#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 0.39 -3.65 1.57 0.00 -1.25 -4.36 120.51 113.22 2fwu n ALA 502 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 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 -1.38 0.32 -0.23 0.00 0.00 -1.26 -4.55 107.32 100.21 2fwu s GLY 503 Ca 0.00 3.48 0.02 0.00 0.00 0.00 0.00 44.72 48.21 2fwu s GLY 503 CO 0.00 2.55 -0.13 -0.42 0.00 0.00 0.00 173.10 175.10 2fwu s ILE 504 N 0.98 2.25 -0.15 0.90 1.09 -1.26 -2.52 121.20 122.48 2fwu s ILE 504 Ca -0.06 -1.32 0.00 0.00 -1.10 0.00 0.00 60.65 58.17 2fwu s ILE 504 Cb -0.03 -2.18 0.02 0.00 -1.06 0.00 0.00 42.46 39.21 2fwu s ILE 504 CO -0.12 0.19 -0.15 -0.36 -0.10 0.00 0.00 174.94 174.40 2fwu s PHE 505 N 1.20 2.26 0.20 3.97 0.08 -1.25 -2.18 117.98 122.25 2fwu s PHE 505 Ca -0.03 -1.29 -0.10 0.00 0.12 0.00 0.00 56.93 55.63 2fwu s PHE 505 Cb -0.17 -1.64 -0.01 0.00 -0.57 0.00 0.00 43.02 40.63 2fwu s PHE 505 CO -0.07 -0.69 0.35 -0.08 -0.10 0.00 0.00 175.22 174.62 2fwu s THR 506 N 1.46 0.03 0.29 0.64 -1.32 -1.25 -0.18 115.64 115.31 2fwu s THR 506 Ca 0.05 -1.44 0.05 0.00 -1.21 0.00 0.00 61.69 59.14 2fwu s THR 506 Cb -0.13 -2.04 -0.02 0.00 -1.51 0.00 0.00 72.50 68.80 2fwu s THR 506 CO -0.11 -0.14 0.42 -0.36 -2.21 0.00 0.00 174.62 172.22 2fwu s PHE 507 N -4.01 3.30 -0.09 9.09 0.08 -1.18 -1.81 117.98 123.37 2fwu s PHE 507 Ca 0.21 -0.09 0.17 0.00 0.12 0.00 0.00 56.93 57.35 2fwu s PHE 507 Cb 0.02 -1.78 -0.25 0.00 -0.57 0.00 0.00 43.02 40.44 2fwu s PHE 507 CO 0.05 0.22 0.25 -0.85 -0.10 0.00 0.00 175.22 174.79 2fwu n GLU 508 N -1.54 0.85 -4.31 0.44 -0.00 -1.26 -4.79 120.64 110.03 2fwu n GLU 508 Ca -0.05 -0.10 -0.33 0.00 -0.00 0.00 0.00 57.16 56.68 2fwu n GLU 508 Cb 0.57 -1.44 -0.15 0.00 -0.00 0.00 0.00 31.44 30.42 2fwu n GLU 508 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.13 175.30 2fwu s GLU 509 N -2.90 3.18 0.00 3.44 -1.05 -1.26 -4.99 118.70 115.12 2fwu s GLU 509 Ca -0.07 -0.75 0.29 0.00 -0.15 0.00 0.00 54.97 54.28 2fwu s GLU 509 Cb 0.09 -2.67 1.19 0.00 -0.44 0.00 0.00 34.13 32.29 2fwu s GLU 509 CO 0.74 -0.09 1.89 -0.35 0.95 0.00 0.00 175.26 178.41 2fwu n PRO 510 N 4.35 0.00 -3.82 -4.83 -0.04 -1.26 -4.75 135.00 124.65 2fwu n PRO 510 Ca -0.19 -0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.13 2fwu n PRO 510 Cb 0.51 -1.50 -0.14 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 -3.00 -0.02 0.02 0.52 1.01 -1.26 0.21 120.40 117.88 2fwu s VAL 511 Ca 0.14 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.22 2fwu s VAL 511 Cb 0.19 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.45 2fwu s VAL 511 CO 0.54 0.03 -0.06 0.28 0.00 0.00 0.00 175.10 175.89 2fwu s THR 512 N 0.47 0.42 -0.11 3.92 -1.32 -0.06 -4.90 115.64 114.07 2fwu s THR 512 Ca -0.04 -0.77 0.02 0.00 -1.21 0.00 0.00 61.69 59.70 2fwu s THR 512 Cb -0.05 -0.46 -0.01 0.00 -1.51 0.00 0.00 72.50 70.46 2fwu s THR 512 CO -0.02 -0.24 -0.18 -1.00 -2.21 0.00 0.00 174.62 170.98 2fwu s HIS 513 N -0.97 2.68 0.21 9.09 3.76 -1.26 -0.47 115.29 128.33 2fwu s HIS 513 Ca -0.07 -0.75 0.07 0.00 -0.15 0.00 0.00 55.06 54.16 2fwu s HIS 513 Cb -0.07 -1.76 -0.05 0.00 1.11 0.00 0.00 32.58 31.81 2fwu s HIS 513 CO 0.00 -0.25 -0.12 0.14 -0.85 0.00 0.00 174.74 173.66 2fwu s VAL 514 N 0.21 1.63 0.54 -0.90 -7.23 -0.60 -4.97 120.40 109.07 2fwu s VAL 514 Ca -0.11 -2.18 -0.17 0.00 -1.81 0.00 0.00 61.98 57.71 2fwu s VAL 514 Cb -0.16 -2.09 -0.06 0.00 0.56 0.00 0.00 36.38 34.63 2fwu s VAL 514 CO 0.06 -0.56 1.03 -0.44 -0.31 0.00 0.00 175.10 174.88 2fwu s SER 515 N -3.31 6.15 0.12 4.85 0.01 -1.26 -2.38 113.70 117.88 2fwu s SER 515 Ca 0.23 1.80 0.17 0.00 1.31 0.00 0.00 55.95 59.46 2fwu s SER 515 Cb 0.01 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.62 2fwu s SER 515 CO 0.07 -0.91 0.96 -0.08 0.41 0.00 0.00 173.24 173.69 2fwu h GLU 516 N 0.93 0.00 -2.83 12.44 4.81 -1.65 -3.36 114.58 124.92 2fwu h GLU 516 Ca -0.48 0.00 -0.78 0.00 -0.13 0.00 0.00 59.36 57.97 2fwu h GLU 516 Cb 1.21 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 30.29 2fwu h GLU 516 CO 0.59 0.28 0.61 0.45 -0.73 0.00 0.00 179.01 180.20 2fwu n SER 517 N -2.92 6.09 -4.09 1.04 2.88 -1.26 -4.76 113.62 110.60 2fwu n SER 517 Ca -0.06 -3.42 -0.13 0.00 -1.33 0.00 0.00 58.87 53.93 2fwu n SER 517 Cb 0.78 -1.19 -0.11 0.00 -0.75 0.00 0.00 64.21 62.94 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 -2.75 0.59 -0.12 2.46 2.07 -1.26 -5.05 121.20 117.13 2fwu s ILE 518 Ca 0.32 -1.30 -0.06 0.00 -1.41 0.00 0.00 60.65 58.20 2fwu s ILE 518 Cb 0.06 -0.88 -0.03 0.00 0.13 0.00 0.00 42.46 41.74 2fwu s ILE 518 CO 0.09 -0.50 -0.04 1.23 -1.91 0.00 0.00 174.94 173.81 2fwu h GLY 519 N 4.11 0.00 -5.99 1.50 0.00 -1.91 -3.37 103.07 97.42 2fwu h GLY 519 Ca -0.36 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.40 2fwu h GLY 519 CO 0.47 0.00 -0.83 -0.42 0.00 0.00 0.00 176.54 175.75 2fwu s ILE 520 N -1.92 1.42 -0.15 2.60 -1.09 -1.26 -1.27 121.20 119.53 2fwu s ILE 520 Ca -0.08 -0.60 -0.07 0.00 -2.23 0.00 0.00 60.65 57.66 2fwu s ILE 520 Cb 0.01 -1.30 -0.04 0.00 -1.58 0.00 0.00 42.46 39.55 2fwu s ILE 520 CO 0.15 0.42 0.10 0.00 -1.23 0.00 0.00 174.94 174.39 2fwu s MET 521 N 0.96 3.73 -0.04 2.79 0.23 -0.84 -4.91 119.30 121.21 2fwu s MET 521 Ca -0.08 -0.23 0.06 0.00 -1.03 0.00 0.00 55.69 54.41 2fwu s MET 521 Cb -0.15 -3.22 -0.01 0.00 -1.53 0.00 0.00 34.83 29.92 2fwu s MET 521 CO -0.01 0.52 -0.24 -1.21 -2.03 0.00 0.00 175.02 172.06 2fwu s GLU 522 N -0.30 2.17 -0.03 3.16 2.02 -1.25 -2.30 118.70 122.16 2fwu s GLU 522 Ca 0.10 -0.85 0.07 0.00 0.02 0.00 0.00 54.97 54.31 2fwu s GLU 522 Cb -0.12 -1.95 -0.02 0.00 0.10 0.00 0.00 34.13 32.15 2fwu s GLU 522 CO 0.01 0.43 -0.24 0.08 0.02 0.00 0.00 175.26 175.56 2fwu s VAL 523 N -0.33 1.94 -0.33 2.63 1.01 -1.23 -4.93 120.40 119.15 2fwu s VAL 523 Ca 0.02 -1.03 -0.22 0.00 0.00 0.00 0.00 61.98 60.75 2fwu s VAL 523 Cb -0.11 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.65 2fwu s VAL 523 CO 0.01 0.55 0.73 -0.54 0.00 0.00 0.00 175.10 175.85 2fwu s LYS 524 N -0.41 3.85 -0.11 2.72 -0.14 -1.26 -3.14 119.74 121.25 2fwu s LYS 524 Ca 0.05 0.38 -0.11 0.00 -1.36 0.00 0.00 55.97 54.92 2fwu s LYS 524 Cb -0.11 -3.76 -0.05 0.00 -1.68 0.00 0.00 37.83 32.23 2fwu s LYS 524 CO 0.01 -0.71 0.25 0.08 -0.76 0.00 0.00 175.35 174.21 2fwu s VAL 525 N 2.89 5.32 0.21 3.17 1.01 -0.06 -4.45 120.40 128.50 2fwu s VAL 525 Ca 0.30 0.46 -0.30 0.00 0.00 0.00 0.00 61.98 62.44 2fwu s VAL 525 Cb -0.14 -3.56 -0.08 0.00 0.00 0.00 0.00 36.38 32.60 2fwu s VAL 525 CO 0.14 0.51 0.95 -0.76 0.00 0.00 0.00 175.10 175.95 2fwu s LEU 526 N -0.39 4.61 0.51 3.92 2.01 -0.75 -2.70 118.68 125.89 2fwu s LEU 526 Ca 0.17 1.94 -0.06 0.00 0.01 0.00 0.00 54.13 56.18 2fwu s LEU 526 Cb -0.13 -3.61 -0.03 0.00 0.01 0.00 0.00 46.19 42.43 2fwu s LEU 526 CO 0.05 0.10 0.82 -0.60 1.01 0.00 0.00 176.35 177.73 2fwu s ARG 527 N -0.94 3.51 0.51 1.70 3.52 -1.26 -3.83 118.95 122.16 2fwu s ARG 527 Ca 0.42 0.26 -0.22 0.00 -0.13 0.00 0.00 55.73 56.06 2fwu s ARG 527 Cb -0.26 -2.33 -0.06 0.00 -1.56 0.00 0.00 34.95 30.74 2fwu s ARG 527 CO 0.32 -0.28 1.25 -0.08 -0.81 0.00 0.00 175.30 175.70 2fwu s THR 528 N -2.81 2.62 0.12 4.11 -1.32 -0.93 -4.83 115.64 112.60 2fwu s THR 528 Ca 0.49 0.46 -0.18 0.00 -1.21 0.00 0.00 61.69 61.25 2fwu s THR 528 Cb -0.10 -3.23 -0.04 0.00 -1.51 0.00 0.00 72.50 67.62 2fwu s THR 528 CO 0.46 -0.01 1.70 -1.28 -2.21 0.00 0.00 174.62 173.27 2fwu h SER 529 N 1.68 0.41 -3.43 8.08 0.87 -1.95 -3.41 113.55 115.80 2fwu h SER 529 Ca -0.50 -0.12 -0.67 0.00 -1.23 0.00 0.00 61.79 59.27 2fwu h SER 529 Cb 1.27 -0.11 -0.30 0.00 -0.44 0.00 0.00 62.40 62.83 2fwu h SER 529 CO 0.58 0.42 -0.74 -0.83 -0.53 0.00 0.00 176.83 175.73 2fwu s GLY 530 N -2.75 1.61 -0.10 5.77 0.00 -1.26 -5.06 107.32 105.53 2fwu s GLY 530 Ca -0.13 -1.34 -0.01 0.00 0.00 0.00 0.00 44.72 43.24 2fwu s GLY 530 CO 0.73 0.47 -0.05 0.00 0.00 0.00 0.00 173.10 174.25 2fwu s ALA 531 N 1.39 1.10 -0.78 3.20 0.00 -1.26 -4.22 121.76 121.19 2fwu s ALA 531 Ca 0.03 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.61 2fwu s ALA 531 Cb -0.15 -0.86 0.23 0.00 0.00 0.00 0.00 23.12 22.34 2fwu s ALA 531 CO -0.04 -0.44 0.80 0.54 0.00 0.00 0.00 175.76 176.62 2fwu n ARG 532 N 5.02 2.66 0.00 0.00 5.12 -1.26 -4.68 116.66 123.52 2fwu n ARG 532 Ca -0.10 -4.57 0.00 0.00 -1.93 0.00 0.00 57.85 51.24 2fwu n ARG 532 Cb 0.50 -2.34 0.00 0.00 -1.16 0.00 0.00 32.46 29.46 2fwu n ARG 532 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2fwu n GLY 533 N 1.54 0.21 3.41 -0.13 0.00 -1.26 -4.92 105.19 104.03 2fwu n GLY 533 Ca 0.25 -1.79 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 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 -4.00 4.00 -0.07 1.61 3.04 -1.26 -0.52 114.94 117.74 2fwu s ASN 534 Ca 0.00 -0.28 0.03 0.00 0.04 0.00 0.00 52.86 52.65 2fwu s ASN 534 Cb 0.00 -1.30 0.01 0.00 -1.54 0.00 0.00 41.25 38.42 2fwu s ASN 534 CO 0.00 0.24 -0.16 -0.69 -3.04 0.00 0.00 177.10 173.45 2fwu s VAL 535 N -0.09 1.38 -0.22 -5.21 1.01 0.82 -0.48 120.40 117.61 2fwu s VAL 535 Ca -0.02 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 2fwu s VAL 535 Cb -0.14 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 2fwu s VAL 535 CO 0.04 0.41 0.20 -0.63 0.00 0.00 0.00 175.10 175.11 2fwu s ILE 536 N 0.43 5.34 -0.32 2.22 -1.09 0.21 -0.70 121.20 127.30 2fwu s ILE 536 Ca -0.12 0.29 -0.01 0.00 -2.23 0.00 0.00 60.65 58.57 2fwu s ILE 536 Cb -0.15 -3.54 0.07 0.00 -1.58 0.00 0.00 42.46 37.26 2fwu s ILE 536 CO 0.04 0.34 0.02 -0.69 -1.23 0.00 0.00 174.94 173.43 2fwu s VAL 537 N 0.98 2.84 0.41 2.92 1.01 0.45 -0.71 120.40 128.31 2fwu s VAL 537 Ca 0.10 -1.64 -0.24 0.00 0.00 0.00 0.00 61.98 60.20 2fwu s VAL 537 Cb -0.13 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.42 2fwu s VAL 537 CO 0.04 -0.25 1.09 -2.16 0.00 0.00 