#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fwu s ALA 502 N 0.00 1.37 -0.17 1.59 0.00 -1.20 -4.05 121.76 119.31 2fwu s ALA 502 Ca 0.00 -1.12 -0.23 0.00 0.00 0.00 0.00 51.96 50.61 2fwu s ALA 502 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 2fwu s ALA 502 CO 0.00 0.19 0.73 0.20 0.00 0.00 0.00 175.76 176.88 2fwu s GLY 503 N -1.95 2.16 -0.27 0.00 0.00 -1.26 -4.72 107.32 101.28 2fwu s GLY 503 Ca 0.02 -0.07 -0.19 0.00 0.00 0.00 0.00 44.72 44.49 2fwu s GLY 503 CO 0.03 1.46 0.54 -0.42 0.00 0.00 0.00 173.10 174.71 2fwu s ILE 504 N 1.86 5.04 -0.11 0.90 1.09 -1.26 -0.60 121.20 128.12 2fwu s ILE 504 Ca 0.34 0.88 0.02 0.00 -1.10 0.00 0.00 60.65 60.79 2fwu s ILE 504 Cb -0.16 -3.87 0.01 0.00 -1.06 0.00 0.00 42.46 37.37 2fwu s ILE 504 CO 0.12 0.03 -0.18 -0.36 -0.10 0.00 0.00 174.94 174.45 2fwu s PHE 505 N 2.38 2.19 0.19 3.97 0.08 -1.08 -3.30 117.98 122.41 2fwu s PHE 505 Ca 0.22 -1.03 -0.15 0.00 0.12 0.00 0.00 56.93 56.09 2fwu s PHE 505 Cb -0.15 -1.54 0.02 0.00 -0.57 0.00 0.00 43.02 40.77 2fwu s PHE 505 CO 0.10 -0.50 0.46 -0.08 -0.10 0.00 0.00 175.22 175.10 2fwu s THR 506 N 0.86 0.03 0.49 0.64 -1.32 -1.26 -0.24 115.64 114.84 2fwu s THR 506 Ca -0.08 -0.98 -0.03 0.00 -1.21 0.00 0.00 61.69 59.39 2fwu s THR 506 Cb -0.15 -1.69 -0.01 0.00 -1.51 0.00 0.00 72.50 69.14 2fwu s THR 506 CO -0.00 -0.16 0.77 -0.36 -2.21 0.00 0.00 174.62 172.65 2fwu s PHE 507 N -3.91 3.37 -0.14 9.09 0.08 -1.13 -3.64 117.98 121.71 2fwu s PHE 507 Ca 0.12 0.56 -0.15 0.00 0.12 0.00 0.00 56.93 57.58 2fwu s PHE 507 Cb 0.00 -2.40 -0.25 0.00 -0.57 0.00 0.00 43.02 39.81 2fwu s PHE 507 CO -0.01 -0.42 0.40 1.49 -0.10 0.00 0.00 175.22 176.57 2fwu h GLU 508 N 0.20 0.18 -5.52 0.44 4.22 -1.90 -3.44 114.58 108.77 2fwu h GLU 508 Ca -0.47 -0.30 -0.64 0.00 0.08 0.00 0.00 59.36 58.03 2fwu h GLU 508 Cb 1.23 0.11 -0.16 0.00 0.50 0.00 0.00 28.75 30.44 2fwu h GLU 508 CO 0.60 1.15 -0.59 -1.83 -2.18 0.00 0.00 179.01 176.15 2fwu s GLU 509 N -2.47 3.59 0.02 1.92 1.03 -1.26 -4.98 118.70 116.54 2fwu s GLU 509 Ca -0.23 -0.38 0.26 0.00 0.03 0.00 0.00 54.97 54.65 2fwu s GLU 509 Cb 0.05 -3.03 0.67 0.00 -0.80 0.00 0.00 34.13 31.02 2fwu s GLU 509 CO 0.72 0.44 1.54 -0.35 -1.33 0.00 0.00 175.26 176.27 2fwu n PRO 510 N 2.99 0.04 -3.83 -4.83 -0.04 -1.26 -4.75 135.00 123.31 2fwu n PRO 510 Ca -0.18 0.01 -0.12 0.00 -0.04 0.00 0.00 63.50 63.17 2fwu n PRO 510 Cb 0.53 -1.53 -0.13 0.00 -0.04 0.00 0.00 33.50 32.33 2fwu n PRO 510 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2fwu s VAL 511 N -3.02 -0.01 -0.02 0.52 1.01 -1.26 0.41 120.40 118.03 2fwu s VAL 511 Ca 0.11 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.09 2fwu s VAL 511 Cb 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 36.42 2fwu s VAL 511 CO 0.66 0.01 0.07 0.28 0.00 0.00 0.00 175.10 176.12 2fwu s THR 512 N 0.17 0.02 -0.15 3.92 -1.32 -0.32 -4.90 115.64 113.05 2fwu s THR 512 Ca -0.01 -0.14 -0.04 0.00 -1.21 0.00 0.00 61.69 60.29 2fwu s THR 512 Cb -0.02 -0.15 -0.03 0.00 -1.51 0.00 0.00 72.50 70.79 2fwu s THR 512 CO -0.00 -0.08 -0.04 -1.00 -2.21 0.00 0.00 174.62 171.29 2fwu s HIS 513 N -0.21 3.03 0.21 9.09 3.76 -1.26 -0.65 115.29 129.26 2fwu s HIS 513 Ca -0.03 -0.27 0.06 0.00 -0.15 0.00 0.00 55.06 54.67 2fwu s HIS 513 Cb -0.02 -1.95 -0.05 0.00 1.11 0.00 0.00 32.58 31.67 2fwu s HIS 513 CO 0.00 -0.01 -0.08 0.14 -0.85 0.00 0.00 174.74 173.94 2fwu s VAL 514 N 0.30 1.41 0.48 -0.90 -7.23 -0.46 -4.97 120.40 109.02 2fwu s VAL 514 Ca -0.03 -2.11 -0.11 0.00 -1.81 0.00 0.00 61.98 57.92 2fwu s VAL 514 Cb -0.14 -2.16 -0.06 0.00 0.56 0.00 0.00 36.38 34.58 2fwu s VAL 514 CO 0.03 -0.50 0.86 -0.55 -0.31 0.00 0.00 175.10 174.63 2fwu s SER 515 N -3.31 6.44 0.00 4.85 0.15 -1.26 -1.20 113.70 119.37 2fwu s SER 515 Ca 0.24 1.22 0.26 0.00 0.70 0.00 0.00 55.95 58.37 2fwu s SER 515 Cb 0.03 -2.37 0.77 0.00 -1.71 0.00 0.00 66.02 62.74 2fwu s SER 515 CO 0.07 -0.55 1.58 1.21 1.20 0.00 0.00 173.24 176.75 2fwu n GLU 516 N -1.79 0.51 -0.20 5.44 2.13 -0.23 -3.43 120.64 123.07 2fwu n GLU 516 Ca 0.03 -0.28 0.11 0.00 0.66 0.00 0.00 57.16 57.69 2fwu n GLU 516 Cb 0.54 -1.49 0.26 0.00 0.27 0.00 0.00 31.44 31.02 2fwu n GLU 516 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2fwu n SER 517 N -1.00 3.09 -4.85 4.31 2.88 -1.26 -4.76 113.62 112.02 2fwu n SER 517 Ca 0.10 -1.94 -0.32 0.00 -1.33 0.00 0.00 58.87 55.38 2fwu n SER 517 Cb 0.33 -0.27 -0.06 0.00 -0.75 0.00 0.00 64.21 63.47 2fwu n SER 517 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2fwu s ILE 518 N -1.46 4.67 -0.09 2.46 2.07 -1.22 -5.01 121.20 122.61 2fwu s ILE 518 Ca 0.38 0.95 -0.06 0.00 -1.41 0.00 0.00 60.65 60.51 2fwu s ILE 518 Cb 0.21 -3.63 -0.02 0.00 0.13 0.00 0.00 42.46 39.15 2fwu s ILE 518 CO 0.30 -0.28 -0.11 1.23 -1.91 0.00 0.00 174.94 174.17 2fwu h GLY 519 N 1.99 0.00 -5.98 1.50 0.00 -1.91 -3.37 103.07 95.31 2fwu h GLY 519 Ca -0.48 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.24 2fwu h GLY 519 CO 0.65 0.00 -0.84 -0.42 0.00 0.00 0.00 176.54 175.92 2fwu s ILE 520 N -1.80 1.67 -0.14 2.60 -1.09 -1.26 -1.46 121.20 119.73 2fwu s ILE 520 Ca -0.09 -0.73 -0.06 0.00 -2.23 0.00 0.00 60.65 57.53 2fwu s ILE 520 Cb 0.01 -1.52 -0.04 0.00 -1.58 0.00 0.00 42.46 39.34 2fwu s ILE 520 CO 0.14 0.47 0.09 0.00 -1.23 0.00 0.00 174.94 174.41 2fwu s MET 521 N 1.03 3.62 -0.08 2.79 0.23 -0.30 -4.90 119.30 121.69 