#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fwu n ALA 502 N 0.00 0.94 -3.54 1.59 0.00 -1.22 -4.77 120.51 113.50 2fwu n ALA 502 Ca 0.00 -0.43 -0.17 0.00 0.00 0.00 0.00 53.44 52.85 2fwu n ALA 502 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2fwu n ALA 502 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2fwu s GLY 503 N -0.12 -0.55 -0.32 0.00 0.00 -1.26 -4.39 107.32 100.68 2fwu s GLY 503 Ca 0.00 1.49 -0.02 0.00 0.00 0.00 0.00 44.72 46.19 2fwu s GLY 503 CO 0.00 1.11 0.16 -0.42 0.00 0.00 0.00 173.10 173.95 2fwu s ILE 504 N -0.89 0.17 -0.27 0.90 1.09 -1.18 -4.17 121.20 116.85 2fwu s ILE 504 Ca -0.08 -1.22 0.03 0.00 -1.10 0.00 0.00 60.65 58.27 2fwu s ILE 504 Cb -0.01 -1.15 0.07 0.00 -1.06 0.00 0.00 42.46 40.31 2fwu s ILE 504 CO 0.08 -0.82 -0.08 -0.36 -0.10 0.00 0.00 174.94 173.67 2fwu s PHE 505 N 1.63 3.22 0.07 3.97 0.08 -1.23 -1.91 117.98 123.81 2fwu s PHE 505 Ca 0.12 -2.36 -0.01 0.00 0.12 0.00 0.00 56.93 54.81 2fwu s PHE 505 Cb -0.19 -2.04 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 2fwu s PHE 505 CO -0.22 -0.88 -0.02 -0.08 -0.10 0.00 0.00 175.22 173.92 2fwu s THR 506 N 1.11 0.28 0.30 0.64 -1.32 -1.24 -0.04 115.64 115.38 2fwu s THR 506 Ca -0.05 -1.85 -0.16 0.00 -1.21 0.00 0.00 61.69 58.42 2fwu s THR 506 Cb -0.20 -1.63 -0.09 0.00 -1.51 0.00 0.00 72.50 69.08 2fwu s THR 506 CO -0.06 -0.90 0.74 -0.36 -2.21 0.00 0.00 174.62 171.83 2fwu s PHE 507 N -3.89 3.43 0.23 9.09 0.08 -1.06 -1.50 117.98 124.36 2fwu s PHE 507 Ca 0.10 1.26 0.07 0.00 0.12 0.00 0.00 56.93 58.48 2fwu s PHE 507 Cb 0.07 -2.56 0.22 0.00 -0.57 0.00 0.00 43.02 40.19 2fwu s PHE 507 CO -0.07 0.14 1.53 1.49 -0.10 0.00 0.00 175.22 178.21 2fwu h GLU 508 N 2.48 0.10 -3.80 0.44 4.22 -1.89 -3.44 114.58 112.68 2fwu h GLU 508 Ca -0.48 -0.08 -0.29 0.00 0.08 0.00 0.00 59.36 58.59 2fwu h GLU 508 Cb 1.18 0.02 -0.31 0.00 0.50 0.00 0.00 28.75 30.14 2fwu h GLU 508 CO 0.65 0.75 -0.73 -1.83 -2.18 0.00 0.00 179.01 175.67 2fwu s GLU 509 N -3.51 0.14 0.12 1.92 -1.05 -1.26 -5.03 118.70 110.04 2fwu s GLU 509 Ca -0.02 0.01 0.27 0.00 -0.15 0.00 0.00 54.97 55.08 2fwu s GLU 509 Cb 0.12 -0.23 0.83 0.00 -0.44 0.00 0.00 34.13 34.41 2fwu s GLU 509 CO 0.79 -0.04 1.72 -0.35 0.95 0.00 0.00 175.26 178.32 2fwu n PRO 510 N 3.49 0.17 -3.84 -4.83 -0.04 -1.26 -4.76 135.00 123.94 2fwu n PRO 510 Ca -0.18 0.12 -0.13 0.00 -0.04 0.00 0.00 63.50 63.26 2fwu n PRO 510 Cb 0.56 -1.67 -0.14 0.00 -0.04 0.00 0.00 33.50 32.20 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 -3.07 -0.01 -0.05 0.52 1.01 -1.26 0.49 120.40 118.01 2fwu s VAL 511 Ca 0.11 0.05 -0.04 0.00 0.00 0.00 0.00 61.98 62.10 2fwu s VAL 511 Cb 0.15 -0.06 0.02 0.00 0.00 0.00 0.00 36.38 36.49 2fwu s VAL 511 CO 0.61 0.02 0.14 0.28 0.00 0.00 0.00 175.10 176.14 2fwu s THR 512 N 0.27 -0.01 -0.19 3.92 -1.32 -0.01 -4.91 115.64 113.38 2fwu s THR 512 Ca -0.02 0.05 -0.06 0.00 -1.21 0.00 0.00 61.69 60.45 2fwu s THR 512 Cb -0.03 -0.21 -0.03 0.00 -1.51 0.00 0.00 72.50 70.72 2fwu s THR 512 CO -0.01 0.02 0.02 -1.00 -2.21 0.00 0.00 174.62 171.45 2fwu s HIS 513 N 0.40 3.10 0.22 9.09 3.76 -1.26 -0.03 115.29 130.57 2fwu s HIS 513 Ca -0.03 -0.26 0.07 0.00 -0.15 0.00 0.00 55.06 54.69 2fwu s HIS 513 Cb -0.04 -2.08 -0.05 0.00 1.11 0.00 0.00 32.58 31.52 2fwu s HIS 513 CO -0.02 -0.10 -0.11 0.14 -0.85 0.00 0.00 174.74 173.80 2fwu s VAL 514 N 0.79 1.64 0.55 -0.90 -7.23 0.03 -4.95 120.40 110.32 2fwu s VAL 514 Ca 0.01 -2.17 -0.07 0.00 -1.81 0.00 0.00 61.98 57.95 2fwu s VAL 514 Cb -0.14 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 2fwu s VAL 514 CO 0.02 -0.52 0.88 -0.55 -0.31 0.00 0.00 175.10 174.62 2fwu s SER 515 N -3.34 5.99 -0.00 4.85 0.15 -1.26 -2.37 113.70 117.72 2fwu s SER 515 Ca 0.24 0.94 0.21 0.00 0.70 0.00 0.00 55.95 58.04 2fwu s SER 515 Cb 0.01 -2.08 -0.20 0.00 -1.71 0.00 0.00 66.02 62.04 2fwu s SER 515 CO 0.08 -0.82 0.86 1.21 1.20 0.00 0.00 173.24 175.76 2fwu n GLU 516 N -2.48 0.12 -0.19 5.44 2.13 -0.97 -4.03 120.64 120.66 2fwu n GLU 516 Ca 0.03 -0.03 0.08 0.00 0.66 0.00 0.00 57.16 57.89 2fwu n GLU 516 Cb 0.56 -1.51 0.22 0.00 0.27 0.00 0.00 31.44 30.98 2fwu n GLU 516 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2fwu n SER 517 N -1.64 2.22 -4.91 4.31 7.64 -1.26 -4.85 113.62 115.13 2fwu n SER 517 Ca 0.03 -1.95 -0.28 0.00 1.01 0.00 0.00 58.87 57.68 2fwu n SER 517 Cb 0.37 -0.25 -0.02 0.00 -1.01 0.00 0.00 64.21 63.30 2fwu n SER 517 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2fwu s ILE 518 N -1.49 4.97 -0.15 0.44 2.07 -1.26 -5.04 121.20 120.74 2fwu s ILE 518 Ca 0.29 0.09 -0.12 0.00 -1.41 0.00 0.00 60.65 59.50 2fwu s ILE 518 Cb 0.15 -3.79 -0.08 0.00 0.13 0.00 0.00 42.46 38.87 2fwu s ILE 518 CO 0.21 -0.55 -0.02 1.23 -1.91 0.00 0.00 174.94 173.90 2fwu h GLY 519 N 1.03 0.00 -5.23 1.50 0.00 -1.89 -3.41 103.07 95.07 2fwu h GLY 519 Ca -0.48 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.32 2fwu h GLY 519 CO 0.64 0.00 -0.83 -0.42 0.00 0.00 0.00 176.54 175.93 2fwu s ILE 520 N -2.19 1.29 -0.12 2.60 -1.09 -1.26 -1.02 121.20 119.41 2fwu s ILE 520 Ca -0.17 -0.65 -0.01 0.00 -2.23 0.00 0.00 60.65 57.59 2fwu s ILE 520 Cb 0.03 -1.10 -0.02 0.00 -1.58 0.00 0.00 42.46 39.78 2fwu s ILE 520 CO 0.31 0.37 -0.08 0.00 -1.23 0.00 0.00 174.94 174.31 2fwu s MET 521 N -0.05 3.28 -0.12 2.79 0.23 -1.06 -4.94 119.30 119.42 2fwu s MET 521 Ca -0.01 -0.58 0.02 0.00 -1.03 0.00 0.00 55.69 54.09 2fwu s MET 521 Cb -0.10 -2.72 -0.00 0.00 -1.53 0.00 0.00 34.83 30.48 2fwu s MET 521 CO 0.01 0.37 -0.19 -1.21 -2.03 0.00 0.00 175.02 171.98 2fwu s GLU 522 N -0.03 3.19 -0.06 3.16 8.01 -1.25 -2.42 118.70 129.30 2fwu s GLU 522 Ca -0.01 -0.79 0.06 0.00 0.01 0.00 0.00 54.97 54.24 2fwu s GLU 522 Cb -0.14 -2.48 -0.01 0.00 -4.31 0.00 0.00 34.13 27.20 2fwu s GLU 522 CO 0.03 0.15 -0.25 0.08 0.01 0.00 0.00 175.26 175.28 2fwu s VAL 523 N 0.47 2.09 -0.02 2.63 1.01 -1.18 -4.89 120.40 120.50 2fwu s VAL 523 Ca -0.13 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 60.50 2fwu s VAL 523 Cb -0.17 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 2fwu s VAL 523 CO 0.05 0.57 0.97 -0.54 0.00 0.00 0.00 175.10 176.15 2fwu s LYS 524 N -0.12 4.54 -0.11 2.72 -0.14 -1.26 -2.13 119.74 123.24 2fwu s LYS 524 Ca -0.05 1.38 -0.00 0.00 -1.36 0.00 0.00 55.97 55.95 2fwu s LYS 524 Cb -0.14 -3.47 -0.02 0.00 -1.68 0.00 0.00 37.83 32.52 2fwu s LYS 524 CO 0.04 -0.08 -0.10 0.08 -0.76 0.00 0.00 175.35 174.53 2fwu s VAL 525 N 1.12 3.33 0.11 3.17 1.01 0.08 -2.89 120.40 126.33 2fwu s VAL 525 Ca 0.51 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.68 2fwu s VAL 525 Cb -0.20 -2.39 -0.07 0.00 0.00 0.00 0.00 36.38 33.71 2fwu s VAL 525 CO 0.26 0.54 0.67 -0.76 0.00 0.00 0.00 175.10 175.82 2fwu s LEU 526 N -0.04 4.55 0.45 3.92 2.01 -0.56 -2.09 118.68 126.91 2fwu s LEU 526 Ca -0.02 1.44 -0.07 0.00 0.01 0.00 0.00 54.13 55.49 2fwu s LEU 526 Cb -0.14 -3.09 -0.05 0.00 0.01 0.00 0.00 46.19 42.93 2fwu s LEU 526 CO 0.03 0.23 0.77 -0.60 1.01 0.00 0.00 176.35 177.80 2fwu s ARG 527 N -1.07 3.64 0.88 1.70 3.52 -1.26 -3.67 118.95 122.70 2fwu s ARG 527 Ca 0.32 0.30 -0.12 0.00 -0.13 0.00 0.00 55.73 56.11 2fwu s ARG 527 Cb -0.21 -2.39 0.10 0.00 -1.56 0.00 0.00 34.95 30.89 2fwu s ARG 527 CO 0.22 -0.13 1.02 -2.37 -0.81 0.00 0.00 175.30 173.23 2fwu n THR 528 N -1.84 0.70 1.16 4.11 5.66 -0.81 -4.69 114.28 118.58 2fwu n THR 528 Ca 0.01 -0.11 0.13 0.00 -3.05 0.00 0.00 64.05 61.03 2fwu n THR 528 Cb 0.55 -0.99 0.40 0.00 -1.55 0.00 0.00 70.33 68.74 2fwu n THR 528 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2fwu n SER 529 N -3.32 0.61 -3.79 1.09 2.88 -1.26 -4.65 113.62 105.18 2fwu n SER 529 Ca 0.12 -0.44 -0.28 0.00 -1.33 0.00 0.00 58.87 56.93 2fwu n SER 529 Cb 0.52 0.07 -0.16 0.00 -0.75 0.00 0.00 64.21 63.88 2fwu n SER 529 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2fwu s GLY 530 N -2.74 0.86 -0.37 0.46 0.00 -1.26 -5.06 107.32 99.22 2fwu s GLY 530 Ca 0.19 -0.86 0.05 0.00 0.00 0.00 0.00 44.72 44.11 2fwu s GLY 530 CO 0.58 1.28 0.52 0.00 0.00 0.00 0.00 173.10 175.47 2fwu s ALA 531 N 1.73 -1.64 -0.26 3.20 0.00 -1.26 -4.70 121.76 118.84 2fwu s ALA 531 Ca -0.02 -0.03 0.12 0.00 0.00 0.00 0.00 51.96 52.04 2fwu s ALA 531 Cb -0.17 -2.42 0.61 0.00 0.00 0.00 0.00 23.12 21.14 2fwu s ALA 531 CO -0.07 -2.08 1.58 2.89 0.00 0.00 0.00 175.76 178.08 2fwu n ARG 532 N 4.63 2.97 -1.54 0.00 -4.01 -1.26 -4.30 116.66 113.15 2fwu n ARG 532 Ca 0.09 -3.02 0.00 0.00 -1.04 0.00 0.00 57.85 53.88 2fwu n ARG 532 Cb 0.52 -1.98 0.00 0.00 -3.04 0.00 0.00 32.46 27.96 2fwu n ARG 532 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2fwu n GLY 533 N -0.53 0.68 3.74 2.89 0.00 -1.26 -4.81 105.19 105.90 2fwu n GLY 533 Ca 0.31 -0.79 -0.40 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.48 7.13 -0.10 1.61 3.04 -1.26 -1.15 114.94 123.74 2fwu s ASN 534 Ca 0.00 1.35 0.01 0.00 0.04 0.00 0.00 52.86 54.26 2fwu s ASN 534 Cb 0.00 -2.45 0.02 0.00 -1.54 0.00 0.00 41.25 37.28 2fwu s ASN 534 CO 0.00 -0.04 -0.11 -0.69 -3.04 0.00 0.00 177.10 173.22 2fwu s VAL 535 N 0.28 1.19 -0.20 -5.21 1.01 0.14 -0.04 120.40 117.57 2fwu s VAL 535 Ca 0.38 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 2fwu s VAL 535 Cb -0.19 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 2fwu s VAL 535 CO 0.21 0.38 0.23 -0.63 0.00 0.00 0.00 175.10 175.30 2fwu s ILE 536 N 1.17 5.33 -0.34 2.22 -1.09 0.13 -0.93 121.20 127.70 2fwu s ILE 536 Ca -0.04 0.39 0.01 0.00 -2.23 0.00 0.00 60.65 58.77 2fwu s ILE 536 Cb -0.14 -3.57 0.09 0.00 -1.58 0.00 0.00 42.46 37.25 2fwu s ILE 536 CO -0.03 0.36 0.05 -0.69 -1.23 0.00 0.00 174.94 173.41 2fwu s VAL 537 N 0.76 2.67 0.40 2.92 1.01 -0.48 -0.64 120.40 127.03 2fwu s VAL 537 Ca 0.12 -1.95 -0.25 0.00 0.00 0.00 0.00 61.98 59.90 2fwu s VAL 537 Cb -0.13 -2.78 -0.09 0.00 0.00 0.00 0.00 36.38 33.39 2fwu s VAL 537 CO 0.03 -0.43 1.13 -2.16 0.00 0.00 0.00 175.10 173.68 2fwu s PRO 538 N 1.07 4.10 0.19 2.72 0.04 -1.26 0.01 135.00 141.87 2fwu s PRO 538 Ca 0.04 1.74 -0.07 0.00 0.04 0.00 0.00 61.00 62.75 2fwu s PRO 538 Cb -0.20 -2.66 -0.02 0.00 0.04 0.00 0.00 34.50 31.66 2fwu s PRO 538 CO -0.05 -0.25 0.26 1.52 0.04 0.00 0.00 177.00 178.52 2fwu s TYR 539 N -1.47 0.62 0.10 0.56 -0.85 0.40 0.13 117.35 116.83 2fwu s TYR 539 Ca 0.57 -0.96 -0.24 0.00 -0.52 0.00 0.00 57.07 55.92 2fwu s TYR 539 Cb -0.28 -0.17 0.06 0.00 0.38 0.00 0.00 41.96 41.95 2fwu s TYR 539 CO 0.35 -0.73 0.59 -1.59 -1.52 0.00 0.00 175.55 172.65 2fwu s LYS 540 N -4.03 1.18 -0.37 -3.49 0.00 -0.71 -1.82 119.74 110.49 2fwu s LYS 540 Ca 0.24 -0.30 -0.19 0.00 0.00 0.00 0.00 55.97 55.72 