0.00 175.10 173.82 2fwu s PRO 538 N 1.17 4.06 0.11 2.72 0.04 -1.26 0.16 135.00 142.00 2fwu s PRO 538 Ca -0.02 1.60 -0.10 0.00 0.04 0.00 0.00 61.00 62.53 2fwu s PRO 538 Cb -0.20 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.82 2fwu s PRO 538 CO -0.03 -0.25 0.24 1.52 0.04 0.00 0.00 177.00 178.52 2fwu s TYR 539 N -1.61 0.17 0.03 0.56 1.13 0.28 -0.22 117.35 117.69 2fwu s TYR 539 Ca 0.59 -0.57 -0.25 0.00 -1.41 0.00 0.00 57.07 55.43 2fwu s TYR 539 Cb -0.24 -0.02 0.06 0.00 -1.10 0.00 0.00 41.96 40.66 2fwu s TYR 539 CO 0.30 -0.61 0.58 -1.59 -2.51 0.00 0.00 175.55 171.72 2fwu s LYS 540 N -3.88 1.07 -0.13 -3.49 0.00 -1.05 -1.55 119.74 110.72 2fwu s LYS 540 Ca 0.08 -0.12 -0.19 0.00 0.00 0.00 0.00 55.97 55.74 2fwu s LYS 540 Cb 0.04 0.49 -0.04 0.00 0.00 0.00 0.00 37.83 38.33 2fwu s LYS 540 CO -0.08 -0.38 0.53 0.95 0.00 0.00 0.00 175.35 176.36 2fwu s THR 541 N -2.23 5.14 -0.30 3.79 -4.23 -1.17 -2.73 115.64 113.92 2fwu s THR 541 Ca -0.06 1.05 -0.16 0.00 -1.18 0.00 0.00 61.69 61.34 2fwu s THR 541 Cb -0.01 -3.87 -0.02 0.00 1.34 0.00 0.00 72.50 69.94 2fwu s THR 541 CO 0.00 0.28 0.42 -0.63 -0.54 0.00 0.00 174.62 174.15 2fwu s ILE 542 N 0.88 5.12 0.08 2.99 1.09 0.12 -4.90 121.20 126.58 2fwu s ILE 542 Ca 0.28 0.46 -0.25 0.00 -1.10 0.00 0.00 60.65 60.03 2fwu s ILE 542 Cb -0.16 -3.80 -0.16 0.00 -1.06 0.00 0.00 42.46 37.28 2fwu s ILE 542 CO 0.11 0.01 1.67 1.05 -0.10 0.00 0.00 174.94 177.68 2fwu h GLU 543 N 8.28 -0.19 0.00 2.79 -0.00 -1.86 -1.73 114.58 121.87 2fwu h GLU 543 Ca -0.30 0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.07 2fwu h GLU 543 Cb 1.15 0.04 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 2fwu h GLU 543 CO 0.69 -0.09 0.00 0.41 -0.00 0.00 0.00 179.01 180.02 2fwu n GLY 544 N -1.05 1.13 0.00 1.06 0.00 -1.26 -1.16 105.19 103.90 2fwu n GLY 544 Ca -0.09 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.44 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 0.00 -3.95 2.61 5.66 -1.25 -5.05 114.28 112.30 2fwu n THR 545 Ca 0.00 -0.36 -0.25 0.00 -3.05 0.00 0.00 64.05 60.39 2fwu n THR 545 Cb 0.00 1.23 -0.03 0.00 -1.55 0.00 0.00 70.33 69.98 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 -0.12 4.10 -0.15 1.79 0.00 -0.31 -4.81 121.76 122.26 2fwu s ALA 546 Ca 0.00 -1.56 -0.01 0.00 0.00 0.00 0.00 51.96 50.39 2fwu s ALA 546 Cb 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 2fwu s ALA 546 CO 0.00 -0.30 -0.10 1.03 0.00 0.00 0.00 175.76 176.39 2fwu s ARG 547 N -4.12 3.45 0.38 0.00 3.00 -1.26 -4.73 118.95 115.67 2fwu s ARG 547 Ca 0.37 -0.64 -0.04 0.00 0.00 0.00 0.00 55.73 55.41 2fwu s ARG 547 Cb -0.00 -2.74 0.08 0.00 0.00 0.00 0.00 34.95 32.29 2fwu s ARG 547 CO 0.22 0.17 0.52 0.41 0.00 0.00 0.00 175.30 176.61 2fwu n GLY 548 N 3.67 -0.55 2.38 -3.53 0.00 -1.26 -0.23 105.19 105.68 2fwu n GLY 548 Ca -0.18 -1.80 -0.07 0.00 0.00 0.00 0.00 46.02 43.97 2fwu n GLY 548 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fwu n GLY 549 N 1.45 0.85 1.84 -0.02 0.00 -1.22 -1.80 105.19 106.30 2fwu n GLY 549 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.41 0.72 0.16 -0.02 0.00 0.31 -4.89 105.19 100.05 2fwu n GLY 550 Ca -0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 2fwu n GLY 550 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fwu h GLU 551 N 2.35 0.47 0.00 1.61 4.81 -1.47 -3.42 114.58 118.93 2fwu h GLU 551 Ca 0.00 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2fwu h GLU 551 Cb 0.00 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2fwu h GLU 551 CO 0.00 1.06 -0.39 -3.47 -0.73 0.00 0.00 179.01 175.48 2fwu n ASP 552 N -4.24 1.93 -3.94 1.04 2.03 -0.04 -4.95 116.55 108.38 2fwu n ASP 552 Ca -0.09 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.14 2fwu n ASP 552 Cb 0.61 0.21 -0.09 0.00 -0.72 0.00 0.00 41.12 41.14 2fwu n ASP 552 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 2fwu s PHE 553 N -1.32 0.26 -0.27 -0.67 -0.71 0.68 -3.60 117.98 112.35 2fwu s PHE 553 Ca 0.00 -0.69 -0.20 0.00 -1.04 0.00 0.00 56.93 55.00 2fwu s PHE 553 Cb 0.00 -0.17 -0.02 0.00 -1.21 0.00 0.00 43.02 41.62 2fwu s PHE 553 CO 0.00 -0.44 0.62 -2.00 -1.34 0.00 0.00 175.22 172.06 2fwu s GLU 554 N -3.48 4.06 -0.71 1.99 -6.30 -0.68 -0.53 118.70 113.05 2fwu s GLU 554 Ca 0.02 0.48 -0.26 0.00 -2.50 0.00 0.00 54.97 52.71 2fwu s GLU 554 Cb 0.04 -3.67 0.01 0.00 0.00 0.00 0.00 34.13 30.51 2fwu s GLU 554 CO -0.09 -0.44 1.55 0.34 0.02 0.00 0.00 175.26 176.64 2fwu s ASP 555 N 1.51 5.78 -0.73 -1.70 2.15 -1.26 -4.46 116.67 117.96 2fwu s ASP 555 Ca 0.26 -0.20 -0.21 0.00 0.43 0.00 0.00 52.55 52.83 2fwu s ASP 555 Cb -0.15 -2.55 0.10 0.00 -0.30 0.00 0.00 42.92 40.01 2fwu s ASP 555 CO 0.09 -2.08 0.96 0.28 -0.17 0.00 0.00 175.17 174.26 2fwu s THR 556 N 7.23 4.54 -0.38 1.71 -1.32 -1.26 -4.85 115.64 121.32 2fwu s THR 556 Ca 0.50 -0.85 -0.07 0.00 -1.21 0.00 0.00 61.69 60.07 2fwu s THR 556 Cb -0.09 -4.68 0.06 0.00 -1.51 0.00 0.00 72.50 66.29 2fwu s THR 556 CO 0.15 -1.41 0.17 0.00 -2.21 0.00 0.00 174.62 171.32 2fwu n GLY 558 N 4.80 3.64 2.90 0.00 0.00 -0.59 -4.99 105.19 110.95 2fwu n GLY 558 Ca -0.10 -0.