2fwu s MET 521 Ca -0.04 -0.27 0.05 0.00 -1.03 0.00 0.00 55.69 54.40 2fwu s MET 521 Cb -0.15 -3.15 -0.00 0.00 -1.53 0.00 0.00 34.83 30.00 2fwu s MET 521 CO -0.04 0.54 -0.23 -1.21 -2.03 0.00 0.00 175.02 172.05 2fwu s GLU 522 N -0.38 2.70 -0.19 3.16 2.02 -1.25 -1.45 118.70 123.31 2fwu s GLU 522 Ca 0.10 -0.84 -0.03 0.00 0.02 0.00 0.00 54.97 54.22 2fwu s GLU 522 Cb -0.12 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 31.96 2fwu s GLU 522 CO 0.02 0.25 -0.07 0.08 0.02 0.00 0.00 175.26 175.55 2fwu s VAL 523 N 0.16 3.26 -0.16 2.63 1.01 -1.06 -4.92 120.40 121.32 2fwu s VAL 523 Ca -0.12 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 2fwu s VAL 523 Cb -0.16 -2.45 -0.00 0.00 0.00 0.00 0.00 36.38 33.77 2fwu s VAL 523 CO 0.06 0.46 1.03 -0.54 0.00 0.00 0.00 175.10 176.12 2fwu s LYS 524 N 1.08 4.34 0.08 2.72 -0.14 -1.26 -2.65 119.74 123.91 2fwu s LYS 524 Ca 0.01 1.39 0.01 0.00 -1.36 0.00 0.00 55.97 56.02 2fwu s LYS 524 Cb -0.15 -3.59 -0.04 0.00 -1.68 0.00 0.00 37.83 32.37 2fwu s LYS 524 CO -0.01 -0.47 0.19 0.08 -0.76 0.00 0.00 175.35 174.38 2fwu s VAL 525 N 2.60 5.19 0.21 3.17 1.01 -0.07 -4.47 120.40 128.04 2fwu s VAL 525 Ca 0.47 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.89 2fwu s VAL 525 Cb -0.17 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2fwu s VAL 525 CO 0.12 0.09 0.43 -0.76 0.00 0.00 0.00 175.10 174.98 2fwu s LEU 526 N -2.62 4.20 0.66 3.92 2.01 -1.24 -3.87 118.68 121.72 2fwu s LEU 526 Ca 0.34 0.52 0.02 0.00 0.01 0.00 0.00 54.13 55.02 2fwu s LEU 526 Cb -0.12 -3.29 0.10 0.00 0.01 0.00 0.00 46.19 42.89 2fwu s LEU 526 CO 0.27 -0.06 0.91 -0.13 1.01 0.00 0.00 176.35 178.35 2fwu s ARG 527 N -3.22 1.96 0.55 1.70 0.52 -1.26 -4.53 118.95 114.66 2fwu s ARG 527 Ca 0.40 -1.20 -0.05 0.00 -0.52 0.00 0.00 55.73 54.36 2fwu s ARG 527 Cb -0.11 -2.44 0.00 0.00 0.52 0.00 0.00 34.95 32.92 2fwu s ARG 527 CO 0.28 -1.19 0.84 -0.08 0.02 0.00 0.00 175.30 175.17 2fwu s THR 528 N -2.96 3.85 0.17 0.02 -1.32 -1.21 -4.88 115.64 109.30 2fwu s THR 528 Ca 0.64 -0.08 -0.12 0.00 -1.21 0.00 0.00 61.69 60.92 2fwu s THR 528 Cb -0.06 -3.50 0.07 0.00 -1.51 0.00 0.00 72.50 67.50 2fwu s THR 528 CO 0.42 -0.48 1.73 -1.28 -2.21 0.00 0.00 174.62 172.80 2fwu h SER 529 N -0.02 0.81 -2.72 8.08 0.87 -1.88 -3.16 113.55 115.53 2fwu h SER 529 Ca -0.46 -0.17 -0.80 0.00 -1.23 0.00 0.00 61.79 59.13 2fwu h SER 529 Cb 1.25 -0.21 -0.28 0.00 -0.44 0.00 0.00 62.40 62.72 2fwu h SER 529 CO 0.60 0.76 0.80 0.61 -0.53 0.00 0.00 176.83 179.06 2fwu n GLY 530 N -0.82 5.42 3.58 5.77 0.00 -1.26 -4.93 105.19 112.96 2fwu n GLY 530 Ca 0.03 -2.65 -0.41 0.00 0.00 0.00 0.00 46.02 42.99 2fwu n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fwu s ALA 531 N -3.20 3.13 -0.01 4.61 0.00 -1.20 -4.84 121.76 120.26 2fwu s ALA 531 Ca 0.33 -2.81 0.02 0.00 0.00 0.00 0.00 51.96 49.51 2fwu s ALA 531 Cb 0.09 -4.65 -0.00 0.00 0.00 0.00 0.00 23.12 18.56 2fwu s ALA 531 CO 0.04 -3.52 -0.07 1.03 0.00 0.00 0.00 175.76 173.25 2fwu s ARG 532 N 4.50 0.60 0.00 0.00 1.81 -1.26 -4.02 118.95 120.58 2fwu s ARG 532 Ca 0.55 -0.23 0.00 0.00 -1.72 0.00 0.00 55.73 54.33 2fwu s ARG 532 Cb 0.03 -0.58 0.00 0.00 -0.45 0.00 0.00 34.95 33.95 2fwu s ARG 532 CO 0.08 0.12 0.00 0.41 -0.68 0.00 0.00 175.30 175.23 2fwu n GLY 533 N 3.06 -0.63 3.47 -3.53 0.00 -1.26 -4.74 105.19 101.55 2fwu n GLY 533 Ca -0.15 -1.72 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 2fwu n GLY 533 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fwu s ASN 534 N -2.39 5.17 -0.11 1.61 3.04 -0.26 -2.81 114.94 119.20 2fwu s ASN 534 Ca 0.00 -0.18 0.02 0.00 0.04 0.00 0.00 52.86 52.74 2fwu s ASN 534 Cb 0.00 -1.92 0.01 0.00 -1.54 0.00 0.00 41.25 37.80 2fwu s ASN 534 CO 0.00 -0.01 -0.17 -0.69 -3.04 0.00 0.00 177.10 173.19 2fwu s VAL 535 N 1.46 1.63 -0.13 -5.21 1.01 0.02 -0.30 120.40 118.88 2fwu s VAL 535 Ca 0.06 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 2fwu s VAL 535 Cb -0.15 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2fwu s VAL 535 CO 0.04 0.47 0.17 -0.63 0.00 0.00 0.00 175.10 175.14 2fwu s ILE 536 N 0.86 5.44 -0.25 2.22 -1.09 0.08 -1.50 121.20 126.96 2fwu s ILE 536 Ca -0.09 0.28 0.02 0.00 -2.23 0.00 0.00 60.65 58.63 2fwu s ILE 536 Cb -0.15 -3.45 0.06 0.00 -1.58 0.00 0.00 42.46 37.33 2fwu s ILE 536 CO -0.00 0.56 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.50 2fwu s VAL 537 N -0.65 1.89 0.18 2.92 1.01 0.11 -0.52 120.40 125.34 2fwu s VAL 537 Ca 0.14 -1.47 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 2fwu s VAL 537 Cb -0.12 -2.08 -0.08 0.00 0.00 0.00 0.00 36.38 34.10 2fwu s VAL 537 CO 0.03 -0.07 1.11 -2.16 0.00 0.00 0.00 175.10 174.01 2fwu s PRO 538 N 1.22 4.59 0.10 2.72 0.04 -1.26 -0.14 135.00 142.27 2fwu s PRO 538 Ca -0.07 1.73 0.03 0.00 0.04 0.00 0.00 61.00 62.73 2fwu s PRO 538 Cb -0.19 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 2fwu s PRO 538 CO -0.06 0.07 -0.09 1.52 0.04 0.00 0.00 177.00 178.49 2fwu s TYR 539 N -0.26 1.00 0.09 0.56 1.13 0.71 -0.04 117.35 120.54 2fwu s TYR 539 Ca 0.49 -0.76 -0.21 0.00 -1.41 0.00 0.00 57.07 55.18 2fwu s TYR 539 Cb -0.30 -0.55 0.05 0.00 -1.10 0.00 0.00 41.96 40.07 2fwu s TYR 539 CO 0.35 -0.05 0.52 -1.59 -2.51 0.00 0.00 175.55 172.27 2fwu s LYS 540 N -3.26 1.10 -0.32 -3.49 -2.85 -0.74 -1.32 119.74 108.86 2fwu s LYS 540 Ca 0.09 -0.37 -0.19 0.00 -1.00 0.00 0.00 