2fwu s LYS 540 Cb 0.04 0.54 0.00 0.00 0.00 0.00 0.00 37.83 38.42 2fwu s LYS 540 CO 0.05 -0.47 0.55 0.95 0.00 0.00 0.00 175.35 176.42 2fwu s THR 541 N -3.03 4.97 -0.26 3.79 -4.23 -0.91 -2.04 115.64 113.93 2fwu s THR 541 Ca -0.02 0.28 -0.29 0.00 -1.18 0.00 0.00 61.69 60.48 2fwu s THR 541 Cb -0.01 -4.03 0.01 0.00 1.34 0.00 0.00 72.50 69.81 2fwu s THR 541 CO -0.06 -0.32 1.13 -0.63 -0.54 0.00 0.00 174.62 174.20 2fwu s ILE 542 N 2.50 4.46 0.25 2.99 1.09 0.10 -4.89 121.20 127.70 2fwu s ILE 542 Ca 0.20 1.73 -0.04 0.00 -1.10 0.00 0.00 60.65 61.43 2fwu s ILE 542 Cb -0.15 -4.26 0.21 0.00 -1.06 0.00 0.00 42.46 37.20 2fwu s ILE 542 CO 0.15 -0.32 1.78 -0.33 -0.10 0.00 0.00 174.94 176.11 2fwu h GLU 543 N 8.09 0.62 0.00 2.79 5.08 -1.86 -0.88 114.58 128.43 2fwu h GLU 543 Ca -0.22 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2fwu h GLU 543 Cb 1.07 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2fwu h GLU 543 CO 1.00 0.41 0.00 0.41 -1.00 0.00 0.00 179.01 179.84 2fwu n GLY 544 N -1.32 0.92 0.45 -3.84 0.00 -1.26 -0.83 105.19 99.31 2fwu n GLY 544 Ca 0.14 0.45 0.01 0.00 0.00 0.00 0.00 46.02 46.62 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 0.26 -4.53 2.61 5.66 -0.98 -5.05 114.28 112.25 2fwu n THR 545 Ca 0.00 -0.32 -0.26 0.00 -3.05 0.00 0.00 64.05 60.41 2fwu n THR 545 Cb 0.00 0.40 -0.10 0.00 -1.55 0.00 0.00 70.33 69.08 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 -0.40 3.06 -0.36 1.79 0.00 -0.01 -4.66 121.76 121.17 2fwu s ALA 546 Ca 0.05 -2.14 -0.17 0.00 0.00 0.00 0.00 51.96 49.70 2fwu s ALA 546 Cb 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 23.12 23.12 2fwu s ALA 546 CO 0.00 0.02 0.44 1.03 0.00 0.00 0.00 175.76 177.25 2fwu s ARG 547 N -3.66 3.49 -0.45 0.00 3.00 -1.26 -4.75 118.95 115.32 2fwu s ARG 547 Ca 0.34 -0.39 -0.19 0.00 0.00 0.00 0.00 55.73 55.49 2fwu s ARG 547 Cb 0.04 -3.84 0.03 0.00 0.00 0.00 0.00 34.95 31.18 2fwu s ARG 547 CO 0.17 -0.64 0.54 0.20 0.00 0.00 0.00 175.30 175.57 2fwu s GLY 548 N 1.76 1.82 0.00 -3.53 0.00 -1.26 -2.73 107.32 103.38 2fwu s GLY 548 Ca 0.14 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.37 2fwu s GLY 548 CO 0.13 1.34 0.00 0.61 0.00 0.00 0.00 173.10 175.18 2fwu n GLY 549 N 5.11 -0.28 0.00 0.20 0.00 -1.00 -4.69 105.19 104.53 2fwu n GLY 549 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 0.99 0.00 -0.02 0.00 -0.12 -4.86 105.19 101.18 2fwu n GLY 550 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2fwu n GLY 550 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2fwu n GLU 551 N -1.07 0.00 -0.12 1.61 -0.58 -1.26 -4.77 120.64 114.46 2fwu n GLU 551 Ca 0.00 0.38 -0.16 0.00 -0.42 0.00 0.00 57.16 56.95 2fwu n GLU 551 Cb 0.00 -0.87 -0.11 0.00 -0.57 0.00 0.00 31.44 29.88 2fwu n GLU 551 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2fwu n ASP 552 N -2.05 2.03 -4.11 1.62 8.00 -1.20 -4.52 116.55 116.32 2fwu n ASP 552 Ca 0.00 -0.13 -0.08 0.00 0.71 0.00 0.00 54.79 55.29 2fwu n ASP 552 Cb 0.00 -0.32 -0.10 0.00 -0.02 0.00 0.00 41.12 40.68 2fwu n ASP 552 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2fwu s PHE 553 N -2.48 0.63 -0.27 1.24 -0.71 -1.11 -1.05 117.98 114.23 2fwu s PHE 553 Ca -0.32 -1.07 -0.21 0.00 -1.04 0.00 0.00 56.93 54.29 2fwu s PHE 553 Cb 0.08 -0.43 -0.01 0.00 -1.21 0.00 0.00 43.02 41.45 2fwu s PHE 553 CO 0.57 -0.37 0.66 -2.00 -1.34 0.00 0.00 175.22 172.74 2fwu s GLU 554 N -3.93 4.06 -0.53 1.99 -6.30 0.01 -0.94 118.70 113.06 2fwu s GLU 554 Ca 0.10 0.53 -0.27 0.00 -2.50 0.00 0.00 54.97 52.84 2fwu s GLU 554 Cb 0.08 -3.67 -0.03 0.00 0.00 0.00 0.00 34.13 30.50 2fwu s GLU 554 CO -0.07 -0.47 1.99 0.34 0.02 0.00 0.00 175.26 177.06 2fwu s ASP 555 N 1.50 5.18 -0.39 -1.70 2.15 -1.26 -4.52 116.67 117.63 2fwu s ASP 555 Ca 0.27 0.70 -0.14 0.00 0.43 0.00 0.00 52.55 53.81 2fwu s ASP 555 Cb -0.15 -2.52 0.02 0.00 -0.30 0.00 0.00 42.92 39.96 2fwu s ASP 555 CO 0.09 -2.38 0.28 0.28 -0.17 0.00 0.00 175.17 173.27 2fwu s THR 556 N 9.44 5.14 -0.34 1.71 -1.32 -1.26 -4.90 115.64 124.12 2fwu s THR 556 Ca 0.77 -0.64 -0.00 0.00 -1.21 0.00 0.00 61.69 60.61 2fwu s THR 556 Cb -0.16 -3.84 0.11 0.00 -1.51 0.00 0.00 72.50 67.11 2fwu s THR 556 CO 0.24 -0.26 0.14 0.00 -2.21 0.00 0.00 174.62 172.54 2fwu n GLY 558 N 4.53 4.62 2.86 0.00 0.00 -0.76 -4.96 105.19 111.48 2fwu n GLY 558 Ca 0.01 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.81 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 1.67 0.90 0.06 1.61 2.02 -1.26 -0.46 118.70 123.24 2fwu s GLU 559 Ca 0.00 -0.07 -0.29 0.00 0.02 0.00 0.00 54.97 54.63 2fwu s GLU 559 Cb 0.00 -1.03 -0.05 0.00 0.10 0.00 0.00 34.13 33.15 2fwu s GLU 559 CO 0.00 -0.18 0.93 -0.51 0.02 0.00 0.00 175.26 175.51 2fwu s LEU 560 N 1.41 4.45 -0.62 1.80 1.43 0.10 -4.87 118.68 122.37 2fwu s LEU 560 Ca -0.03 1.68 -0.17 0.00 -1.03 0.00 0.00 54.13 54.57 2fwu s LEU 560 Cb -0.13 -3.51 0.13 0.00 0.03 0.00 0.00 46.19 42.71 2fwu s LEU 560 CO -0.03 -0.11 0.67 -0.70 0.23 0.00 0.00 176.35 176.41 2fwu s GLU 561 N 0.33 3.13 0.13 1.70 2.12 -1.26 -1.38 118.70 123.46 2fwu s GLU 561 Ca 0.47 -1.61 -0.03 0.00 0.36 0.00 0.00 54.97 54.16 2fwu s GLU 561 Cb -0.22 -4.33 -0.05 0.00 0.26 0.00 0.00 34.13 29.79 2fwu s GLU 561 CO 0.28 -1.46 0.33 -0.06 -0.54 0.00 0.00 175.26 173.81 2fwu s PHE 562 N 2.02 3.49 0.30 