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.92 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 1.22 0.07 0.03 1.61 2.02 -1.26 -0.56 118.70 121.82 2fwu s GLU 559 Ca 0.00 0.31 -0.19 0.00 0.02 0.00 0.00 54.97 55.11 2fwu s GLU 559 Cb 0.00 -0.16 -0.06 0.00 0.10 0.00 0.00 34.13 34.01 2fwu s GLU 559 CO 0.00 -0.15 0.55 -0.51 0.02 0.00 0.00 175.26 175.17 2fwu s LEU 560 N 1.02 4.48 -0.42 1.80 1.43 0.12 -4.88 118.68 122.23 2fwu s LEU 560 Ca -0.08 1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 54.07 2fwu s LEU 560 Cb -0.11 -2.85 0.06 0.00 0.03 0.00 0.00 46.19 43.33 2fwu s LEU 560 CO -0.05 0.22 0.27 -0.70 0.23 0.00 0.00 176.35 176.33 2fwu s GLU 561 N -0.75 2.75 -0.18 1.70 2.12 -1.26 -0.41 118.70 122.67 2fwu s GLU 561 Ca 0.29 -1.32 -0.09 0.00 0.36 0.00 0.00 54.97 54.20 2fwu s GLU 561 Cb -0.18 -3.85 -0.05 0.00 0.26 0.00 0.00 34.13 30.31 2fwu s GLU 561 CO 0.17 -0.89 0.13 -0.06 -0.54 0.00 0.00 175.26 174.07 2fwu s PHE 562 N 1.51 3.45 0.28 5.30 0.08 0.13 -4.98 117.98 123.75 2fwu s PHE 562 Ca 0.03 0.37 0.10 0.00 0.12 0.00 0.00 56.93 57.55 2fwu s PHE 562 Cb -0.22 -2.11 -0.05 0.00 -0.57 0.00 0.00 43.02 40.07 2fwu s PHE 562 CO 0.05 0.39 -0.08 -0.65 -0.10 0.00 0.00 175.22 174.82 2fwu s GLN 563 N 0.05 2.00 0.44 0.44 -0.21 -1.26 -0.13 119.66 120.99 2fwu s GLN 563 Ca 0.09 -1.62 0.23 0.00 0.02 0.00 0.00 55.36 54.08 2fwu s GLN 563 Cb -0.11 -1.96 0.96 0.00 1.00 0.00 0.00 33.01 32.90 2fwu s GLN 563 CO -0.01 0.31 1.85 -2.95 -2.12 0.00 0.00 175.29 172.38 2fwu h ASN 564 N 2.03 0.00 0.28 5.90 -1.07 -1.08 -2.56 115.58 119.08 2fwu h ASN 564 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.95 2fwu h ASN 564 Cb 1.25 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 2fwu h ASN 564 CO 0.61 0.25 -0.34 -0.67 0.07 0.00 0.00 177.43 177.36 2fwu n ASP 565 N -3.53 0.95 -4.46 6.14 2.03 -1.26 -4.87 116.55 111.55 2fwu n ASP 565 Ca -0.01 -0.77 -0.27 0.00 0.52 0.00 0.00 54.79 54.27 2fwu n ASP 565 Cb 0.41 0.20 -0.11 0.00 -0.72 0.00 0.00 41.12 40.89 2fwu n ASP 565 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2fwu s GLU 566 N -2.63 1.63 0.28 -0.67 2.12 -0.97 -5.14 118.70 113.33 2fwu s GLU 566 Ca 0.21 -1.50 0.07 0.00 0.36 0.00 0.00 54.97 54.11 2fwu s GLU 566 Cb 0.19 -1.90 -0.06 0.00 0.26 0.00 0.00 34.13 32.62 2fwu s GLU 566 CO 0.57 0.40 -0.08 0.96 -0.54 0.00 0.00 175.26 176.57 2fwu s ILE 567 N -1.76 1.77 0.32 -3.70 -4.36 -1.26 -4.48 121.20 107.73 2fwu s ILE 567 Ca 0.22 -2.15 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 2fwu s ILE 567 Cb -0.08 -2.44 0.00 0.00 1.25 0.00 0.00 42.46 41.20 2fwu s ILE 567 CO 0.11 -0.31 0.00 0.55 0.24 0.00 0.00 174.94 175.53 2fwu n VAL 568 N -0.60 -0.95 -4.14 8.37 3.14 -1.26 -5.03 118.33 117.86 2fwu n VAL 568 Ca -0.06 0.61 -0.10 0.00 -2.96 0.00 0.00 64.34 61.83 2fwu n VAL 568 Cb 0.63 -0.97 -0.10 0.00 -1.06 0.00 0.00 33.84 32.34 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 -4.71 1.00 -0.02 1.45 -0.14 -1.10 -4.95 119.74 111.28 2fwu s LYS 569 Ca 0.00 -1.45 0.01 0.00 -1.36 0.00 0.00 55.97 53.16 2fwu s LYS 569 Cb 0.00 0.26 0.02 0.00 -1.68 0.00 0.00 37.83 36.43 2fwu s LYS 569 CO 0.00 -0.30 -0.01 0.95 -0.76 0.00 0.00 175.35 175.22 2fwu s THR 570 N -4.06 0.22 -0.20 2.17 -4.23 -1.25 -0.88 115.64 107.41 2fwu s THR 570 Ca 0.26 -0.01 -0.25 0.00 -1.18 0.00 0.00 61.69 60.52 2fwu s THR 570 Cb 0.07 -0.27 -0.01 0.00 1.34 0.00 0.00 72.50 73.63 2fwu s THR 570 CO 0.04 0.12 0.82 -0.63 -0.54 0.00 0.00 174.62 174.43 2fwu s ILE 571 N 0.62 4.87 -0.43 2.99 1.09 -1.19 -4.87 121.20 124.28 2fwu s ILE 571 Ca -0.06 1.59 -0.16 0.00 -1.10 0.00 0.00 60.65 60.92 2fwu s ILE 571 Cb -0.09 -4.12 0.03 0.00 -1.06 0.00 0.00 42.46 37.21 2fwu s ILE 571 CO -0.01 -0.01 0.39 -0.94 -0.10 0.00 0.00 174.94 174.28 2fwu s SER 572 N 1.22 6.16 -0.20 3.58 1.04 -1.26 -3.56 113.70 120.68 2fwu s SER 572 Ca 0.37 -0.86 -0.04 0.00 0.48 0.00 0.00 55.95 55.90 2fwu s SER 572 Cb -0.16 -2.20 -0.02 0.00 0.10 0.00 0.00 66.02 63.74 2fwu s SER 572 CO 0.10 -0.56 -0.03 -0.69 0.98 0.00 0.00 173.24 173.04 2fwu s VAL 573 N 1.93 3.61 -0.37 5.02 1.01 -0.97 -4.89 120.40 125.75 2fwu s VAL 573 Ca 0.09 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 2fwu s VAL 573 Cb -0.19 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.58 2fwu s VAL 573 CO 0.11 0.44 1.22 -0.75 0.00 0.00 0.00 175.10 176.12 2fwu s LYS 574 N 1.08 3.85 -0.07 2.72 2.47 -1.26 -1.98 119.74 126.56 2fwu s LYS 574 Ca 0.01 0.97 -0.23 0.00 -1.56 0.00 0.00 55.97 55.16 2fwu s LYS 574 Cb -0.15 -3.87 -0.04 0.00 -1.46 0.00 0.00 37.83 32.31 2fwu s LYS 574 CO 0.00 -1.21 0.67 0.08 0.16 0.00 0.00 175.35 175.06 2fwu s VAL 575 N 4.38 5.05 0.15 4.02 1.01 -0.40 -1.68 120.40 132.94 2fwu s VAL 575 Ca 0.52 1.38 -0.05 0.00 0.00 0.00 0.00 61.98 63.83 2fwu s VAL 575 Cb -0.12 -4.