55.97 54.49 2fwu s LYS 540 Cb 0.01 0.50 -0.01 0.00 -2.06 0.00 0.00 37.83 36.27 2fwu s LYS 540 CO -0.02 -0.42 0.59 0.95 0.10 0.00 0.00 175.35 176.55 2fwu s THR 541 N -2.98 4.97 -0.41 3.79 -4.23 -0.74 -2.12 115.64 113.92 2fwu s THR 541 Ca -0.02 0.71 -0.23 0.00 -1.18 0.00 0.00 61.69 60.96 2fwu s THR 541 Cb -0.00 -3.98 0.02 0.00 1.34 0.00 0.00 72.50 69.88 2fwu s THR 541 CO -0.06 -0.15 0.80 -0.63 -0.54 0.00 0.00 174.62 174.04 2fwu s ILE 542 N 2.53 4.67 0.19 2.99 1.09 0.18 -4.88 121.20 127.98 2fwu s ILE 542 Ca 0.23 0.70 -0.11 0.00 -1.10 0.00 0.00 60.65 60.37 2fwu s ILE 542 Cb -0.15 -4.28 0.12 0.00 -1.06 0.00 0.00 42.46 37.09 2fwu s ILE 542 CO 0.12 -0.59 1.75 1.05 -0.10 0.00 0.00 174.94 177.17 2fwu h GLU 543 N 8.74 0.37 0.00 2.79 -0.00 -1.85 -0.34 114.58 124.29 2fwu h GLU 543 Ca -0.25 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 59.09 2fwu h GLU 543 Cb 1.09 -0.08 0.00 0.00 -0.00 0.00 0.00 28.75 29.75 2fwu h GLU 543 CO 0.94 0.25 0.00 0.41 -0.00 0.00 0.00 179.01 180.61 2fwu n GLY 544 N -1.28 0.56 0.29 1.06 0.00 -1.26 -0.71 105.19 103.84 2fwu n GLY 544 Ca 0.07 0.56 0.04 0.00 0.00 0.00 0.00 46.02 46.68 2fwu n GLY 544 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2fwu n THR 545 N 0.00 0.04 -4.05 2.61 5.66 -1.24 -5.00 114.28 112.30 2fwu n THR 545 Ca 0.00 -0.52 -0.25 0.00 -3.05 0.00 0.00 64.05 60.23 2fwu n THR 545 Cb 0.00 1.12 -0.04 0.00 -1.55 0.00 0.00 70.33 69.86 2fwu n THR 545 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2fwu s ALA 546 N -0.61 3.69 -0.15 1.79 0.00 0.11 -4.85 121.76 121.74 2fwu s ALA 546 Ca 0.09 -1.23 -0.23 0.00 0.00 0.00 0.00 51.96 50.59 2fwu s ALA 546 Cb 0.06 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.69 2fwu s ALA 546 CO 0.09 0.42 0.70 1.03 0.00 0.00 0.00 175.76 178.00 2fwu s ARG 547 N -3.40 4.30 0.87 0.00 3.00 -1.26 -4.75 118.95 117.71 2fwu s ARG 547 Ca 0.32 0.79 -0.08 0.00 0.00 0.00 0.00 55.73 56.76 2fwu s ARG 547 Cb -0.10 -3.54 0.19 0.00 0.00 0.00 0.00 34.95 31.50 2fwu s ARG 547 CO 0.25 -0.17 1.19 0.20 0.00 0.00 0.00 175.30 176.77 2fwu s GLY 548 N 1.06 1.79 -0.51 -3.53 0.00 -1.26 -0.91 107.32 103.95 2fwu s GLY 548 Ca 0.34 -1.62 -0.00 0.00 0.00 0.00 0.00 44.72 43.44 2fwu s GLY 548 CO 0.13 -0.88 0.03 0.61 0.00 0.00 0.00 173.10 172.99 2fwu n GLY 549 N -3.38 0.15 2.11 0.20 0.00 -1.25 -3.20 105.19 99.82 2fwu n GLY 549 Ca 0.17 -0.61 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 2fwu n GLY 549 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fwu n GLY 550 N -1.00 0.63 0.03 -0.02 0.00 -0.09 -4.92 105.19 99.82 2fwu n GLY 550 Ca -0.07 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 45.07 2fwu n GLY 550 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fwu n GLU 551 N -2.67 0.17 -0.09 1.61 4.07 -1.20 -4.71 120.64 117.82 2fwu n GLU 551 Ca -0.04 0.31 -0.09 0.00 -0.06 0.00 0.00 57.16 57.28 2fwu n GLU 551 Cb 0.19 -1.06 -0.15 0.00 -0.06 0.00 0.00 31.44 30.36 2fwu n GLU 551 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2fwu n ASP 552 N -3.15 0.45 -3.89 4.31 -0.08 -0.09 -4.62 116.55 109.48 2fwu n ASP 552 Ca -0.03 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.16 2fwu n ASP 552 Cb 0.11 0.97 -0.08 0.00 2.34 0.00 0.00 41.12 44.47 2fwu n ASP 552 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 2fwu s PHE 553 N -2.46 0.20 -0.11 -0.67 -0.71 -0.88 -3.32 117.98 110.04 2fwu s PHE 553 Ca -0.09 -0.65 -0.19 0.00 -1.04 0.00 0.00 56.93 54.96 2fwu s PHE 553 Cb 0.06 -0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 2fwu s PHE 553 CO 0.76 -0.52 0.50 -2.00 -1.34 0.00 0.00 175.22 172.62 2fwu s GLU 554 N -3.87 4.35 -0.30 1.99 -6.30 -0.49 -0.91 118.70 113.17 2fwu s GLU 554 Ca 0.05 0.50 -0.24 0.00 -2.50 0.00 0.00 54.97 52.79 2fwu s GLU 554 Cb 0.05 -3.44 0.00 0.00 0.00 0.00 0.00 34.13 30.75 2fwu s GLU 554 CO -0.11 0.15 0.80 0.34 0.02 0.00 0.00 175.26 176.47 2fwu s ASP 555 N 0.63 6.69 -0.18 -1.70 2.15 -1.26 -4.48 116.67 118.52 2fwu s ASP 555 Ca 0.27 0.72 -0.01 0.00 0.43 0.00 0.00 52.55 53.96 2fwu s ASP 555 Cb -0.15 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 2fwu s ASP 555 CO 0.11 -0.61 -0.13 0.28 -0.17 0.00 0.00 175.17 174.65 2fwu s THR 556 N 2.97 2.72 -0.07 1.71 -1.32 -1.26 -4.96 115.64 115.43 2fwu s THR 556 Ca 0.33 -0.73 -0.03 0.00 -1.21 0.00 0.00 61.69 60.05 2fwu s THR 556 Cb -0.14 -2.18 0.04 0.00 -1.51 0.00 0.00 72.50 68.71 2fwu s THR 556 CO 0.12 0.49 0.16 0.00 -2.21 0.00 0.00 174.62 173.18 2fwu n GLY 558 N 4.35 1.05 2.95 0.00 0.00 -0.44 -4.99 105.19 108.11 2fwu n GLY 558 Ca -0.24 -0.56 -0.25 0.00 0.00 0.00 0.00 46.02 44.98 2fwu n GLY 558 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fwu s GLU 559 N 1.16 1.49 0.17 1.61 2.02 -1.26 -0.21 118.70 123.68 2fwu s GLU 559 Ca 0.00 -0.30 -0.16 0.00 0.02 0.00 0.00 54.97 54.54 2fwu s GLU 559 Cb 0.00 -1.39 -0.07 0.00 0.10 0.00 0.00 34.13 32.77 2fwu s GLU 559 CO 0.00 -0.11 0.60 -0.51 0.02 0.00 0.00 175.26 175.26 2fwu s LEU 560 N 1.14 4.33 -0.24 1.80 1.43 0.80 -4.87 118.68 123.07 2fwu s LEU 560 Ca -0.06 1.18 -0.08 0.00 -1.03 0.00 0.00 54.13 54.13 2fwu s LEU 560 Cb -0.14 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.67 2fwu s LEU 560 CO -0.02 0.08 0.10 -0.70 0.23 0.00 0.00 176.35 176.04 2fwu s GLU 561 N -1.98 3.80 0.07 1.70 2.12 -1.26 -0.71 118.70 122.44 2fwu s GLU 561 Ca 0.40 -0.41 0.09 0.00 0.36 0.00 0.00 54.97 