5.30 0.40 -0.10 -4.98 117.98 124.41 2fwu s PHE 562 Ca 0.11 0.43 -0.16 0.00 -0.60 0.00 0.00 56.93 56.71 2fwu s PHE 562 Cb -0.23 -1.91 0.02 0.00 0.51 0.00 0.00 43.02 41.41 2fwu s PHE 562 CO 0.02 0.47 0.64 1.14 0.70 0.00 0.00 175.22 178.19 2fwu s GLN 563 N -2.75 1.83 0.20 0.44 -2.07 -1.25 0.28 119.66 116.34 2fwu s GLN 563 Ca 0.39 -1.23 -0.11 0.00 -1.82 0.00 0.00 55.36 52.59 2fwu s GLN 563 Cb -0.12 0.56 0.26 0.00 -1.09 0.00 0.00 33.01 32.62 2fwu s GLN 563 CO 0.26 -0.82 1.70 -0.97 -1.32 0.00 0.00 175.29 174.15 2fwu h ASN 564 N 2.08 -0.02 -0.19 12.60 -1.24 -1.32 -1.49 115.58 125.99 2fwu h ASN 564 Ca -0.25 0.11 0.00 0.00 0.71 0.00 0.00 56.30 56.87 2fwu h ASN 564 Cb 1.25 0.15 0.00 0.00 0.73 0.00 0.00 38.32 40.45 2fwu h ASN 564 CO 0.32 0.00 0.00 0.47 -1.29 0.00 0.00 177.43 176.93 2fwu n ASP 565 N -5.14 1.77 -4.15 1.15 8.00 -1.26 -4.82 116.55 112.10 2fwu n ASP 565 Ca 0.08 -1.75 -0.31 0.00 0.71 0.00 0.00 54.79 53.52 2fwu n ASP 565 Cb 0.30 -0.12 -0.17 0.00 -0.02 0.00 0.00 41.12 41.11 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 -1.75 2.75 0.26 -1.24 2.56 -0.56 -5.12 118.70 115.59 2fwu s GLU 566 Ca 0.32 -0.76 0.09 0.00 0.00 0.00 0.00 54.97 54.61 2fwu s GLU 566 Cb 0.17 -2.21 -0.04 0.00 2.00 0.00 0.00 34.13 34.05 2fwu s GLU 566 CO 0.26 0.02 0.04 0.96 -0.56 0.00 0.00 175.26 175.98 2fwu s ILE 567 N 0.73 3.67 0.20 -3.70 -4.36 -1.26 -3.96 121.20 112.52 2fwu s ILE 567 Ca -0.10 -1.78 0.00 0.00 -0.26 0.00 0.00 60.65 58.51 2fwu s ILE 567 Cb -0.16 -2.96 0.00 0.00 1.25 0.00 0.00 42.46 40.59 2fwu s ILE 567 CO 0.01 -0.36 0.00 0.55 0.24 0.00 0.00 174.94 175.39 2fwu n VAL 568 N -0.91 0.00 -3.71 8.37 3.14 -1.26 -5.01 118.33 118.94 2fwu n VAL 568 Ca -0.07 0.09 -0.05 0.00 -2.96 0.00 0.00 64.34 61.36 2fwu n VAL 568 Cb 0.59 -0.35 -0.02 0.00 -1.06 0.00 0.00 33.84 33.00 2fwu n VAL 568 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2fwu s LYS 569 N -2.20 1.20 -0.01 1.45 2.47 -0.89 -4.88 119.74 116.88 2fwu s LYS 569 Ca 0.00 -0.63 0.03 0.00 -1.56 0.00 0.00 55.97 53.81 2fwu s LYS 569 Cb 0.00 0.43 -0.00 0.00 -1.46 0.00 0.00 37.83 36.80 2fwu s LYS 569 CO 0.00 -0.55 -0.10 0.95 0.16 0.00 0.00 175.35 175.82 2fwu s THR 570 N -3.34 0.79 -0.31 3.43 -4.23 -1.25 -0.74 115.64 109.98 2fwu s THR 570 Ca 0.10 -0.41 -0.20 0.00 -1.18 0.00 0.00 61.69 60.01 2fwu s THR 570 Cb -0.02 -0.67 -0.01 0.00 1.34 0.00 0.00 72.50 73.14 2fwu s THR 570 CO 0.00 0.23 0.62 -0.63 -0.54 0.00 0.00 174.62 174.30 2fwu s ILE 571 N -0.10 4.94 -0.41 2.99 1.09 -0.91 -4.85 121.20 123.95 2fwu s ILE 571 Ca 0.02 0.80 -0.18 0.00 -1.10 0.00 0.00 60.65 60.18 2fwu s ILE 571 Cb -0.05 -4.00 0.02 0.00 -1.06 0.00 0.00 42.46 37.37 2fwu s ILE 571 CO -0.00 -0.15 0.49 -0.94 -0.10 0.00 0.00 174.94 174.23 2fwu s SER 572 N 1.66 6.24 -0.14 3.58 1.04 -1.26 -3.09 113.70 121.73 2fwu s SER 572 Ca 0.25 -0.51 -0.03 0.00 0.48 0.00 0.00 55.95 56.14 2fwu s SER 572 Cb -0.15 -2.25 -0.03 0.00 0.10 0.00 0.00 66.02 63.69 2fwu s SER 572 CO 0.12 -0.61 -0.03 -0.69 0.98 0.00 0.00 173.24 173.01 2fwu s VAL 573 N 2.32 3.96 -0.25 5.02 1.01 -1.01 -4.96 120.40 126.48 2fwu s VAL 573 Ca 0.15 -0.34 -0.23 0.00 0.00 0.00 0.00 61.98 61.56 2fwu s VAL 573 Cb -0.16 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 2fwu s VAL 573 CO 0.15 0.52 0.75 -0.75 0.00 0.00 0.00 175.10 175.76 2fwu s LYS 574 N 0.08 4.13 -0.05 2.72 2.47 -1.26 -2.57 119.74 125.25 2fwu s LYS 574 Ca 0.00 0.76 -0.20 0.00 -1.56 0.00 0.00 55.97 54.97 2fwu s LYS 574 Cb -0.13 -3.65 -0.05 0.00 -1.46 0.00 0.00 37.83 32.53 2fwu s LYS 574 CO 0.03 -0.49 0.55 0.08 0.16 0.00 0.00 175.35 175.68 2fwu s VAL 575 N 2.72 5.04 0.23 4.02 1.01 -0.18 -0.81 120.40 132.42 2fwu s VAL 575 Ca 0.31 1.14 -0.04 0.00 0.00 0.00 0.00 61.98 63.39 2fwu s VAL 575 Cb -0.15 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 2fwu s VAL 575 CO 0.08 0.37 0.46 -0.63 0.00 0.00 0.00 175.10 175.39 2fwu s ILE 576 N 0.17 5.11 -0.34 2.22 -1.09 -0.22 -4.80 121.20 122.25 2fwu s ILE 576 Ca 0.30 -0.06 -0.27 0.00 -2.23 0.00 0.00 60.65 58.38 2fwu s ILE 576 Cb -0.17 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 36.96 2fwu s ILE 576 CO 0.15 -0.18 2.20 1.51 -1.23 0.00 0.00 174.94 177.39 2fwu s ASP 577 N -2.96 5.18 0.42 3.58 -4.77 -1.26 -4.81 116.67 112.05 2fwu s ASP 577 Ca 0.42 1.47 -0.26 0.00 -3.30 0.00 0.00 52.55 50.88 2fwu s ASP 577 Cb -0.11 -2.51 -0.09 0.00 -1.09 0.00 0.00 42.92 39.12 2fwu s ASP 577 CO 0.28 -2.24 1.40 -0.62 0.70 0.00 0.00 175.17 174.68 2fwu s ASP 578 N 9.22 6.11 -0.13 2.11 2.15 -1.26 -4.93 116.67 129.93 2fwu s ASP 578 Ca 0.95 2.86 -0.23 0.00 0.43 0.00 0.00 52.55 56.56 2fwu s ASP 578 Cb -0.25 -2.65 -0.21 0.00 -0.30 0.00 0.00 42.92 39.50 2fwu s ASP 578 CO 0.31 -1.01 0.61 -0.33 -0.17 0.00 0.00 175.17 174.59 2fwu h GLU 579 N 2.58 0.00 0.00 4.34 3.07 -1.91 -3.48 114.58 119.18 2fwu h GLU 579 Ca -0.50 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 2fwu h GLU 579 Cb 1.