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 2fwu s VAL 575 CO 0.25 0.27 0.40 -0.63 0.00 0.00 0.00 175.10 175.39 2fwu s ILE 576 N 0.71 5.14 0.32 2.22 -1.09 -1.24 -4.71 121.20 122.56 2fwu s ILE 576 Ca 0.36 0.08 -0.29 0.00 -2.23 0.00 0.00 60.65 58.57 2fwu s ILE 576 Cb -0.17 -3.62 -0.10 0.00 -1.58 0.00 0.00 42.46 36.98 2fwu s ILE 576 CO 0.17 0.02 1.26 -0.62 -1.23 0.00 0.00 174.94 174.55 2fwu s ASP 577 N -2.43 6.88 0.96 3.58 2.15 -1.26 -4.85 116.67 121.69 2fwu s ASP 577 Ca 0.42 2.59 -0.11 0.00 0.43 0.00 0.00 52.55 55.88 2fwu s ASP 577 Cb -0.12 -2.64 0.17 0.00 -0.30 0.00 0.00 42.92 40.03 2fwu s ASP 577 CO 0.24 -0.45 1.02 -0.67 -0.17 0.00 0.00 175.17 175.14 2fwu n ASP 578 N 0.94 0.21 0.00 -0.34 -0.08 -1.26 -4.95 116.55 111.07 2fwu n ASP 578 Ca -0.00 -1.45 0.00 0.00 -1.51 0.00 0.00 54.79 51.83 2fwu n ASP 578 Cb 0.42 -0.77 0.00 0.00 2.34 0.00 0.00 41.12 43.12 2fwu n ASP 578 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 2fwu n GLU 579 N -3.13 0.00 -0.80 -0.67 0.00 -1.26 -5.18 120.64 109.61 2fwu n GLU 579 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.29 2fwu n GLU 579 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.90 2fwu n GLU 579 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 2fwu n GLU 580 N -1.01 1.37 -1.91 3.44 0.00 -1.26 -5.07 120.64 116.20 2fwu n GLU 580 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.81 2fwu n GLU 580 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 31.44 31.48 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 1.17 2.37 0.12 -1.84 -0.85 -1.26 -5.02 117.35 112.04 2fwu s TYR 581 Ca 0.00 1.53 0.05 0.00 -0.52 0.00 0.00 57.07 58.14 2fwu s TYR 581 Cb 0.00 -3.44 -0.04 0.00 0.38 0.00 0.00 41.96 38.86 2fwu s TYR 581 CO 0.00 -2.20 -0.13 -1.21 -1.52 0.00 0.00 175.55 170.49 2fwu s GLU 582 N -3.49 0.98 0.18 -3.49 2.02 -1.26 -5.12 118.70 108.52 2fwu s GLU 582 Ca 0.76 -1.22 0.02 0.00 0.02 0.00 0.00 54.97 54.55 2fwu s GLU 582 Cb -0.29 -0.81 -0.01 0.00 0.10 0.00 0.00 34.13 33.12 2fwu s GLU 582 CO 0.35 0.15 0.09 0.36 0.02 0.00 0.00 175.26 176.23 2fwu n LYS 583 N 0.54 0.57 -2.22 1.61 2.85 -1.26 -5.06 118.16 115.19 2fwu n LYS 583 Ca -0.16 -1.60 -0.42 0.00 -1.05 0.00 0.00 58.31 55.08 2fwu n LYS 583 Cb 0.57 1.02 -0.03 0.00 -0.65 0.00 0.00 35.03 35.94 2fwu n LYS 583 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 2fwu s ASN 584 N -2.15 5.99 0.01 -5.58 2.47 -1.26 -4.96 114.94 109.46 2fwu s ASN 584 Ca 0.13 0.73 0.05 0.00 0.42 0.00 0.00 52.86 54.18 2fwu s ASN 584 Cb 0.01 -2.54 -0.03 0.00 -1.45 0.00 0.00 41.25 37.24 2fwu s ASN 584 CO 0.09 -1.73 -0.12 -1.59 -3.72 0.00 0.00 177.10 170.03 2fwu s LYS 585 N 5.62 2.38 -0.05 0.43 0.00 -1.26 -5.00 119.74 121.85 2fwu s LYS 585 Ca 0.65 -0.80 -0.24 0.00 0.00 0.00 0.00 55.97 55.57 2fwu s LYS 585 Cb -0.15 -2.37 0.05 0.00 0.00 0.00 0.00 37.83 35.36 2fwu s LYS 585 CO 0.29 0.59 0.54 -0.08 0.00 0.00 0.00 175.35 176.68 2fwu s THR 586 N -0.92 0.02 0.01 3.79 -1.32 -1.26 -2.66 115.64 113.30 2fwu s THR 586 Ca 0.15 -0.17 0.09 0.00 -1.21 0.00 0.00 61.69 60.55 2fwu s THR 586 Cb -0.11 -0.84 -0.02 0.00 -1.51 0.00 0.00 72.50 70.02 2fwu s THR 586 CO 0.05 -0.09 -0.26 0.72 -2.21 0.00 0.00 174.62 172.83 2fwu s PHE 587 N -1.09 2.31 -0.16 9.09 -0.12 -1.04 -3.96 117.98 123.02 2fwu s PHE 587 Ca -0.11 -0.42 -0.10 0.00 -0.05 0.00 0.00 56.93 56.25 2fwu s PHE 587 Cb -0.02 -1.44 -0.05 0.00 -0.63 0.00 0.00 43.02 40.88 2fwu s PHE 587 CO 0.07 0.04 0.18 -0.06 -0.05 0.00 0.00 175.22 175.40 2fwu s PHE 588 N -0.70 3.49 -0.18 3.49 0.08 -0.65 -0.97 117.98 122.54 2fwu s PHE 588 Ca 0.11 0.47 -0.05 0.00 0.12 0.00 0.00 56.93 57.58 2fwu s PHE 588 Cb -0.10 -2.14 -0.03 0.00 -0.57 0.00 0.00 43.02 40.19 2fwu s PHE 588 CO 0.01 0.43 -0.00 -1.17 -0.10 0.00 0.00 175.22 174.38 2fwu s LEU 589 N -0.11 3.33 -0.09 -0.37 1.98 0.13 0.14 118.68 123.70 2fwu s LEU 589 Ca 0.12 -0.14 0.02 0.00 -2.89 0.00 0.00 54.13 51.24 2fwu s LEU 589 Cb -0.12 -1.83 0.02 0.00 0.66 0.00 0.00 46.19 44.92 2fwu s LEU 589 CO 0.02 0.11 -0.12 -0.70 -1.89 0.00 0.00 176.35 173.77 2fwu s GLU 590 N 0.70 1.81 -0.16 1.98 2.12 -1.10 -1.05 118.70 122.99 2fwu s GLU 590 Ca -0.00 -0.42 -0.16 0.00 0.36 0.00 0.00 54.97 54.75 2fwu s GLU 590 Cb -0.14 -1.57 -0.04 0.00 0.26 0.00 0.00 34.13 32.64 2fwu s GLU 590 CO 0.02 -0.05 0.38 0.96 -0.54 0.00 0.00 175.26 176.03 2fwu s ILE 591 N 0.95 5.24 0.00 -3.70 -4.36 -1.26 -2.52 121.20 115.55 2fwu s ILE 591 Ca -0.09 0.73 0.00 0.00 -0.26 0.00 0.00 60.65 61.03 2fwu s ILE 591 Cb -0.15 -3.72 0.00 0.00 1.25 0.00 0.00 42.46 39.84 2fwu s ILE 591 CO 0.00 0.33 0.00 0.61 0.24 0.00 0.00 174.94 176.12 2fwu n GLY 592 N 3.50 1.57 3.64 6.27 0.00 0.70 -4.85 105.19 116.02 2fwu n GLY 592 Ca -0.09 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 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 