55.41 2fwu s GLU 561 Cb -0.15 -3.39 -0.03 0.00 0.26 0.00 0.00 34.13 30.81 2fwu s GLU 561 CO 0.20 -0.09 -0.25 -0.06 -0.54 0.00 0.00 175.26 174.52 2fwu s PHE 562 N 1.38 2.18 0.13 5.30 0.08 -0.56 -4.89 117.98 121.59 2fwu s PHE 562 Ca 0.06 -0.40 -0.04 0.00 0.12 0.00 0.00 56.93 56.67 2fwu s PHE 562 Cb -0.15 -1.26 0.02 0.00 -0.57 0.00 0.00 43.02 41.06 2fwu s PHE 562 CO 0.05 0.19 0.25 0.00 -0.10 0.00 0.00 175.22 175.60 2fwu n GLN 563 N 1.48 0.35 -0.16 0.44 10.64 -1.24 -0.80 117.38 128.09 2fwu n GLN 563 Ca -0.17 -0.73 -0.06 0.00 -1.83 0.00 0.00 57.00 54.20 2fwu n GLN 563 Cb 0.53 0.89 0.03 0.00 -0.86 0.00 0.00 30.24 30.82 2fwu n GLN 563 CO 0.00 0.00 0.00 -0.97 -1.83 0.00 0.00 177.06 174.26 2fwu h ASN 564 N 0.63 0.49 0.09 2.61 -1.24 -1.66 -3.27 115.58 113.24 2fwu h ASN 564 Ca -0.11 -0.00 -0.36 0.00 0.71 0.00 0.00 56.30 56.54 2fwu h ASN 564 Cb 0.40 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.31 2fwu h ASN 564 CO 0.13 0.35 -2.01 0.47 -1.29 0.00 0.00 177.43 175.08 2fwu n ASP 565 N -4.80 2.08 -4.74 1.15 8.00 -1.26 -4.86 116.55 112.12 2fwu n ASP 565 Ca 0.03 0.18 -0.41 0.00 0.71 0.00 0.00 54.79 55.30 2fwu n ASP 565 Cb 0.06 -0.81 -0.03 0.00 -0.02 0.00 0.00 41.12 40.33 2fwu n ASP 565 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2fwu s GLU 566 N -2.53 4.32 0.12 -1.24 2.56 -1.23 -5.01 118.70 115.68 2fwu s GLU 566 Ca -0.25 2.21 0.00 0.00 0.00 0.00 0.00 54.97 56.93 2fwu s GLU 566 Cb 0.07 -3.14 0.00 0.00 2.00 0.00 0.00 34.13 33.07 2fwu s GLU 566 CO 0.72 -0.34 0.03 0.44 -0.56 0.00 0.00 175.26 175.54 2fwu n ILE 567 N 2.32 0.00 0.00 -3.70 -5.35 -1.26 -3.62 119.36 107.75 2fwu n ILE 567 Ca 0.06 -0.53 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 2fwu n ILE 567 Cb 0.41 -0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 2fwu n ILE 567 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34 2fwu n VAL 568 N -0.44 0.00 -4.35 7.28 3.14 -1.26 -4.95 118.33 117.74 2fwu n VAL 568 Ca -0.04 0.00 -0.27 0.00 -2.96 0.00 0.00 64.34 61.07 2fwu n VAL 568 Cb 0.15 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 32.82 2fwu n VAL 568 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2fwu s LYS 569 N 0.00 1.79 -0.13 1.45 -0.14 -1.25 -4.92 119.74 116.54 2fwu s LYS 569 Ca 0.00 -1.38 0.00 0.00 -1.36 0.00 0.00 55.97 53.24 2fwu s LYS 569 Cb 0.00 -2.01 0.02 0.00 -1.68 0.00 0.00 37.83 34.16 2fwu s LYS 569 CO 0.00 0.42 -0.12 0.95 -0.76 0.00 0.00 175.35 175.85 2fwu s THR 570 N -1.63 1.33 -0.24 2.17 -4.23 -1.25 -0.90 115.64 110.89 2fwu s THR 570 Ca 0.22 -0.49 -0.29 0.00 -1.18 0.00 0.00 61.69 59.95 2fwu s THR 570 Cb -0.09 -1.27 -0.00 0.00 1.34 0.00 0.00 72.50 72.48 2fwu s THR 570 CO 0.12 0.42 1.20 -0.63 -0.54 0.00 0.00 174.62 175.18 2fwu s ILE 571 N 1.47 4.36 -0.37 2.99 1.09 -1.08 -4.82 121.20 124.84 2fwu s ILE 571 Ca 0.03 1.61 -0.10 0.00 -1.10 0.00 0.00 60.65 61.09 2fwu s ILE 571 Cb -0.13 -4.17 0.04 0.00 -1.06 0.00 0.00 42.46 37.14 2fwu s ILE 571 CO -0.08 -0.29 0.19 -0.44 -0.10 0.00 0.00 174.94 174.22 2fwu s SER 572 N 1.97 5.63 -0.09 3.58 0.01 -1.26 -2.56 113.70 120.98 2fwu s SER 572 Ca 0.51 -1.10 0.02 0.00 1.31 0.00 0.00 55.95 56.69 2fwu s SER 572 Cb -0.17 -1.98 -0.02 0.00 0.21 0.00 0.00 66.02 64.05 2fwu s SER 572 CO 0.15 -0.39 -0.14 -0.69 0.41 0.00 0.00 173.24 172.58 2fwu s VAL 573 N 1.50 3.07 -0.20 3.43 1.01 -0.53 -4.92 120.40 123.77 2fwu s VAL 573 Ca 0.01 -0.69 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 2fwu s VAL 573 Cb -0.20 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 2fwu s VAL 573 CO 0.05 0.56 0.57 -0.75 0.00 0.00 0.00 175.10 175.54 2fwu s LYS 574 N -0.23 4.21 -0.30 2.72 2.47 -1.26 -1.15 119.74 126.20 2fwu s LYS 574 Ca 0.01 0.52 -0.17 0.00 -1.56 0.00 0.00 55.97 54.77 2fwu s LYS 574 Cb -0.13 -3.57 -0.02 0.00 -1.46 0.00 0.00 37.83 32.65 2fwu s LYS 574 CO 0.03 -0.19 0.45 0.08 0.16 0.00 0.00 175.35 175.88 2fwu s VAL 575 N 1.74 5.10 0.53 4.02 1.01 -0.53 -1.40 120.40 130.87 2fwu s VAL 575 Ca 0.26 0.48 -0.16 0.00 0.00 0.00 0.00 61.98 62.56 2fwu s VAL 575 Cb -0.16 -3.83 -0.07 0.00 0.00 0.00 0.00 36.38 32.33 2fwu s VAL 575 CO 0.10 -0.02 1.00 -0.63 0.00 0.00 0.00 175.10 175.56 2fwu s ILE 576 N 2.22 4.41 -1.02 2.22 -1.09 -1.21 -4.73 121.20 121.99 2fwu s ILE 576 Ca 0.17 1.14 -0.23 0.00 -2.23 0.00 0.00 60.65 59.50 2fwu s ILE 576 Cb -0.16 -3.66 -0.03 0.00 -1.58 0.00 0.00 42.46 37.03 2fwu s ILE 576 CO 0.11 -0.67 1.84 -1.81 -1.23 0.00 0.00 174.94 173.18 2fwu s ASP 577 N -3.05 5.49 0.02 3.58 1.01 -1.26 -4.79 116.67 117.66 2fwu s ASP 577 Ca 0.60 -1.20 -0.39 0.00 0.71 0.00 0.00 52.55 52.27 2fwu s ASP 577 Cb -0.11 -2.57 -0.20 0.00 1.01 0.00 0.00 42.92 41.05 2fwu s ASP 577 CO 0.33 -2.49 1.06 -0.67 0.21 0.00 0.00 175.17 173.61 2fwu n ASP 578 N 12.75 0.04 0.16 0.27 2.03 -1.26 -4.91 116.55 125.63 2fwu n ASP 578 Ca 0.41 1.16 0.03 0.00 0.52 0.00 0.00 54.79 56.90 2fwu n ASP 578 Cb 0.47 -0.94 0.22 0.00 -0.72 0.00 0.00 41.12 40.15 2fwu n ASP 578 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2fwu h GLU 579 N 3.00 0.00 -5.11 -0.67 9.09 -1.91 -3.46 114.58 115.51 2fwu h GLU 579 Ca -0.49 0.00 -0.63 0.00 0.05 0.00 0.00 59.36 58.28 2fwu h GLU 579 Cb 1.42 0.00 -0.13 0.00 -1.65 0.00 0.00 28.75 28.39 2fwu h GLU 579 CO 0.65 0.48 -0.51 -1.83 0.05 0.00 0.00 179.01 177.86 2fwu s GLU 580 N -3.42 2.09 0.35 1.06 1.03 -1.26 -5.12 118.70 113.43 2fwu s GLU 580 Ca 