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 2fwu h GLU 579 CO 0.62 0.81 0.00 -0.85 -1.40 0.00 0.00 179.01 178.19 2fwu n GLU 580 N -4.64 3.47 -4.24 2.33 0.00 -1.26 -5.14 120.64 111.16 2fwu n GLU 580 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 57.16 56.78 2fwu n GLU 580 Cb 0.39 0.00 -0.10 0.00 0.00 0.00 0.00 31.44 31.73 2fwu n GLU 580 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.13 178.65 2fwu s TYR 581 N 1.16 2.70 0.21 -1.84 1.13 -1.26 -5.14 117.35 114.31 2fwu s TYR 581 Ca 0.00 -0.18 0.01 0.00 -1.41 0.00 0.00 57.07 55.49 2fwu s TYR 581 Cb 0.00 -1.41 -0.00 0.00 -1.10 0.00 0.00 41.96 39.45 2fwu s TYR 581 CO 0.00 0.43 0.04 0.39 -2.51 0.00 0.00 175.55 173.90 2fwu n GLU 582 N 0.66 1.02 0.00 -3.49 4.71 -1.26 -5.15 120.64 117.13 2fwu n GLU 582 Ca -0.14 -1.64 0.00 0.00 -0.01 0.00 0.00 57.16 55.37 2fwu n GLU 582 Cb 0.53 0.72 0.00 0.00 -1.01 0.00 0.00 31.44 31.67 2fwu n GLU 582 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2fwu n LYS 583 N -0.49 1.78 -2.78 3.49 5.02 -1.26 -4.78 118.16 119.15 2fwu n LYS 583 Ca -0.05 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.80 2fwu n LYS 583 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.30 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 0.00 5.10 -4.94 4.39 4.13 -1.26 -4.54 115.26 118.13 2fwu n ASN 584 Ca 0.00 -2.95 -0.24 0.00 1.68 0.00 0.00 54.58 53.06 2fwu n ASN 584 Cb 0.00 -1.64 0.04 0.00 -1.54 0.00 0.00 39.78 36.64 2fwu n ASN 584 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 2fwu s LYS 585 N 2.65 2.57 -0.03 3.52 0.00 -1.20 -4.84 119.74 122.40 2fwu s LYS 585 Ca 0.47 -0.35 -0.24 0.00 0.00 0.00 0.00 55.97 55.85 2fwu s LYS 585 Cb 0.00 -2.32 0.05 0.00 0.00 0.00 0.00 37.83 35.56 2fwu s LYS 585 CO 0.03 -0.86 0.51 -0.08 0.00 0.00 0.00 175.35 174.96 2fwu s THR 586 N -2.98 0.03 0.08 3.79 -1.32 -1.26 -0.66 115.64 113.32 2fwu s THR 586 Ca 0.56 -0.21 0.07 0.00 -1.21 0.00 0.00 61.69 60.90 2fwu s THR 586 Cb -0.10 -0.83 -0.03 0.00 -1.51 0.00 0.00 72.50 70.03 2fwu s THR 586 CO 0.42 -0.12 -0.19 0.72 -2.21 0.00 0.00 174.62 173.25 2fwu s PHE 587 N -1.24 1.63 -0.17 9.09 -0.12 -1.06 -2.32 117.98 123.78 2fwu s PHE 587 Ca -0.12 -0.41 -0.06 0.00 -0.05 0.00 0.00 56.93 56.29 2fwu s PHE 587 Cb -0.02 -0.92 -0.04 0.00 -0.63 0.00 0.00 43.02 41.41 2fwu s PHE 587 CO 0.07 0.14 0.03 -0.06 -0.05 0.00 0.00 175.22 175.35 2fwu s PHE 588 N -1.09 3.17 -0.26 3.49 0.08 -0.34 -1.27 117.98 121.76 2fwu s PHE 588 Ca 0.05 -0.07 -0.13 0.00 0.12 0.00 0.00 56.93 56.90 2fwu s PHE 588 Cb -0.10 -2.04 -0.04 0.00 -0.57 0.00 0.00 43.02 40.27 2fwu s PHE 588 CO 0.03 0.08 0.28 -1.17 -0.10 0.00 0.00 175.22 174.34 2fwu s LEU 589 N 0.39 4.05 -0.08 -0.37 1.98 0.76 0.01 118.68 125.43 2fwu s LEU 589 Ca 0.01 0.17 0.03 0.00 -2.89 0.00 0.00 54.13 51.44 2fwu s LEU 589 Cb -0.13 -2.27 0.01 0.00 0.66 0.00 0.00 46.19 44.46 2fwu s LEU 589 CO 0.01 -0.09 -0.17 -0.70 -1.89 0.00 0.00 176.35 173.51 2fwu s GLU 590 N 1.75 2.22 -0.11 1.98 2.12 -0.87 -1.37 118.70 124.44 2fwu s GLU 590 Ca 0.11 -0.59 -0.09 0.00 0.36 0.00 0.00 54.97 54.76 2fwu s GLU 590 Cb -0.15 -1.76 -0.04 0.00 0.26 0.00 0.00 34.13 32.43 2fwu s GLU 590 CO 0.09 0.08 0.20 0.96 -0.54 0.00 0.00 175.26 176.06 2fwu s ILE 591 N 0.55 5.39 0.00 -3.70 -4.36 -1.26 -1.74 121.20 116.08 2fwu s ILE 591 Ca -0.16 0.35 0.00 0.00 -0.26 0.00 0.00 60.65 60.58 2fwu s ILE 591 Cb -0.17 -3.48 0.00 0.00 1.25 0.00 0.00 42.46 40.06 2fwu s ILE 591 CO 0.06 0.58 0.00 0.61 0.24 0.00 0.00 174.94 176.43 2fwu n GLY 592 N 2.19 1.46 3.64 6.27 0.00 0.12 -4.93 105.19 113.94 2fwu n GLY 592 Ca -0.18 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 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 2.49 4.16 0.64 1.61 2.12 -1.26 -4.82 118.70 123.64 2fwu s GLU 593 Ca 0.00 1.02 -0.17 0.00 0.36 0.00 0.00 54.97 56.19 2fwu s GLU 593 Cb 0.00 -3.66 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 2fwu s GLU 593 CO 0.00 -0.61 1.16 -1.25 -0.54 0.00 0.00 175.26 174.02 2fwu s PRO 594 N 3.04 2.80 -0.02 4.30 0.04 -1.26 -4.47 135.00 139.43 2fwu s PRO 594 Ca 0.38 1.61 0.01 0.00 0.04 0.00 0.00 61.00 63.04 2fwu s PRO 594 Cb -0.15 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.48 2fwu s PRO 594 CO 0.08 -1.29 -0.02 -0.98 0.04 0.00 0.00 177.00 174.84 2fwu s ARG 595 N -3.72 0.36 0.03 4.56 1.70 0.19 -4.38 118.95 117.68 2fwu s ARG 595 Ca 0.72 -0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 55.66 2fwu s ARG 595 Cb -0.25 -0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 33.64 2fwu s ARG 595 CO 0.37 -0.05 1.01 -1.17 -1.08 0.00 0.00 175.30 174.38 2fwu s LEU 596 N 0.61 4.39 -0.09 -1.89 1.98 -1.26 -0.69 118.68 121.73 2fwu s LEU 596 Ca -0.06 1.75 0.09 0.00 -2.89 0.00 0.00 54.13 53.02 2fwu s LEU 596 Cb -0.09 -3.58 0.44 0.00 0.66 0.00 0.00 46.19 43.62 2fwu s LEU 596 CO -0.01 -0.26 1.24 0.52 -1.89 0.00 0.00 176.35 175.95 2fwu n VAL 597 N 3.68 1.26 -2.48 1.68 0.31 0.95 -4.72 118.33 119.01 2fwu n VAL 597 Ca 0.06 -0.72 -0.39 0.00 -0.01 0.00 0.00 64.34 63.28 2fwu n VAL 597 Cb 0.50 -0.18 -0.02 0.00 -0.91 0.00 0.00 33.84 33.23 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 -1.83 3.54 -1.06 5.55 -1.05 -1.26 -4.84 118.70 117.75 2fwu s GLU 598 Ca 0.30 -1.35 -0.10 0.00 -0.15 0.00 0.00 54.97 53.67 2fwu s GLU 598 Cb 0.21 -5.38 0.26 0.00 -0.44 0.00 0.00 34.13 28.77 2fwu s GLU 598 CO 0.12 -2.49 1.06 -1.64 0.95 0.00 0.00 175.26 173.26 2fwu s MET 599 N 5.04 4.07 -0.13 -4.83 -1.94 -1.26 -4.66 119.30 115.59 2fwu s MET 599 Ca 0.53 -3.02 0.07 0.00 -1.71 0.00 0.00 55.69 51.56 2fwu s MET 599 Cb 0.01 -4.56 -0.23 0.00 2.01 0.00 0.00 34.83 32.05 2fwu s MET 599 CO -0.01 -1.28 0.33 0.45 -0.01 0.00 