3.02 4.02 0.68 1.61 2.12 -1.26 -4.67 118.70 124.22 2fwu s GLU 593 Ca 0.00 1.24 -0.11 0.00 0.36 0.00 0.00 54.97 56.46 2fwu s GLU 593 Cb 0.00 -3.80 -0.00 0.00 0.26 0.00 0.00 34.13 30.58 2fwu s GLU 593 CO 0.00 -0.97 1.05 -1.25 -0.54 0.00 0.00 175.26 173.56 2fwu s PRO 594 N 3.86 3.07 -0.01 4.30 0.04 -1.26 -4.45 135.00 140.54 2fwu s PRO 594 Ca 0.52 0.88 0.02 0.00 0.04 0.00 0.00 61.00 62.46 2fwu s PRO 594 Cb -0.16 -2.01 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 2fwu s PRO 594 CO 0.19 -0.99 -0.06 -0.98 0.04 0.00 0.00 177.00 175.20 2fwu s ARG 595 N -5.09 0.51 -0.05 4.56 1.70 0.11 -4.49 118.95 116.21 2fwu s ARG 595 Ca 0.57 -0.20 -0.27 0.00 -0.47 0.00 0.00 55.73 55.36 2fwu s ARG 595 Cb -0.13 -0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 33.72 2fwu s ARG 595 CO 0.55 0.11 0.84 -1.17 -1.08 0.00 0.00 175.30 174.55 2fwu s LEU 596 N -0.04 4.32 0.41 -1.89 1.98 -1.26 -0.62 118.68 121.58 2fwu s LEU 596 Ca 0.01 1.40 0.21 0.00 -2.89 0.00 0.00 54.13 52.86 2fwu s LEU 596 Cb -0.03 -3.32 0.80 0.00 0.66 0.00 0.00 46.19 44.30 2fwu s LEU 596 CO -0.00 -0.22 1.78 0.58 -1.89 0.00 0.00 176.35 176.61 2fwu h VAL 597 N 4.83 0.74 -2.28 1.68 2.07 -1.15 -3.43 116.25 118.72 2fwu h VAL 597 Ca -0.39 -1.32 -0.57 0.00 0.82 0.00 0.00 66.70 65.24 2fwu h VAL 597 Cb 1.20 1.84 -0.10 0.00 -1.52 0.00 0.00 31.29 32.70 2fwu h VAL 597 CO 0.76 0.30 -0.66 -1.83 0.02 0.00 0.00 177.57 176.17 2fwu s GLU 598 N -3.66 2.26 -0.49 1.57 -1.05 -1.26 -5.05 118.70 111.02 2fwu s GLU 598 Ca 0.00 -1.41 -0.26 0.00 -0.15 0.00 0.00 54.97 53.15 2fwu s GLU 598 Cb 0.11 -2.15 0.03 0.00 -0.44 0.00 0.00 34.13 31.68 2fwu s GLU 598 CO 0.66 0.37 0.96 1.41 0.95 0.00 0.00 175.26 179.61 2fwu s MET 599 N -3.59 3.50 -0.35 -4.83 -2.45 -1.26 -4.98 119.30 105.34 2fwu s MET 599 Ca 0.31 0.10 -0.29 0.00 -1.25 0.00 0.00 55.69 54.56 2fwu s MET 599 Cb -0.07 -3.96 0.01 0.00 1.25 0.00 0.00 34.83 32.06 2fwu s MET 599 CO 0.19 -1.32 1.34 -1.12 1.05 0.00 0.00 175.02 175.17 2fwu s SER 600 N 2.45 6.54 -0.04 1.11 0.01 -1.26 -4.96 113.70 117.54 2fwu s SER 600 Ca 0.37 1.04 -0.06 0.00 1.31 0.00 0.00 55.95 58.61 2fwu s SER 600 Cb -0.10 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.60 2fwu s SER 600 CO 0.25 -1.22 0.14 -0.70 0.41 0.00 0.00 173.24 172.12 2fwu s GLU 601 N 4.48 0.25 -0.00 12.44 2.56 -1.26 -4.47 118.70 132.69 2fwu s GLU 601 Ca 0.58 0.06 0.00 0.00 0.00 0.00 0.00 54.97 55.61 2fwu s GLU 601 Cb -0.15 0.11 -0.01 0.00 2.00 0.00 0.00 34.13 36.08 2fwu s GLU 601 CO 0.27 -0.04 0.01 1.17 -0.56 0.00 0.00 175.26 176.11 2fwu n LYS 602 N 2.63 1.32 0.00 4.30 3.00 -1.26 -4.94 118.16 123.21 2fwu n LYS 602 Ca -0.15 -0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 2fwu n LYS 602 Cb 0.58 -1.01 0.00 0.00 0.00 0.00 0.00 35.03 34.60 2fwu n LYS 602 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2fwu n LYS 603 N -1.68 0.00 -3.64 1.64 5.02 -1.26 -5.10 118.16 113.14 2fwu n LYS 603 Ca -0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 2fwu n LYS 603 Cb 0.18 -0.12 -0.07 0.00 -0.02 0.00 0.00 35.03 35.00 2fwu n LYS 603 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2fwu s GLY 604 N -2.55 -0.60 -0.15 0.72 0.00 -1.26 -5.12 107.32 98.35 2fwu s GLY 604 Ca 0.00 2.31 -0.29 0.00 0.00 0.00 0.00 44.72 46.74 2fwu s GLY 604 CO 0.00 2.28 1.51 -0.32 0.00 0.00 0.00 173.10 176.57 2fwu s GLY 605 N 1.49 1.45 0.30 0.20 0.00 -1.26 -4.86 107.32 104.64 2fwu s GLY 605 Ca -0.09 0.60 0.05 0.00 0.00 0.00 0.00 44.72 45.28 2fwu s GLY 605 CO -0.17 2.85 1.74 0.74 0.00 0.00 0.00 173.10 178.26 2fwu h PHE 606 N 9.55 0.42 -3.21 1.90 0.04 -2.00 -3.43 116.94 120.22 2fwu h PHE 606 Ca -0.33 -0.09 -0.37 0.00 2.80 0.00 0.00 57.97 59.98 2fwu h PHE 606 Cb 1.14 -0.10 -0.15 0.00 2.20 0.00 0.00 35.95 39.05 2fwu h PHE 606 CO 0.87 0.63 -0.72 0.95 -0.60 0.00 0.00 178.31 179.44 2fwu s THR 607 N -4.42 1.37 -1.19 -1.55 -4.23 -1.26 -5.02 115.64 99.34 2fwu s THR 607 Ca -0.06 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.38 2fwu s THR 607 Cb 0.14 -1.91 0.17 0.00 1.34 0.00 0.00 72.50 72.24 2fwu s THR 607 CO 0.78 -0.69 0.88 -0.38 -0.54 0.00 0.00 174.62 174.67 2fwu n ILE 608 N -0.25 0.50 -3.42 2.99 5.41 -1.26 -4.59 119.36 118.73 2fwu n ILE 608 Ca -0.09 -0.28 0.01 0.00 1.00 0.00 0.00 62.75 63.38 2fwu n ILE 608 Cb 0.60 -0.28 -0.05 0.00 -0.71 0.00 0.00 39.64 39.21 2fwu n ILE 608 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2fwu s THR 609 N -1.51 -0.25 -0.13 1.39 -1.32 -1.26 -5.01 115.64 107.54 2fwu s THR 609 Ca 0.12 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.77 2fwu s THR 609 Cb 0.08 -1.00 0.28 0.00 -1.51 0.00 0.00 72.50 70.35 2fwu s THR 609 CO 0.05 0.00 1.16 -0.62 -2.21 0.00 0.00 174.62 173.00 2fwu n GLU 610 N 4.44 1.61 -1.90 7.08 1.02 -1.26 -4.94 120.64 126.68 2fwu n GLU 610 Ca -0.11 -2.49 -0.40 0.00 -0.02 0.00 0.00 57.16 54.14 2fwu n GLU 610 Cb 0.55 