0.01 -2.32 -0.13 0.00 0.03 0.00 0.00 54.97 52.55 2fwu s GLU 580 Cb 0.11 -1.10 -0.08 0.00 -0.80 0.00 0.00 34.13 32.25 2fwu s GLU 580 CO 0.72 -0.43 0.74 1.52 -1.33 0.00 0.00 175.26 176.48 2fwu s TYR 581 N -3.02 3.40 0.30 4.83 1.13 -1.26 -5.08 117.35 117.64 2fwu s TYR 581 Ca 0.13 1.16 0.02 0.00 -1.41 0.00 0.00 57.07 56.97 2fwu s TYR 581 Cb 0.02 -2.50 -0.05 0.00 -1.10 0.00 0.00 41.96 38.33 2fwu s TYR 581 CO 0.08 0.04 0.11 -1.83 -2.51 0.00 0.00 175.55 171.44 2fwu s GLU 582 N -3.24 1.55 -0.20 -3.49 -1.05 -1.26 -5.03 118.70 105.98 2fwu s GLU 582 Ca 0.53 -1.87 -0.19 0.00 -0.15 0.00 0.00 54.97 53.29 2fwu s GLU 582 Cb -0.10 -0.34 -0.19 0.00 -0.44 0.00 0.00 34.13 33.05 2fwu s GLU 582 CO 0.22 -0.34 0.19 1.63 0.95 0.00 0.00 175.26 177.90 2fwu n LYS 583 N -0.58 0.59 0.00 -4.83 5.02 -1.26 -4.93 118.16 112.17 2fwu n LYS 583 Ca -0.01 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.80 2fwu n LYS 583 Cb 0.66 -1.73 0.00 0.00 -0.02 0.00 0.00 35.03 33.94 2fwu n LYS 583 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2fwu n ASN 584 N -4.31 0.00 -4.93 4.39 5.03 -1.26 -4.85 115.26 109.33 2fwu n ASN 584 Ca -0.34 0.00 -0.25 0.00 0.87 0.00 0.00 54.58 54.86 2fwu n ASN 584 Cb 0.74 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 39.50 2fwu n ASN 584 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 2fwu s LYS 585 N 0.00 3.29 -0.11 3.52 0.00 -1.25 -4.91 119.74 120.28 2fwu s LYS 585 Ca 0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 55.97 55.71 2fwu s LYS 585 Cb 0.00 -2.45 0.04 0.00 0.00 0.00 0.00 37.83 35.41 2fwu s LYS 585 CO 0.00 -0.25 0.40 -0.08 0.00 0.00 0.00 175.35 175.42 2fwu s THR 586 N -2.67 0.01 0.06 3.79 -1.32 -1.26 -1.42 115.64 112.85 2fwu s THR 586 Ca 0.47 -0.12 0.07 0.00 -1.21 0.00 0.00 61.69 60.91 2fwu s THR 586 Cb -0.10 -0.60 -0.03 0.00 -1.51 0.00 0.00 72.50 70.26 2fwu s THR 586 CO 0.42 -0.06 -0.19 0.72 -2.21 0.00 0.00 174.62 173.29 2fwu s PHE 587 N -0.24 1.67 -0.13 9.09 -0.12 -1.03 -3.60 117.98 123.62 2fwu s PHE 587 Ca -0.04 -0.39 -0.04 0.00 -0.05 0.00 0.00 56.93 56.41 2fwu s PHE 587 Cb -0.03 -0.96 -0.03 0.00 -0.63 0.00 0.00 43.02 41.36 2fwu s PHE 587 CO 0.02 0.12 0.02 -0.06 -0.05 0.00 0.00 175.22 175.27 2fwu s PHE 588 N -0.96 3.19 -0.22 3.49 0.08 -0.14 -1.63 117.98 121.80 2fwu s PHE 588 Ca 0.05 0.10 -0.08 0.00 0.12 0.00 0.00 56.93 57.13 2fwu s PHE 588 Cb -0.09 -1.91 -0.04 0.00 -0.57 0.00 0.00 43.02 40.41 2fwu s PHE 588 CO 0.03 0.31 0.08 -1.17 -0.10 0.00 0.00 175.22 174.37 2fwu s LEU 589 N -0.34 3.69 -0.03 -0.37 1.98 0.81 0.48 118.68 124.90 2fwu s LEU 589 Ca 0.07 -0.04 0.03 0.00 -2.89 0.00 0.00 54.13 51.30 2fwu s LEU 589 Cb -0.12 -1.96 0.00 0.00 0.66 0.00 0.00 46.19 44.77 2fwu s LEU 589 CO 0.02 0.07 -0.10 -0.70 -1.89 0.00 0.00 176.35 173.75 2fwu s GLU 590 N 1.01 1.07 -0.15 1.98 2.12 -0.90 -0.43 118.70 123.40 2fwu s GLU 590 Ca 0.04 -0.35 -0.09 0.00 0.36 0.00 0.00 54.97 54.94 2fwu s GLU 590 Cb -0.14 -0.99 -0.05 0.00 0.26 0.00 0.00 34.13 33.22 2fwu s GLU 590 CO 0.03 0.13 0.16 0.96 -0.54 0.00 0.00 175.26 176.00 2fwu s ILE 591 N 0.17 5.43 0.00 -3.70 -4.36 -1.26 -1.79 121.20 115.69 2fwu s ILE 591 Ca -0.03 0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.62 2fwu s ILE 591 Cb -0.09 -3.47 0.00 0.00 1.25 0.00 0.00 42.46 40.16 2fwu s ILE 591 CO 0.01 0.52 0.00 0.61 0.24 0.00 0.00 174.94 176.32 2fwu n GLY 592 N 2.78 1.38 3.65 6.27 0.00 0.95 -4.95 105.19 115.26 2fwu n GLY 592 Ca -0.17 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 2fwu n GLY 592 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fwu s GLU 593 N 2.05 4.08 0.38 1.61 2.12 -1.26 -4.78 118.70 122.90 2fwu s GLU 593 Ca 0.00 2.05 -0.26 0.00 0.36 0.00 0.00 54.97 57.12 2fwu s GLU 593 Cb 0.00 -3.99 -0.09 0.00 0.26 0.00 0.00 34.13 30.31 2fwu s GLU 593 CO 0.00 -0.96 1.18 -1.25 -0.54 0.00 0.00 175.26 173.69 2fwu s PRO 594 N 4.19 4.15 -0.16 4.30 0.04 -1.26 -4.46 135.00 141.81 2fwu s PRO 594 Ca 0.73 1.87 0.02 0.00 0.04 0.00 0.00 61.00 63.66 2fwu s PRO 594 Cb -0.31 -2.77 0.02 0.00 0.04 0.00 0.00 34.50 31.48 2fwu s PRO 594 CO 0.29 -0.25 -0.20 -0.98 0.04 0.00 0.00 177.00 175.90 2fwu s ARG 595 N -2.16 2.88 -0.16 4.56 1.70 0.32 -4.59 118.95 121.51 2fwu s ARG 595 Ca 0.55 -0.80 -0.29 0.00 -0.47 0.00 0.00 55.73 54.72 2fwu s ARG 595 Cb -0.32 -2.42 -0.00 0.00 -0.57 0.00 0.00 34.95 31.64 2fwu s ARG 595 CO 0.40 -0.12 1.06 -1.17 -1.08 0.00 0.00 175.30 174.39 2fwu s LEU 596 N 1.09 4.18 -0.18 -1.89 1.98 -1.26 -0.74 118.68 121.86 2fwu s LEU 596 Ca -0.01 1.50 -0.08 0.00 -2.89 0.00 0.00 54.13 52.65 2fwu s LEU 596 Cb -0.14 -3.55 -0.22 0.00 0.66 0.00 0.00 46.19 42.95 2fwu s LEU 596 CO -0.07 -0.59 0.14 0.52 -1.89 0.00 0.00 176.35 174.46 2fwu n VAL 597 N 4.98 1.65 -3.52 1.68 0.31 0.59 -4.99 118.33 119.03 2fwu n VAL 597 Ca 0.11 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.83 2fwu n VAL 597 Cb 0.47 -1.73 -0.03 0.00 -0.91 0.00 0.00 33.84 31.63 2fwu n VAL 597 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2fwu s GLU 598 N -2.51 0.81 0.00 5.55 -1.05 -1.22 -5.00 118.70 115.28 2fwu s GLU 598 Ca -0.28 -0.12 0.00 0.00 -0.15 0.00 0.00 54.97 54.42 2fwu s GLU 598 Cb 0.08 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.14 2fwu s GLU 598 CO 0.67 -0.32 0.00 0.00 0.95 0.00 0.00 175.26 176.57 2fwu n MET 599 N 0.16 0.00 -3.37 -4.83 0.00 -1.26 -1.10 117.12 106.73 2fwu n MET 599 