0.00 175.02 174.50 2fwu n SER 600 N 3.14 1.16 -2.70 3.03 2.88 -1.26 -5.06 113.62 114.80 2fwu n SER 600 Ca 0.22 0.20 -0.02 0.00 -1.33 0.00 0.00 58.87 57.94 2fwu n SER 600 Cb 0.41 -0.08 -0.01 0.00 -0.75 0.00 0.00 64.21 63.78 2fwu n SER 600 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2fwu n GLU 601 N -3.12 -3.73 -3.90 -1.46 2.13 -1.26 -5.00 120.64 104.30 2fwu n GLU 601 Ca -0.28 2.94 -0.32 0.00 0.66 0.00 0.00 57.16 60.15 2fwu n GLU 601 Cb 1.07 -5.21 -0.04 0.00 0.27 0.00 0.00 31.44 27.52 2fwu n GLU 601 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2fwu s LYS 602 N -1.37 3.45 -0.50 5.31 -2.85 -1.26 -5.03 119.74 117.49 2fwu s LYS 602 Ca -0.08 -0.36 0.06 0.00 -1.00 0.00 0.00 55.97 54.59 2fwu s LYS 602 Cb 0.01 -3.06 0.21 0.00 -2.06 0.00 0.00 37.83 32.92 2fwu s LYS 602 CO 0.77 0.64 0.49 1.17 0.10 0.00 0.00 175.35 178.52 2fwu n LYS 603 N 0.63 1.03 0.05 1.78 0.00 -1.26 -4.88 118.16 115.51 2fwu n LYS 603 Ca -0.08 -3.68 -0.02 0.00 0.00 0.00 0.00 58.31 54.53 2fwu n LYS 603 Cb 0.52 -1.75 -0.07 0.00 0.00 0.00 0.00 35.03 33.73 2fwu n LYS 603 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2fwu h GLY 604 N 4.88 0.00 0.00 3.14 0.00 -2.04 -3.49 103.07 105.56 2fwu h GLY 604 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2fwu h GLY 604 CO 0.54 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.69 2fwu n GLY 605 N 1.38 -0.84 3.41 4.60 0.00 -1.26 -5.04 105.19 107.43 2fwu n GLY 605 Ca -0.07 -1.04 -0.45 0.00 0.00 0.00 0.00 46.02 44.47 2fwu n GLY 605 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fwu s PHE 606 N -2.00 3.59 -0.17 1.61 0.08 -1.26 -4.98 117.98 114.85 2fwu s PHE 606 Ca 0.00 -1.98 -0.29 0.00 0.12 0.00 0.00 56.93 54.77 2fwu s PHE 606 Cb 0.00 -4.10 -0.01 0.00 -0.57 0.00 0.00 43.02 38.34 2fwu s PHE 606 CO 0.00 -1.25 1.09 0.95 -0.10 0.00 0.00 175.22 175.92 2fwu s THR 607 N 1.05 4.58 -0.75 0.64 -4.23 -1.26 -4.97 115.64 110.70 2fwu s THR 607 Ca 0.32 1.89 -0.21 0.00 -1.18 0.00 0.00 61.69 62.50 2fwu s THR 607 Cb -0.06 -4.22 0.09 0.00 1.34 0.00 0.00 72.50 69.65 2fwu s THR 607 CO -0.07 -0.10 1.01 -0.63 -0.54 0.00 0.00 174.62 174.29 2fwu s ILE 608 N 2.84 4.50 -0.09 2.99 1.01 -1.26 -4.94 121.20 126.25 2fwu s ILE 608 Ca 0.49 -0.84 -0.24 0.00 0.00 0.00 0.00 60.65 60.06 2fwu s ILE 608 Cb -0.18 -4.71 0.05 0.00 0.01 0.00 0.00 42.46 37.63 2fwu s ILE 608 CO 0.13 -1.46 0.56 0.28 0.00 0.00 0.00 174.94 174.45 2fwu s THR 609 N 3.49 0.01 -0.80 2.92 -1.32 -1.26 -5.08 115.64 113.60 2fwu s THR 609 Ca 0.25 -0.12 -0.18 0.00 -1.21 0.00 0.00 61.69 60.43 2fwu s THR 609 Cb -0.13 -0.84 0.14 0.00 -1.51 0.00 0.00 72.50 70.16 2fwu s THR 609 CO 0.03 -0.07 0.91 -1.61 -2.21 0.00 0.00 174.62 171.67 2fwu s GLU 610 N -0.77 3.43 -0.49 7.08 0.41 -1.26 -4.81 118.70 122.29 2fwu s GLU 610 Ca -0.08 -1.78 0.08 0.00 -0.41 0.00 0.00 54.97 52.78 2fwu s GLU 610 Cb -0.03 -4.58 0.28 0.00 -1.78 0.00 0.00 34.13 28.02 2fwu s GLU 610 CO 0.06 -1.59 0.67 0.39 -0.49 0.00 0.00 175.26 174.30 2fwu n GLU 611 N 5.88 1.61 -4.34 1.61 1.02 -1.26 -4.10 120.64 121.06 2fwu n GLU 611 Ca 0.11 -3.89 -0.34 0.00 -0.02 0.00 0.00 57.16 53.02 2fwu n GLU 611 Cb 0.47 -1.73 -0.11 0.00 -0.02 0.00 0.00 31.44 30.05 2fwu n GLU 611 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2fwu s TYR 612 N -2.05 3.12 -0.94 -0.32 5.04 -1.26 -5.02 117.35 115.92 2fwu s TYR 612 Ca 0.39 -0.00 -0.24 0.00 -2.44 0.00 0.00 57.07 54.77 2fwu s TYR 612 Cb 0.21 -1.89 -0.02 0.00 0.35 0.00 0.00 41.96 40.61 2fwu s TYR 612 CO -0.08 0.24 1.79 -0.51 -1.34 0.00 0.00 175.55 175.65 2fwu s ASP 613 N -0.25 5.56 -0.64 4.32 1.01 -1.26 -4.90 116.67 120.51 2fwu s ASP 613 Ca 0.06 -0.91 -0.24 0.00 0.71 0.00 0.00 52.55 52.16 2fwu s ASP 613 Cb -0.12 -2.56 0.05 0.00 1.01 0.00 0.00 42.92 41.29 2fwu s ASP 613 CO 0.02 -2.36 1.04 -0.62 0.21 0.00 0.00 175.17 173.45 2fwu s ASP 614 N 7.09 6.23 -1.15 0.27 2.15 -1.26 -4.94 116.67 125.06 2fwu s ASP 614 Ca 0.63 -0.64 -0.21 0.00 0.43 0.00 0.00 52.55 52.75 2fwu s ASP 614 Cb -0.05 -2.46 -0.01 0.00 -0.30 0.00 0.00 42.92 40.11 2fwu s ASP 614 CO -0.04 -1.47 1.79 -1.59 -0.17 0.00 0.00 175.17 173.70 2fwu s LYS 615 N 4.43 3.19 0.20 4.34 -2.85 -1.26 -4.84 119.74 122.95 2fwu s LYS 615 Ca 0.28 -1.31 0.01 0.00 -1.00 0.00 0.00 55.97 53.96 2fwu s LYS 615 Cb -0.13 -5.34 -0.05 0.00 -2.06 0.00 0.00 37.83 30.25 2fwu s LYS 615 CO 0.15 -3.03 0.05 -0.65 0.10 0.00 0.00 175.35 171.97 2fwu s GLN 616 N 5.55 1.22 1.10 1.78 -1.52 -1.26 -5.15 119.66 121.38 2fwu s GLN 616 Ca 0.60 -1.62 -0.12 0.00 -1.95 0.00 0.00 55.36 52.27 2fwu s GLN 616 Cb 0.00 -0.21 0.25 0.00 -0.22 0.00 0.00 33.01 32.83 2fwu s GLN 616 CO 0.06 -0.21 1.05 -1.25 -0.25 0.00 0.00 175.29 174.69 2fwu s PRO 617 N -3.98 -0.41 -0.59 2.91 0.04 -1.26 -4.83 135.00 126.88 2fwu s PRO 617 Ca 0.30 0.91 -0.26 0.00 0.04 0.00 0.00 61.00 61.99 2fwu s PRO 617 Cb 0.07 -1.61 -0.04 0.00 0.04 0.00 0.00 34.50 32.96 2fwu s PRO 617 CO 0.08 -3.40 2.01 -0.51 0.04 0.00 0.00 177.00 175.22 2fwu s LEU 618 N -7.01 3.31 0.01 -3.56 2.01 -1.26 -4.88 118.68 107.30 2fwu s LEU 618 Ca 0.68 0.48 -0.01 0.00 0.01 0.00 0.00 54.13 55.29 2fwu s LEU 618 Cb -0.24 -2.52 -0.01 0.00 0.01 0.00 0.00 46.19 43.43 2fwu s LEU 618 CO 0.63 -2.54 0.01 0.42 1.01 0.00 0.00 176.35 175.87 2fwu s THR 619 N 9.98 0.06 -0.03 5.49 -4.23 -1.26 -5.04 115.64 