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.46 2fwu n GLU 610 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2fwu s GLU 611 N -2.67 2.82 -0.72 3.49 2.02 -1.26 -2.51 118.70 119.87 2fwu s GLU 611 Ca 0.30 1.17 -0.01 0.00 0.02 0.00 0.00 54.97 56.44 2fwu s GLU 611 Cb 0.26 -4.36 -0.02 0.00 0.10 0.00 0.00 34.13 30.11 2fwu s GLU 611 CO 0.03 -2.47 0.67 0.66 0.02 0.00 0.00 175.26 174.17 2fwu n TYR 612 N 12.38 -2.52 0.12 1.61 4.01 -1.26 -4.96 117.16 126.54 2fwu n TYR 612 Ca 0.25 0.94 -0.19 0.00 -0.16 0.00 0.00 57.90 58.75 2fwu n TYR 612 Cb 0.50 -3.85 -0.15 0.00 -0.31 0.00 0.00 39.34 35.54 2fwu n TYR 612 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 2fwu h ASP 613 N 0.06 0.57 -3.34 7.72 2.03 -1.85 -3.42 116.42 118.18 2fwu h ASP 613 Ca -0.14 -0.61 -0.54 0.00 -0.73 0.00 0.00 57.03 55.01 2fwu h ASP 613 Cb 1.07 -0.19 -0.40 0.00 -0.83 0.00 0.00 39.33 38.99 2fwu h ASP 613 CO 0.30 1.48 -0.77 -0.62 -1.03 0.00 0.00 179.24 178.60 2fwu s ASP 614 N -7.30 3.23 -1.19 4.15 2.15 -1.26 -5.06 116.67 111.40 2fwu s ASP 614 Ca -0.06 -0.98 -0.11 0.00 0.43 0.00 0.00 52.55 51.83 2fwu s ASP 614 Cb 0.06 -0.75 0.21 0.00 -0.30 0.00 0.00 42.92 42.15 2fwu s ASP 614 CO 0.91 -0.30 1.43 0.29 -0.17 0.00 0.00 175.17 177.32 2fwu n LYS 615 N 4.95 3.57 -4.15 4.34 4.01 -1.26 -4.92 118.16 124.70 2fwu n LYS 615 Ca -0.09 -4.04 -0.11 0.00 -0.51 0.00 0.00 58.31 53.56 2fwu n LYS 615 Cb 0.46 -2.83 -0.10 0.00 -0.51 0.00 0.00 35.03 32.04 2fwu n LYS 615 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 2fwu s GLN 616 N 0.14 0.79 0.00 1.97 -0.21 -1.26 -5.17 119.66 115.92 2fwu s GLN 616 Ca 0.38 -1.22 0.00 0.00 0.02 0.00 0.00 55.36 54.54 2fwu s GLN 616 Cb -0.02 -0.26 0.00 0.00 1.00 0.00 0.00 33.01 33.73 2fwu s GLN 616 CO -0.01 0.01 0.00 -2.30 -2.12 0.00 0.00 175.29 170.87 2fwu n PRO 617 N 0.28 -1.28 -1.63 2.91 -0.02 -1.26 -4.81 135.00 129.20 2fwu n PRO 617 Ca -0.14 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 60.95 2fwu n PRO 617 Cb 0.59 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.04 2fwu n PRO 617 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2fwu s LEU 618 N 0.00 3.41 -0.06 2.45 2.01 -1.26 -4.74 118.68 120.48 2fwu s LEU 618 Ca 0.00 1.27 0.09 0.00 0.01 0.00 0.00 54.13 55.50 2fwu s LEU 618 Cb 0.00 -2.85 0.14 0.00 0.01 0.00 0.00 46.19 43.49 2fwu s LEU 618 CO 0.00 -2.52 1.04 0.35 1.01 0.00 0.00 176.35 176.23 2fwu n THR 619 N 7.84 1.02 -1.28 5.49 -2.24 -1.26 -4.76 114.28 119.09 2fwu n THR 619 Ca 0.33 -1.20 -0.26 0.00 -2.27 0.00 0.00 64.05 60.64 2fwu n THR 619 Cb 0.51 0.17 0.15 0.00 -2.10 0.00 0.00 70.33 69.06 2fwu n THR 619 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2fwu n SER 620 N -0.75 4.81 -0.07 3.42 7.64 -1.26 -4.61 113.62 122.80 2fwu n SER 620 Ca 0.08 -3.67 -0.09 0.00 1.01 0.00 0.00 58.87 56.20 2fwu n SER 620 Cb 0.62 -0.86 -0.07 0.00 -1.01 0.00 0.00 64.21 62.89 2fwu n SER 620 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2fwu h LYS 621 N 1.29 0.00 0.00 1.43 1.57 -2.00 -3.42 116.57 115.44 2fwu h LYS 621 Ca 0.61 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.31 2fwu h LYS 621 Cb 2.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.54 2fwu h LYS 621 CO 1.21 0.54 -0.60 0.93 -0.57 0.00 0.00 179.45 180.96 2fwu h GLU 622 N -1.00 0.00 -6.40 3.15 4.39 -1.99 -3.47 114.58 109.26 2fwu h GLU 622 Ca -0.04 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.11 2fwu h GLU 622 Cb 0.63 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 2fwu h GLU 622 CO -0.03 0.55 -0.06 -1.83 -1.16 0.00 0.00 179.01 176.48 2fwu s GLU 623 N -2.17 3.98 0.10 2.33 1.03 -1.26 -4.97 118.70 117.74 2fwu s GLU 623 Ca -0.18 0.51 0.23 0.00 0.03 0.00 0.00 54.97 55.55 2fwu s GLU 623 Cb 0.02 -2.84 0.07 0.00 -0.80 0.00 0.00 34.13 30.58 2fwu s GLU 623 CO 0.41 0.42 1.05 -0.85 -1.33 0.00 0.00 175.26 174.96 2fwu n GLU 624 N 0.55 0.40 0.05 -4.83 0.28 -1.26 -3.92 120.64 111.91 2fwu n GLU 624 Ca -0.03 0.03 0.06 0.00 -0.16 0.00 0.00 57.16 57.05 2fwu n GLU 624 Cb 0.52 -1.67 0.48 0.00 1.43 0.00 0.00 31.44 32.20 2fwu n GLU 624 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2fwu h GLU 625 N 0.00 0.40 -0.00 3.44 4.11 -1.97 0.22 114.58 120.78 2fwu h GLU 625 Ca 0.00 -0.02 -0.20 0.00 0.07 0.00 0.00 59.36 59.20 2fwu h GLU 625 Cb 0.82 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2fwu h GLU 625 CO 0.00 0.27 -0.88 -0.09 0.07 0.00 0.00 179.01 178.38 2fwu h ARG 626 N 0.42 0.24 0.00 1.06 9.65 -1.93 -3.09 114.38 120.73 2fwu h ARG 626 Ca 0.13 -0.26 -0.02 0.00 -1.10 0.00 0.00 59.98 58.72 2fwu h ARG 626 Cb -0.00 0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.65 2fwu h ARG 626 CO -0.03 0.98 -0.09 0.00 2.80 0.00 0.00 179.97 183.63 2fwu h ARG 627 N 0.14 0.00 -0.65 0.20 3.08 -1.11 -0.95 114.38 115.09 2fwu h ARG 627 Ca -0.05 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 2fwu h ARG 627 Cb 1.50 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.52 