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 57.70 57.34 2fwu n MET 599 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.73 2fwu n MET 599 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2fwu s SER 600 N -0.78 1.66 0.19 3.17 0.01 -1.26 -4.83 113.70 111.87 2fwu s SER 600 Ca 0.00 -2.52 -0.10 0.00 1.31 0.00 0.00 55.95 54.64 2fwu s SER 600 Cb 0.00 -0.14 -0.07 0.00 0.21 0.00 0.00 66.02 66.02 2fwu s SER 600 CO 0.00 -0.22 0.52 -1.61 0.41 0.00 0.00 173.24 172.34 2fwu s GLU 601 N 0.60 3.82 0.00 12.44 8.01 -1.26 -3.64 118.70 138.67 2fwu s GLU 601 Ca 0.26 0.28 0.00 0.00 0.01 0.00 0.00 54.97 55.52 2fwu s GLU 601 Cb -0.07 -2.77 0.00 0.00 -4.31 0.00 0.00 34.13 26.98 2fwu s GLU 601 CO -0.10 0.39 0.00 1.63 0.01 0.00 0.00 175.26 177.19 2fwu n LYS 602 N 0.22 0.00 -1.05 1.61 5.02 -1.26 -4.61 118.16 118.08 2fwu n LYS 602 Ca -0.02 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.30 2fwu n LYS 602 Cb 0.52 -1.44 0.03 0.00 -0.02 0.00 0.00 35.03 34.12 2fwu n LYS 602 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2fwu n LYS 603 N -1.99 0.15 0.00 1.97 0.00 -1.26 -4.75 118.16 112.28 2fwu n LYS 603 Ca 0.00 -1.77 0.12 0.00 -0.00 0.00 0.00 58.31 56.66 2fwu n LYS 603 Cb 0.00 -0.33 0.18 0.00 -0.00 0.00 0.00 35.03 34.87 2fwu n LYS 603 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2fwu n GLY 604 N 0.15 0.30 0.00 2.58 0.00 -1.24 -5.06 105.19 101.92 2fwu n GLY 604 Ca 0.05 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2fwu n GLY 604 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fwu n GLY 605 N 1.34 0.03 0.18 -0.02 0.00 -1.26 -4.55 105.19 100.91 2fwu n GLY 605 Ca 0.13 -1.94 0.13 0.00 0.00 0.00 0.00 46.02 44.34 2fwu n GLY 605 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2fwu n PHE 606 N -0.09 0.00 -2.53 1.61 1.16 -1.26 -4.80 117.46 111.54 2fwu n PHE 606 Ca 0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.16 2fwu n PHE 606 Cb 0.00 -0.16 -0.03 0.00 -1.61 0.00 0.00 39.48 37.68 2fwu n PHE 606 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 2fwu s THR 607 N -2.62 4.38 0.55 1.97 -4.23 -1.26 -5.01 115.64 109.42 2fwu s THR 607 Ca 0.21 1.70 -0.18 0.00 -1.18 0.00 0.00 61.69 62.25 2fwu s THR 607 Cb 0.19 -4.09 -0.05 0.00 1.34 0.00 0.00 72.50 69.88 2fwu s THR 607 CO 0.56 0.11 1.07 -0.63 -0.54 0.00 0.00 174.62 175.19 2fwu s ILE 608 N 1.26 3.62 0.11 2.99 -1.09 -1.26 -4.93 121.20 121.90 2fwu s ILE 608 Ca 0.56 0.90 -0.32 0.00 -2.23 0.00 0.00 60.65 59.56 2fwu s ILE 608 Cb -0.25 -3.36 -0.11 0.00 -1.58 0.00 0.00 42.46 37.16 2fwu s ILE 608 CO 0.27 -0.33 1.83 0.41 -1.23 0.00 0.00 174.94 175.90 2fwu n THR 609 N -1.54 0.38 0.23 2.92 -1.04 -1.26 -4.83 114.28 109.15 2fwu n THR 609 Ca 0.10 -0.07 0.03 0.00 -2.04 0.00 0.00 64.05 62.07 2fwu n THR 609 Cb 0.52 -2.09 0.13 0.00 -1.82 0.00 0.00 70.33 67.08 2fwu n THR 609 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2fwu n GLU 610 N 5.67 0.05 -2.61 -2.82 0.28 -1.26 -4.32 120.64 115.62 2fwu n GLU 610 Ca 0.18 0.29 -0.43 0.00 -0.16 0.00 0.00 57.16 57.05 2fwu n GLU 610 Cb 0.36 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.71 2fwu n GLU 610 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2fwu s GLU 611 N -2.72 3.73 -0.75 3.44 8.01 -1.26 -4.94 118.70 124.21 2fwu s GLU 611 Ca 0.04 0.56 0.03 0.00 0.01 0.00 0.00 54.97 55.62 2fwu s GLU 611 Cb 0.04 -3.90 0.27 0.00 -4.31 0.00 0.00 34.13 26.22 2fwu s GLU 611 CO 0.09 -1.36 0.95 0.66 0.01 0.00 0.00 175.26 175.61 2fwu n TYR 612 N 7.77 3.31 -3.17 1.61 4.01 -1.26 -4.77 117.16 124.65 2fwu n TYR 612 Ca 0.12 -3.74 -0.07 0.00 -0.16 0.00 0.00 57.90 54.04 2fwu n TYR 612 Cb 0.49 -0.74 0.00 0.00 -0.31 0.00 0.00 39.34 38.79 2fwu n TYR 612 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2fwu n ASP 613 N 0.92 -7.22 -4.68 7.72 2.03 -1.26 -4.98 116.55 109.08 2fwu n ASP 613 Ca 0.29 -0.13 -0.34 0.00 0.52 0.00 0.00 54.79 55.14 2fwu n ASP 613 Cb 0.39 -4.54 -0.09 0.00 -0.72 0.00 0.00 41.12 36.16 2fwu n ASP 613 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2fwu s ASP 614 N -2.86 5.20 -0.43 1.67 1.01 -1.26 -5.03 116.67 114.97 2fwu s ASP 614 Ca 0.06 0.09 0.03 0.00 0.71 0.00 0.00 52.55 53.44 2fwu s ASP 614 Cb -0.01 -1.43 0.16 0.00 1.01 0.00 0.00 42.92 42.65 2fwu s ASP 614 CO 0.78 0.34 0.32 -1.59 0.21 0.00 0.00 175.17 175.24 2fwu s LYS 615 N -1.14 0.99 0.45 8.23 0.00 -1.26 -4.98 119.74 122.04 2fwu s LYS 615 Ca 0.16 -2.06 0.05 0.00 0.00 0.00 0.00 55.97 54.11 2fwu s LYS 615 Cb -0.11 -1.62 -0.04 0.00 0.00 0.00 0.00 37.83 36.05 2fwu s LYS 615 CO 0.05 -1.33 0.08 -0.65 0.00 0.00 0.00 175.35 173.50 2fwu s GLN 616 N 0.13 2.11 1.01 1.78 -1.52 -1.26 -5.11 119.66 116.81 2fwu s GLN 616 Ca 0.29 -2.13 -0.13 0.00 -1.95 0.00 0.00 55.36 51.43 2fwu s GLN 616 Cb -0.03 -1.72 0.19 0.00 -0.22 0.00 0.00 33.01 31.23 2fwu s GLN 616 CO -0.15 -0.21 1.11 -1.25 -0.25 0.00 0.00 175.29 174.55 2fwu s PRO 617 N -3.85 0.34 0.12 2.91 0.04 -1.26 -4.39 135.00 128.91 2fwu s PRO 617 Ca 0.27 0.34 -0.31 0.00 0.04 0.00 0.00 61.00 61.34 2fwu s PRO 617 Cb 0.05 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.76 2fwu s PRO 617 CO 0.15 -2.75 1.48 -0.51 0.04 0.00 0.00 177.00 175.41 2fwu s LEU 618 N -6.42 4.37 0.42 -3.56 2.01 -1.26 -4.87 118.68 109.36 2fwu s LEU 618 Ca 0.66 2.43 0.29 0.00 0.01 0.00 0.00 54.13 57.52 2fwu s LEU 618 Cb -0.16 -3.58 1.39 0.00 0.01 0.00 0.00 46.19 43.85 2fwu s