 54.86 1pms n ASN 552 Cb 0.27 -0.48 -0.03 0.00 -0.61 0.00 0.00 39.78 38.93 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 -0.26 -0.40 6.41 4.21 -0.09 -2.37 115.58 123.08 1pms h ASN 553 Ca 0.00 -0.02 -0.07 0.00 1.21 0.00 0.00 56.30 57.42 1pms h ASN 553 Cb 0.43 0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.67 1pms h ASN 553 CO 0.00 0.21 -0.01 -0.50 -1.29 0.00 0.00 177.43 175.84 1pms h TRP 554 N -1.07 0.84 -0.73 1.19 4.06 -1.63 -1.67 115.95 116.94 1pms h TRP 554 Ca -0.03 -0.12 0.05 0.00 2.06 0.00 0.00 58.89 60.85 1pms h TRP 554 Cb 0.27 -0.23 -0.05 0.00 -1.00 0.00 0.00 29.16 28.15 1pms h TRP 554 CO 0.01 0.78 0.44 1.98 -3.56 0.00 0.00 178.44 178.09 1pms h MET 555 N 0.74 0.81 -0.21 0.49 1.85 -1.64 -2.20 114.93 114.77 1pms h MET 555 Ca 0.14 -0.05 -0.18 0.00 -0.61 0.00 0.00 59.70 59.00 1pms h MET 555 Cb 0.46 -0.18 -0.00 0.00 0.43 0.00 0.00 31.60 32.30 1pms h MET 555 CO 0.02 0.53 -0.60 0.00 -0.40 0.00 0.00 176.91 176.46 1pms h ALA 556 N 1.34 0.55 0.00 0.39 0.00 -0.98 -2.76 119.26 117.80 1pms h ALA 556 Ca 0.31 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1pms h ALA 556 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1pms h ALA 556 CO -0.15 0.69 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1pms h ALA 557 N 0.81 1.00 0.00 0.00 0.00 -0.73 0.12 119.26 120.47 1pms h ALA 557 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pms h ALA 557 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1pms h ALA 557 CO 0.12 0.00 -0.04 -0.07 0.00 0.00 0.00 179.25 179.26 1pms h LEU 558 N 0.00 0.00 -1.11 0.00 3.38 -1.14 -3.24 115.31 113.20 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 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1pms h LEU 558 CO 0.00 0.32 0.00 -0.38 0.09 0.00 0.00 178.44 178.47 1pms n ILE 559 N -3.63 1.15 -0.09 1.22 -0.00 -1.16 -1.57 119.36 115.28 1pms n ILE 559 Ca -0.01 0.63 -0.12 0.00 -0.00 0.00 0.00 62.75 63.25 1pms n ILE 559 Cb 0.02 -1.61 -0.05 0.00 -0.00 0.00 0.00 39.64 38.00 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 0.54 0.18 4.38 0.87 -0.82 -2.92 113.55 115.79 1pms h SER 560 Ca 0.00 -0.40 -0.23 0.00 -1.23 0.00 0.00 61.79 59.93 1pms h SER 560 Cb 0.05 -0.15 0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1pms h SER 560 CO 0.00 0.82 -0.93 -0.07 -0.53 0.00 0.00 176.83 176.13 1pms h LEU 561 N 0.26 0.67 -1.04 2.23 -0.00 -1.31 -3.18 115.31 112.93 1pms h LEU 561 Ca 0.06 -0.52 0.21 0.00 -0.00 0.00 0.00 57.88 57.63 1pms h LEU 561 Cb 0.61 -0.20 -0.11 0.00 -0.00 0.00 0.00 40.66 40.96 1pms h LEU 561 CO 0.04 1.31 0.61 -0.61 -0.00 0.00 0.00 178.44 179.79 1pms h GLN 562 N 0.32 0.66 -0.86 1.13 4.15 -1.42 0.38 115.11 119.47 1pms h GLN 562 Ca -0.08 -0.04 0.22 0.00 0.77 0.00 0.00 58.65 59.52 1pms h GLN 562 Cb 1.56 -0.15 -0.14 0.00 0.21 0.00 0.00 27.48 28.95 1pms h GLN 562 CO 0.17 0.44 0.15 1.88 -1.93 0.00 0.00 178.83 179.54 1pms h TYR 563 N 0.68 0.19 0.00 3.99 -1.99 -1.49 -3.37 116.97 114.99 1pms h TYR 563 Ca 0.59 0.05 0.00 0.00 2.00 0.00 0.00 58.73 61.38 1pms h TYR 563 Cb 1.03 0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.81 1pms h TYR 563 CO -0.00 -0.25 0.00 2.89 -0.00 0.00 0.00 178.16 180.80 1pms n ARG 564 N -5.29 0.00 0.00 4.88 0.00 0.17 -5.16 116.66 111.26 1pms n ARG 564 Ca 0.19 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 58.07 1pms n ARG 564 Cb 0.64 -0.06 0.13 0.00 -0.00 0.00 0.00 32.46 33.16 1pms n ARG 564 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08