120.61 2fwu s THR 619 Ca 0.75 -0.51 0.14 0.00 -1.18 0.00 0.00 61.69 60.88 2fwu s THR 619 Cb -0.13 -0.19 -0.21 0.00 1.34 0.00 0.00 72.50 73.31 2fwu s THR 619 CO 0.21 -0.28 0.28 -1.54 -0.54 0.00 0.00 174.62 172.74 2fwu n SER 620 N 2.19 1.87 -0.20 3.99 3.41 -1.26 -4.95 113.62 118.68 2fwu n SER 620 Ca -0.19 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.39 2fwu n SER 620 Cb 0.57 1.55 -0.01 0.00 -0.26 0.00 0.00 64.21 66.06 2fwu n SER 620 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2fwu n LYS 621 N -2.02 -1.64 -0.44 4.33 4.81 -1.26 -1.53 118.16 120.41 2fwu n LYS 621 Ca -0.04 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 2fwu n LYS 621 Cb 0.41 -4.80 0.00 0.00 0.02 0.00 0.00 35.03 30.66 2fwu n LYS 621 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2fwu n GLU 622 N -0.01 0.00 -2.53 1.64 1.02 -1.26 -4.95 120.64 114.55 2fwu n GLU 622 Ca -0.03 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.69 2fwu n GLU 622 Cb 0.45 -3.37 -0.03 0.00 -0.02 0.00 0.00 31.44 28.47 2fwu n GLU 622 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2fwu s GLU 623 N -0.35 4.44 0.27 3.49 2.12 -0.59 -4.92 118.70 123.16 2fwu s GLU 623 Ca 0.00 1.62 0.04 0.00 0.36 0.00 0.00 54.97 56.99 2fwu s GLU 623 Cb 0.00 -3.45 0.35 0.00 0.26 0.00 0.00 34.13 31.30 2fwu s GLU 623 CO 0.00 -0.26 1.65 1.05 -0.54 0.00 0.00 175.26 177.16 2fwu h GLU 624 N 6.99 0.32 -0.97 4.30 4.11 -1.93 -1.81 114.58 125.60 2fwu h GLU 624 Ca -0.39 -0.17 0.07 0.00 0.07 0.00 0.00 59.36 58.95 2fwu h GLU 624 Cb 1.20 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 2fwu h GLU 624 CO 0.82 0.71 0.62 0.93 0.07 0.00 0.00 179.01 182.16 2fwu h GLU 625 N 0.27 1.08 -0.10 1.06 3.07 -1.91 0.48 114.58 118.53 2fwu h GLU 625 Ca 0.02 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 58.76 2fwu h GLU 625 Cb 0.89 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 28.56 2fwu h GLU 625 CO 0.07 0.71 -0.15 -0.09 -1.40 0.00 0.00 179.01 178.16 2fwu h ARG 626 N 1.11 0.27 -0.97 2.33 9.65 -1.77 -2.90 114.38 122.10 2fwu h ARG 626 Ca 0.43 -0.16 0.02 0.00 -1.10 0.00 0.00 59.98 59.16 2fwu h ARG 626 Cb 0.20 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.75 2fwu h ARG 626 CO -0.18 0.73 0.64 0.00 2.80 0.00 0.00 179.97 183.96 2fwu h ARG 627 N -0.17 1.26 -0.43 0.20 3.08 -0.37 0.29 114.38 118.24 2fwu h ARG 627 Ca 0.01 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 2fwu h ARG 627 Cb 0.70 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 2fwu h ARG 627 CO 0.03 0.83 0.00 0.82 -1.07 0.00 0.00 179.97 180.59 2fwu h ILE 628 N 1.29 1.23 -0.37 2.04 2.04 -0.15 -2.29 117.51 121.30 2fwu h ILE 628 Ca 0.36 -0.93 -0.15 0.00 1.00 0.00 0.00 64.86 65.15 2fwu h ILE 628 Cb -0.11 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 2fwu h ILE 628 CO -0.09 0.32 -0.37 0.00 0.00 0.00 0.00 178.15 178.02 2fwu h ALA 629 N 1.35 0.64 0.00 1.87 0.00 -1.01 -3.03 119.26 119.07 2fwu h ALA 629 Ca 0.13 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2fwu h ALA 629 Cb 0.40 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2fwu h ALA 629 CO 0.02 0.67 0.00 0.39 0.00 0.00 0.00 179.25 180.33 2fwu n GLU 630 N -4.06 0.57 -0.00 0.00 -0.58 -0.03 -0.40 120.64 116.14 2fwu n GLU 630 Ca -0.02 0.02 0.09 0.00 -0.42 0.00 0.00 57.16 56.83 2fwu n GLU 630 Cb 0.53 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.78 2fwu n GLU 630 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2fwu n MET 631 N -1.06 0.80 -0.08 3.49 0.00 -1.05 -3.44 117.12 115.78 2fwu n MET 631 Ca 0.14 -0.06 -0.05 0.00 0.00 0.00 0.00 57.70 57.73 2fwu n MET 631 Cb 0.09 -1.40 -0.16 0.00 0.00 0.00 0.00 33.22 31.75 2fwu n MET 631 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2fwu n GLY 632 N 1.43 -0.99 3.87 3.17 0.00 -0.35 -4.05 105.19 108.27 2fwu n GLY 632 Ca 0.01 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.71 3.54 0.28 1.61 0.52 0.46 -4.94 118.95 117.72 2fwu s ARG 633 Ca -0.10 -0.03 -0.29 0.00 -0.52 0.00 0.00 55.73 54.79 2fwu s ARG 633 Cb 0.08 -3.20 -0.10 0.00 0.52 0.00 0.00 34.95 32.25 2fwu s ARG 633 CO 0.84 0.76 1.14 -1.25 0.02 0.00 0.00 175.30 176.81 2fwu s PRO 634 N -1.03 4.59 0.28 3.54 0.04 -1.26 -3.82 135.00 137.33 2fwu s PRO 634 Ca 0.17 1.87 0.02 0.00 0.04 0.00 0.00 61.00 63.09 2fwu s PRO 634 Cb -0.13 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.23 2fwu s PRO 634 CO 0.06 0.13 0.06 0.44 0.04 0.00 0.00 177.00 177.72 2fwu n ILE 635 N 1.24 0.00 -1.73 0.56 -6.64 -1.26 -4.10 119.36 107.43 2fwu n ILE 635 Ca -0.01 -1.49 -0.30 0.00 -1.77 0.00 0.00 62.75 59.19 2fwu n ILE 635 Cb 0.44 0.45 0.20 0.00 -1.44 0.00 0.00 39.64 39.29 2fwu n ILE 635 CO 0.00 0.00 0.00 -1.48 -1.77 0.00 0.00 176.55 173.30 2fwu s LEU 636 N 0.00 2.24 0.00 7.28 2.34 -1.26 -3.09 118.68 126.19 2fwu s LEU 636 Ca 0.08 0.33 0.00 0.00 0.06 0.00 0.00 54.13 54.60 2fwu s LEU 636 Cb 0.00 -2.28 0.00 0.00 -0.56 0.00 0.00 46.19 43.35 2fwu s LEU 636 CO 0.06 -3.10 0.00 0.61 -1.06 0.00 0.00 176.35 172.86 2fwu n GLY 637 N -3.12 0.03 1.39 -3.48 0.00 0.94 -3.87 105.19 97.08 2fwu n GLY 637 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2fwu n GLY 637 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fwu n GLU 638 N -0.64 0.00 -4.04 1.61 4.07 -1.26 -4.87 120.64 115.51 2fwu n GLU 638 Ca 0.00 