LEU 618 CO 0.56 -0.75 1.88 0.00 1.01 0.00 0.00 176.35 179.06 2fwu h THR 619 N 4.29 0.00 -0.53 5.49 1.03 -1.93 -3.38 112.91 117.88 2fwu h THR 619 Ca -0.42 -0.19 -0.63 0.00 -0.01 0.00 0.00 66.41 65.16 2fwu h THR 619 Cb 1.20 0.96 -0.05 0.00 -1.07 0.00 0.00 68.15 69.19 2fwu h THR 619 CO 0.89 0.00 2.25 -1.54 -0.01 0.00 0.00 175.52 177.11 2fwu n SER 620 N -2.59 4.20 -0.03 0.00 3.41 -1.26 -4.67 113.62 112.68 2fwu n SER 620 Ca -0.00 -2.85 0.00 0.00 -0.26 0.00 0.00 58.87 55.76 2fwu n SER 620 Cb 0.16 -1.68 0.00 0.00 -0.26 0.00 0.00 64.21 62.44 2fwu n SER 620 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2fwu n LYS 621 N 7.73 2.13 -0.05 4.33 4.76 -1.26 -5.05 118.16 130.75 2fwu n LYS 621 Ca 0.49 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 56.00 2fwu n LYS 621 Cb 0.44 0.00 0.44 0.00 -1.84 0.00 0.00 35.03 34.07 2fwu n LYS 621 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2fwu h GLU 622 N 0.00 0.52 -6.33 1.97 5.08 -1.97 -3.40 114.58 110.44 2fwu h GLU 622 Ca 0.00 -0.03 -0.57 0.00 -1.00 0.00 0.00 59.36 57.76 2fwu h GLU 622 Cb 0.00 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2fwu h GLU 622 CO 0.00 0.34 1.13 -1.21 -1.00 0.00 0.00 179.01 178.28 2fwu s GLU 623 N -5.48 3.66 0.04 2.33 2.02 -1.26 -4.86 118.70 115.14 2fwu s GLU 623 Ca -0.08 1.43 0.10 0.00 0.02 0.00 0.00 54.97 56.44 2fwu s GLU 623 Cb 0.18 -4.05 0.45 0.00 0.10 0.00 0.00 34.13 30.81 2fwu s GLU 623 CO 0.74 -1.46 1.32 -0.85 0.02 0.00 0.00 175.26 175.04 2fwu n GLU 624 N 7.88 0.02 0.28 1.61 0.00 -1.26 -1.71 120.64 127.46 2fwu n GLU 624 Ca 0.19 0.38 0.19 0.00 0.00 0.00 0.00 57.16 57.91 2fwu n GLU 624 Cb 0.46 -1.56 0.97 0.00 0.00 0.00 0.00 31.44 31.31 2fwu n GLU 624 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2fwu h GLU 625 N 0.00 0.00 -0.82 3.44 4.81 -1.93 -2.08 114.58 118.00 2fwu h GLU 625 Ca 0.00 0.00 0.23 0.00 -0.13 0.00 0.00 59.36 59.46 2fwu h GLU 625 Cb 0.15 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 2fwu h GLU 625 CO 0.00 0.00 0.58 0.07 -0.73 0.00 0.00 179.01 178.93 2fwu h ARG 626 N 0.00 0.08 -0.58 1.92 0.11 -1.60 0.13 114.38 114.43 2fwu h ARG 626 Ca 0.00 -0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.11 2fwu h ARG 626 Cb 0.06 -0.02 -0.03 0.00 1.11 0.00 0.00 29.97 31.09 2fwu h ARG 626 CO 0.00 0.05 0.38 0.00 0.10 0.00 0.00 179.97 180.50 2fwu h ARG 627 N 0.08 0.66 0.03 0.08 3.08 -1.64 0.78 114.38 117.44 2fwu h ARG 627 Ca 0.40 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 60.21 2fwu h ARG 627 Cb 1.46 -0.15 0.02 0.00 0.08 0.00 0.00 29.97 31.38 2fwu h ARG 627 CO -0.04 0.43 -0.77 0.82 -1.07 0.00 0.00 179.97 179.34 2fwu h ILE 628 N 0.68 1.40 -0.42 2.04 2.04 -0.99 -3.20 117.51 119.06 2fwu h ILE 628 Ca 0.23 -2.20 0.01 0.00 1.00 0.00 0.00 64.86 63.90 2fwu h ILE 628 Cb 0.09 2.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 2fwu h ILE 628 CO -0.06 0.65 0.26 0.00 0.00 0.00 0.00 178.15 179.00 2fwu h ALA 629 N 0.30 0.53 0.00 1.87 0.00 -0.55 -2.10 119.26 119.31 2fwu h ALA 629 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2fwu h ALA 629 Cb 1.48 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2fwu h ALA 629 CO 0.15 -0.05 0.00 0.39 0.00 0.00 0.00 179.25 179.74 2fwu n GLU 630 N -4.82 0.03 0.07 0.00 1.02 0.26 -0.03 120.64 117.17 2fwu n GLU 630 Ca 0.01 0.24 -0.03 0.00 -0.02 0.00 0.00 57.16 57.36 2fwu n GLU 630 Cb 0.04 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 29.89 2fwu n GLU 630 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 2fwu h MET 631 N 0.00 0.00 0.00 3.49 4.05 -1.36 -3.17 114.93 117.94 2fwu h MET 631 Ca 0.00 0.00 -0.40 0.00 -0.28 0.00 0.00 59.70 59.02 2fwu h MET 631 Cb 0.23 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 30.97 2fwu h MET 631 CO 0.00 0.65 -2.38 0.41 0.23 0.00 0.00 176.91 175.82 2fwu n GLY 632 N 1.34 -0.37 3.87 1.39 0.00 -0.75 -2.26 105.19 108.41 2fwu n GLY 632 Ca -0.03 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2fwu n GLY 632 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fwu s ARG 633 N -2.47 3.80 0.59 1.61 0.52 0.96 -4.89 118.95 119.07 2fwu s ARG 633 Ca -0.34 0.42 -0.03 0.00 -0.52 0.00 0.00 55.73 55.26 2fwu s ARG 633 Cb 0.11 -2.46 0.03 0.00 0.52 0.00 0.00 34.95 33.16 2fwu s ARG 633 CO 0.49 0.06 0.86 -1.25 0.02 0.00 0.00 175.30 175.48 2fwu s PRO 634 N -3.58 2.58 0.33 3.54 0.04 -1.26 -4.31 135.00 132.35 2fwu s PRO 634 Ca 0.50 -0.43 0.02 0.00 0.04 0.00 0.00 61.00 61.13 2fwu s PRO 634 Cb -0.10 -2.36 -0.01 0.00 0.04 0.00 0.00 34.50 32.06 2fwu s PRO 634 CO 0.28 -0.81 0.37 0.96 0.04 0.00 0.00 177.00 177.84 2fwu s ILE 635 N -2.92 0.00 0.35 0.56 -5.25 0.23 -4.70 121.20 109.47 2fwu s ILE 635 Ca 0.56 -1.80 -0.20 0.00 -0.99 0.00 0.00 60.65 58.23 2fwu s ILE 635 Cb -0.10 -2.57 -0.10 0.00 2.95 0.00 0.00 42.46 42.64 2fwu s ILE 635 CO 0.41 0.00 0.85 -1.48 -1.79 0.00 0.00 174.94 172.93 2fwu s LEU 636 N -3.30 4.11 0.00 0.37 -0.00 -1.26 -2.64 118.68 115.96 2fwu s LEU 636 Ca 0.36 1.55 0.00 0.00 -0.00 0.00 0.00 54.13 56.03 2fwu s LEU 636 Cb 0.01 -4.16 0.00 0.00 -0.00 0.00 0.00 46.19 42.04 2fwu s LEU 636 CO 0.23 -0.20 0.00 0.61 -0.00 0.00 0.00 176.35 176.99 2fwu n GLY 637 N -0.13 0.68 0.18 -3.48 0.00 0.67 -4.70 105.19 98.41 2fwu n GLY 637 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 2fwu n GLY 637 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fwu h GLU 638 N 0.00 -0.35 -2.49 1.61 4.57 -1.91 -3.44 114.58 112.56 2fwu h GLU 638 Ca 0.00 0.02 -0.31 0.00 -1.18 0.00 0.00 59.36 57.89 2fwu h GLU 638 Cb 0.00 0.08 -0.36 0.00 -0.16 0.00 0.00 28.75 28.31 2fwu h GLU 638 CO 0.00 -0.03 -0.62 -3.38 -1.18 0.00 0.00 179.01 173.80 2fwu s HIS 639 N -3.47 -0.29 -0.80 0.92 -3.43 -1.26 -5.06 115.29 101.90 2fwu s HIS 639 Ca -0.11 0.22 -0.13 0.00 -0.80 0.00 0.00 55.06 54.24 2fwu s HIS 639 Cb 0.01 -0.36 0.21 0.00 -1.43 0.00 0.00 32.58 31.01 2fwu s HIS 639 CO 0.38 -0.62 0.73 0.95 -2.00 0.00 0.00 174.74 174.18 2fwu s THR 640 N 2.33 5.40 -0.30 -5.38 -4.23 -1.26 -2.84 115.64 109.37 2fwu s THR 640 Ca 0.07 -2.51 -0.17 0.00 -1.18 0.00 0.00 61.69 57.90 2fwu s THR 640 Cb -0.16 -4.35 0.20 0.00 1.34 0.00 0.00 72.50 69.53 2fwu s THR 640 CO -0.13 -1.01 1.26 -0.75 -0.54 0.00 0.00 174.62 173.45 2fwu s LYS 641 N 0.16 0.05 -0.23 3.99 2.36 -1.26 -4.73 119.74 120.08 2fwu s LYS 641 Ca 0.18 0.11 0.01 0.00 -2.55 0.00 0.00 55.97 53.72 2fwu s LYS 641 Cb -0.12 0.04 0.06 0.00 -1.05 0.00 0.00 37.83 36.76 2fwu s LYS 641 CO -0.08 -0.01 -0.07 -1.17 1.55 0.00 0.00 175.35 175.56 2fwu s LEU 642 N 1.49 2.60 -0.58 5.43 2.96 0.43 -4.38 118.68 126.64 2fwu s LEU 642 Ca -0.05 -1.14 -0.20 0.00 -0.22 0.00 0.00 54.13 52.53 2fwu s LEU 642 Cb -0.02 -1.23 0.09 0.00 0.50 0.00 0.00 46.19 45.53 2fwu s LEU 642 CO -0.13 -0.21 0.72 -0.70 -1.32 0.00 0.00 176.35 174.72 2fwu s GLU 643 N 1.36 3.08 -0.46 1.98 2.12 0.17 -0.13 118.70 126.81 2fwu s GLU 643 Ca -0.05 -1.14 -0.20 0.00 0.36 0.00 0.00 54.97 53.94 2fwu s GLU 643 Cb -0.18 -4.22 0.03 0.00 0.26 0.00 0.00 34.13 30.02 2fwu s GLU 643 CO -0.06 -1.50 0.62 0.08 -0.54 0.00 0.00 175.26 173.85 2fwu s VAL 644 N 2.87 4.86 -0.24 3.70 1.01 -0.65 -1.18 120.40 130.77 2fwu s VAL 644 Ca 0.14 -0.13 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 2fwu s VAL 644 Cb -0.22 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 31.91 2fwu s VAL 644 CO 0.08 -0.65 0.43 -0.63 0.00 0.00 0.00 175.10 174.33 2fwu s ILE 645 N 2.71 5.15 -0.17 2.22 1.09 0.17 -2.48 121.20 129.89 2fwu s ILE 645 Ca 0.19 0.73 -0.09 0.00 -1.10 0.00 0.00 60.65 60.38 2fwu s ILE 645 Cb -0.16 -3.75 -0.05 0.00 -1.06 0.00 0.00 42.46 37.44 2fwu s ILE 645 CO 0.16 0.16 0.13 -0.63 -0.10 0.00 0.00 174.94 174.67 2fwu s ILE 646 N 1.89 5.42 0.05 2.92 1.09 -0.50 -1.36 121.20 130.71 2fwu s ILE 646 Ca 0.19 0.19 0.08 0.00 -1.10 0.00 0.00 60.65 60.01 2fwu s ILE 646 Cb -0.15 -3.43 -0.03 0.00 -1.06 0.00 0.00 42.46 37.79 2fwu s ILE 646 CO 0.09 0.51 -0.22 -1.61 -0.10 0.00 0.00 174.94 173.61 2fwu s GLU 647 N -0.21 1.91 0.34 2.79 2.02 -0.34 -3.76 118.70 121.45 2fwu s GLU 647 Ca 0.11 -1.06 -0.29 0.00 0.02 0.00 0.00 54.97 53.74 2fwu s GLU 647 Cb -0.11 -2.08 -0.11 0.00 0.10 0.00 0.00 34.13 31.92 2fwu s GLU 647 CO 0.00 0.52 1.55 -1.21 0.02 0.00 0.00 175.26 176.14 2fwu s GLU 648 N -1.41 4.11 0.03 1.61 0.41 -1.26 -1.07 118.70 121.12 2fwu s GLU 648 Ca 0.13 2.59 -0.30 0.00 -0.41 0.00 0.00 54.97 56.98 2fwu s GLU 648 Cb -0.10 -2.99 -0.08 0.00 -1.78 0.00 0.00 34.13 29.18 2fwu s GLU 648 CO 0.04 -0.59 1.69 0.45 -0.49 0.00 0.00 175.26 176.36 2fwu s SER 649 N 0.18 6.60 0.00 -0.19 0.15 -1.26 -4.68 113.70 114.51 2fwu s SER 649 Ca 0.58 2.44 0.00 0.00 0.70 0.00 0.00 55.95 59.68 2fwu s SER 649 Cb -0.47 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.28 2fwu s SER 649 CO 0.56 -0.92 0.00 0.00 1.20 0.00 0.00 173.24 174.08 2fwu n TYR 650 N 6.21 -0.43 -3.85 3.44 4.19 -1.26 -5.07 117.16 120.40 2fwu n TYR 650 Ca 0.17 0.00 0.02 0.00 3.31 0.00 0.00 57.90 61.40 2fwu n TYR 650 Cb 0.41 0.23 0.01 0.00 0.49 0.00 0.00 39.34 40.48 2fwu n TYR 650 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 2fwu s GLU 651 N -0.47 0.36 -0.39 2.98 0.41 -1.26 -5.12 118.70 115.22 2fwu s GLU 651 Ca 0.00 -0.22 -0.14 0.00 -0.41 0.00 0.00 54.97 54.20 2fwu s GLU 651 Cb 0.00 0.11 0.01 0.00 -1.78 0.00 0.00 34.13 32.46 2fwu s GLU 651 CO 0.00 -0.17 0.28 0.12 -0.49 0.00 0.00 175.26 175.00 2fwu s PHE 652 N -2.14 3.24 0.38 1.61 5.36 -1.26 -5.03 117.98 120.14 2fwu s PHE 652 Ca 0.24 -0.46 0.08 0.00 -0.96 0.00 0.00 56.93 55.83 2fwu s PHE 652 Cb 0.02 -2.55 -0.07 0.00 -0.34 0.00 0.00 43.02 40.08 2fwu s PHE 652 CO -0.02 -0.51 0.00 0.15 -1.46 0.00 0.00 175.22 173.38 2fwu s LYS 653 N 1.69 1.97 0.07 10.12 -0.14 -1.26 -5.05 119.74 127.15 2fwu s LYS 653 Ca 0.05 -1.98 0.00 0.00 -1.36 0.00 0.00 55.97 52.68 2fwu s LYS 653 Cb -0.18 -1.74 0.00 0.00 -1.68 0.00 0.00 37.83 34.23 2fwu s LYS 653 CO 0.10 0.02 0.00 0.45 -0.76 0.00 0.00 175.35 175.16 2fwu n SER 654 N -0.95 -0.56 -4.10 2.83 2.88 -1.26 -5.07 113.62 107.39 2fwu n SER 654 Ca -0.04 0.13 -0.35 0.00 -1.33 0.00 0.00 58.87 57.28 2fwu n SER 654 Cb 0.65 0.88 -0.13 0.00 -0.75 0.00 0.00 64.21 64.86 2fwu n SER 654 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2fwu s THR 655 N -1.15 2.96 -0.29 2.46 2.01 -1.26 -5.07 115.64 115.30 2fwu s THR 655 Ca 0.00 -2.02 -0.28 0.00 0.31 0.00 0.00 61.69 59.70 2fwu s THR 655 Cb 0.00 -3.01 0.01 0.00 0.01 0.00 0.00 72.50 69.51 2fwu s THR 655 CO 0.00 -0.57 1.02 -0.69 -0.69 0.00 0.00 174.62 173.70 2fwu s VAL 656 N 1.09 4.60 0.00 3.82 1.01 -1.26 -5.29 120.40 124.37 2fwu s VAL 656 Ca 0.07 1.74 0.00 0.00 0.00 0.00 0.00 61.98 63.78 2fwu s VAL 656 Cb -0.21 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.82 2fwu s VAL 656 CO -0.05 -0.37 0.19 -0.67 0.00 0.00 0.00 175.10 174.21