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.79 2fwu n GLU 638 Cb 0.00 -0.10 -0.16 0.00 -0.06 0.00 0.00 31.44 31.12 2fwu n GLU 638 CO 0.00 0.00 0.00 -3.38 -0.06 0.00 0.00 177.13 173.69 2fwu s HIS 639 N -1.32 2.39 -0.67 4.31 -3.43 -1.26 -5.05 115.29 110.26 2fwu s HIS 639 Ca 0.00 -1.41 -0.06 0.00 -0.80 0.00 0.00 55.06 52.79 2fwu s HIS 639 Cb 0.00 -1.70 0.17 0.00 -1.43 0.00 0.00 32.58 29.63 2fwu s HIS 639 CO 0.00 -0.72 0.51 0.95 -2.00 0.00 0.00 174.74 173.48 2fwu s THR 640 N 1.41 4.20 -0.30 -5.38 -4.23 -1.26 -2.57 115.64 107.52 2fwu s THR 640 Ca 0.04 -2.77 -0.18 0.00 -1.18 0.00 0.00 61.69 57.60 2fwu s THR 640 Cb -0.13 -3.70 0.20 0.00 1.34 0.00 0.00 72.50 70.21 2fwu s THR 640 CO -0.11 -0.91 1.26 -0.75 -0.54 0.00 0.00 174.62 173.57 2fwu s LYS 641 N 0.08 0.09 -0.15 3.99 2.36 -1.26 -4.72 119.74 120.13 2fwu s LYS 641 Ca 0.16 0.15 -0.04 0.00 -2.55 0.00 0.00 55.97 53.69 2fwu s LYS 641 Cb -0.18 0.02 0.05 0.00 -1.05 0.00 0.00 37.83 36.68 2fwu s LYS 641 CO -0.05 -0.02 0.07 -1.17 1.55 0.00 0.00 175.35 175.73 2fwu s LEU 642 N 0.86 0.56 -0.56 5.43 2.96 -0.47 -4.35 118.68 123.11 2fwu s LEU 642 Ca -0.05 -0.55 -0.21 0.00 -0.22 0.00 0.00 54.13 53.09 2fwu s LEU 642 Cb -0.03 -0.34 0.06 0.00 0.50 0.00 0.00 46.19 46.38 2fwu s LEU 642 CO -0.11 -0.32 0.79 -0.70 -1.32 0.00 0.00 176.35 174.69 2fwu s GLU 643 N 2.06 3.18 -0.43 1.98 2.12 0.18 -0.17 118.70 127.62 2fwu s GLU 643 Ca 0.02 -0.73 -0.18 0.00 0.36 0.00 0.00 54.97 54.43 2fwu s GLU 643 Cb -0.16 -4.13 0.02 0.00 0.26 0.00 0.00 34.13 30.13 2fwu s GLU 643 CO -0.08 -1.44 0.51 0.08 -0.54 0.00 0.00 175.26 173.79 2fwu s VAL 644 N 3.30 5.00 -0.30 3.70 1.01 -0.40 -0.83 120.40 131.88 2fwu s VAL 644 Ca 0.21 -0.19 -0.19 0.00 0.00 0.00 0.00 61.98 61.81 2fwu s VAL 644 Cb -0.17 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.10 2fwu s VAL 644 CO 0.13 -0.48 0.56 -0.63 0.00 0.00 0.00 175.10 174.68 2fwu s ILE 645 N 2.37 5.00 -0.36 2.22 1.09 0.96 -2.56 121.20 129.92 2fwu s ILE 645 Ca 0.16 0.74 -0.09 0.00 -1.10 0.00 0.00 60.65 60.37 2fwu s ILE 645 Cb -0.16 -3.93 0.04 0.00 -1.06 0.00 0.00 42.46 37.35 2fwu s ILE 645 CO 0.15 -0.08 0.16 -0.63 -0.10 0.00 0.00 174.94 174.45 2fwu s ILE 646 N 2.46 4.16 0.11 2.92 1.09 0.17 -0.79 121.20 131.30 2fwu s ILE 646 Ca 0.22 -1.05 0.06 0.00 -1.10 0.00 0.00 60.65 58.79 2fwu s ILE 646 Cb -0.15 -3.36 -0.04 0.00 -1.06 0.00 0.00 42.46 37.85 2fwu s ILE 646 CO 0.11 -0.24 -0.06 -1.83 -0.10 0.00 0.00 174.94 172.83 2fwu s GLU 647 N 1.47 2.29 0.25 2.79 -1.05 -1.00 -3.26 118.70 120.19 2fwu s GLU 647 Ca 0.00 -0.97 -0.30 0.00 -0.15 0.00 0.00 54.97 53.55 2fwu s GLU 647 Cb -0.20 -2.39 -0.11 0.00 -0.44 0.00 0.00 34.13 31.00 2fwu s GLU 647 CO 0.04 0.51 1.53 -1.21 0.95 0.00 0.00 175.26 177.09 2fwu s GLU 648 N -2.31 4.20 -0.30 -4.83 0.41 -1.26 -2.30 118.70 112.31 2fwu s GLU 648 Ca 0.23 2.42 -0.28 0.00 -0.41 0.00 0.00 54.97 56.94 2fwu s GLU 648 Cb -0.11 -3.09 -0.05 0.00 -1.78 0.00 0.00 34.13 29.10 2fwu s GLU 648 CO 0.16 -0.54 2.22 0.45 -0.49 0.00 0.00 175.26 177.06 2fwu s SER 649 N 0.59 5.24 0.21 -0.19 0.15 -1.26 -4.63 113.70 113.80 2fwu s SER 649 Ca 0.63 1.61 0.00 0.00 0.70 0.00 0.00 55.95 58.90 2fwu s SER 649 Cb -0.45 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.35 2fwu s SER 649 CO 0.42 -2.17 0.00 0.00 1.20 0.00 0.00 173.24 172.69 2fwu n TYR 650 N 12.63 -1.60 0.00 3.44 9.36 -1.26 -5.07 117.16 134.66 2fwu n TYR 650 Ca 0.31 0.28 0.00 0.00 3.32 0.00 0.00 57.90 61.81 2fwu n TYR 650 Cb 0.48 0.38 0.00 0.00 -0.63 0.00 0.00 39.34 39.57 2fwu n TYR 650 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 2fwu n GLU 651 N -3.44 0.00 -3.81 2.98 2.13 -1.26 -5.14 120.64 112.10 2fwu n GLU 651 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 2fwu n GLU 651 Cb 0.00 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 31.56 2fwu n GLU 651 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2fwu s PHE 652 N -2.00 1.90 -0.25 4.31 0.08 -1.26 -5.07 117.98 115.68 2fwu s PHE 652 Ca 0.00 -1.65 -0.04 0.00 0.12 0.00 0.00 56.93 55.36 2fwu s PHE 652 Cb 0.00 -1.63 0.00 0.00 -0.57 0.00 0.00 43.02 40.83 2fwu s PHE 652 CO 0.00 -0.80 -0.00 0.15 -0.10 0.00 0.00 175.22 174.47 2fwu s LYS 653 N 1.56 3.20 -0.28 0.44 -0.14 -1.26 -5.06 119.74 118.20 2fwu s LYS 653 Ca 0.04 -0.76 -0.29 0.00 -1.36 0.00 0.00 55.97 53.60 2fwu s LYS 653 Cb -0.18 -3.13 -0.01 0.00 -1.68 0.00 0.00 37.83 32.83 2fwu s LYS 653 CO -0.15 -0.31 1.55 0.45 -0.76 0.00 0.00 175.35 176.13 2fwu s SER 654 N 1.46 6.36 -0.43 2.83 0.15 -1.26 -4.90 113.70 117.92 2fwu s SER 654 Ca 0.04 1.39 0.05 0.00 0.70 0.00 0.00 55.95 58.12 2fwu s SER 654 Cb -0.16 -2.53 0.18 0.00 -1.71 0.00 0.00 66.02 61.80 2fwu s SER 654 CO -0.01 -1.31 0.42 1.07 1.20 0.00 0.00 173.24 174.60 2fwu n THR 655 N 6.60 -1.00 -2.75 6.45 5.66 -1.26 -5.10 114.28 122.89 2fwu n THR 655 Ca 0.18 -3.06 -0.43 0.00 -3.05 0.00 0.00 64.05 57.69 2fwu n THR 655 Cb 0.46 -1.23 -0.03 0.00 -1.55 0.00 0.00 70.33 67.98 2fwu n THR 655 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2fwu s VAL 656 N 0.12 4.41 -2.00 1.08 0.11 -1.26 -5.19 120.40 117.67 2fwu s VAL 656 Ca 0.33 0.93 0.28 0.00 -2.93 0.00 0.00 61.98 60.58 2fwu s VAL 656 Cb 0.04 -4.48 0.80 0.00 -1.53 0.00 0.00 36.38 31.21 2fwu s VAL 656 CO -0.17 -0.86 2.01 -0.67 -3.33 0.00 0.00 175.10 172.08