2fwu h ARG 627 CO 0.14 0.09 0.20 0.82 -1.07 0.00 0.00 179.97 180.15 2fwu h ILE 628 N 0.00 1.25 -0.30 2.04 2.04 -1.30 -2.27 117.51 118.97 2fwu h ILE 628 Ca -0.00 -0.86 -0.13 0.00 1.00 0.00 0.00 64.86 64.86 2fwu h ILE 628 Cb 0.42 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2fwu h ILE 628 CO 0.01 0.33 -0.36 0.00 0.00 0.00 0.00 178.15 178.14 2fwu h ALA 629 N 1.08 0.81 0.00 1.87 0.00 -1.30 -2.44 119.26 119.27 2fwu h ALA 629 Ca 0.21 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2fwu h ALA 629 Cb 0.30 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2fwu h ALA 629 CO -0.01 0.65 0.00 0.39 0.00 0.00 0.00 179.25 180.28 2fwu n GLU 630 N -4.05 0.70 0.19 0.00 4.71 -0.84 -0.98 120.64 120.36 2fwu n GLU 630 Ca -0.01 0.00 0.10 0.00 -0.01 0.00 0.00 57.16 57.23 2fwu n GLU 630 Cb 0.50 -1.09 0.12 0.00 -1.01 0.00 0.00 31.44 29.96 2fwu n GLU 630 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2fwu h MET 631 N 0.08 0.00 0.00 3.49 -0.00 -0.90 -3.34 114.93 114.26 2fwu h MET 631 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 59.70 59.32 2fwu h MET 631 Cb 0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 31.60 31.62 2fwu h MET 631 CO 0.00 0.11 -2.45 0.41 -0.00 0.00 0.00 176.91 174.98 2fwu n GLY 632 N 1.14 -0.55 3.70 -3.00 0.00 -0.15 -4.38 105.19 101.95 2fwu n GLY 632 Ca 0.03 -0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.51 4.25 0.56 1.61 3.00 -0.98 -4.33 118.95 120.55 2fwu s ARG 633 Ca -0.28 0.20 -0.17 0.00 0.00 0.00 0.00 55.73 55.49 2fwu s ARG 633 Cb 0.08 -3.47 -0.05 0.00 0.00 0.00 0.00 34.95 31.51 2fwu s ARG 633 CO 0.67 0.12 1.04 -1.25 0.00 0.00 0.00 175.30 175.87 2fwu s PRO 634 N 0.81 3.53 0.42 3.54 0.04 -1.26 -4.40 135.00 137.69 2fwu s PRO 634 Ca 0.19 1.17 0.04 0.00 0.04 0.00 0.00 61.00 62.45 2fwu s PRO 634 Cb -0.14 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 2fwu s PRO 634 CO 0.07 -0.63 0.16 0.96 0.04 0.00 0.00 177.00 177.59 2fwu s ILE 635 N -2.42 0.46 0.54 0.56 -5.25 -1.05 -4.34 121.20 109.70 2fwu s ILE 635 Ca 0.63 -2.00 -0.17 0.00 -0.99 0.00 0.00 60.65 58.12 2fwu s ILE 635 Cb -0.15 -2.28 -0.06 0.00 2.95 0.00 0.00 42.46 42.91 2fwu s ILE 635 CO 0.33 0.00 1.02 -1.48 -1.79 0.00 0.00 174.94 173.02 2fwu s LEU 636 N -3.62 3.64 0.00 0.37 -0.00 -1.26 -3.80 118.68 114.00 2fwu s LEU 636 Ca 0.23 1.75 0.00 0.00 -0.00 0.00 0.00 54.13 56.10 2fwu s LEU 636 Cb 0.01 -4.53 0.00 0.00 -0.00 0.00 0.00 46.19 41.67 2fwu s LEU 636 CO 0.16 -0.84 0.00 0.61 -0.00 0.00 0.00 176.35 176.28 2fwu n GLY 637 N -1.02 0.97 0.22 -3.48 0.00 0.75 -4.58 105.19 98.04 2fwu n GLY 637 Ca 0.08 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.45 -2.80 1.61 4.57 -1.94 -3.45 114.58 112.13 2fwu h GLU 638 Ca 0.00 0.03 -0.18 0.00 -1.18 0.00 0.00 59.36 58.03 2fwu h GLU 638 Cb 0.00 0.10 -0.31 0.00 -0.16 0.00 0.00 28.75 28.39 2fwu h GLU 638 CO 0.00 -0.14 -0.47 -3.38 -1.18 0.00 0.00 179.01 173.84 2fwu s HIS 639 N -3.83 -0.50 -0.66 0.92 -3.43 -1.26 -5.08 115.29 101.44 2fwu s HIS 639 Ca -0.12 1.08 -0.06 0.00 -0.80 0.00 0.00 55.06 55.16 2fwu s HIS 639 Cb 0.01 0.07 0.17 0.00 -1.43 0.00 0.00 32.58 31.40 2fwu s HIS 639 CO 0.41 -0.36 0.51 0.95 -2.00 0.00 0.00 174.74 174.25 2fwu s THR 640 N 2.18 4.26 -0.29 -5.38 -4.23 -1.26 -3.13 115.64 107.79 2fwu s THR 640 Ca -0.02 -2.70 -0.16 0.00 -1.18 0.00 0.00 61.69 57.63 2fwu s THR 640 Cb -0.11 -3.73 0.12 0.00 1.34 0.00 0.00 72.50 70.12 2fwu s THR 640 CO -0.10 -0.90 0.89 -0.75 -0.54 0.00 0.00 174.62 173.21 2fwu s LYS 641 N 0.16 0.48 -0.17 3.99 2.47 -1.26 -4.61 119.74 120.80 2fwu s LYS 641 Ca 0.16 0.83 -0.04 0.00 -1.56 0.00 0.00 55.97 55.36 2fwu s LYS 641 Cb -0.18 0.10 0.06 0.00 -1.46 0.00 0.00 37.83 36.35 2fwu s LYS 641 CO -0.05 -0.10 0.07 -1.17 0.16 0.00 0.00 175.35 174.26 2fwu s LEU 642 N 1.41 0.65 -0.44 5.43 2.96 -0.22 -4.30 118.68 124.18 2fwu s LEU 642 Ca -0.09 -0.66 -0.19 0.00 -0.22 0.00 0.00 54.13 52.97 2fwu s LEU 642 Cb -0.04 -0.37 0.03 0.00 0.50 0.00 0.00 46.19 46.30 2fwu s LEU 642 CO -0.16 -0.33 0.56 -0.70 -1.32 0.00 0.00 176.35 174.40 2fwu s GLU 643 N 2.03 3.19 -0.49 1.98 2.12 0.13 0.20 118.70 127.87 2fwu s GLU 643 Ca 0.01 -0.56 -0.18 0.00 0.36 0.00 0.00 54.97 54.60 2fwu s GLU 643 Cb -0.16 -3.97 0.06 0.00 0.26 0.00 0.00 34.13 30.32 2fwu s GLU 643 CO -0.08 -0.96 0.53 0.08 -0.54 0.00 0.00 175.26 174.28 2fwu s VAL 644 N 2.54 5.02 -0.25 3.70 1.01 -0.14 -0.88 120.40 131.41 2fwu s VAL 644 Ca 0.18 -0.72 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 2fwu s VAL 644 Cb -0.16 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 2fwu s VAL 644 CO 0.16 -0.71 0.70 -0.63 0.00 0.00 0.00 175.10 174.63 2fwu s ILE 645 N 2.22 4.93 -0.43 2.22 1.09 0.38 -2.48 121.20 129.14 2fwu s ILE 645 Ca 0.11 1.30 -0.14 0.00 -1.10 0.00 0.00 60.65 60.82 2fwu s ILE 645 Cb -0.21 -4.00 0.05 0.00 -1.06 0.00 0.00 42.46 37.23 2fwu s ILE 645 CO 0.10 -0.01 0.31 -0.63 -0.10 0.00 0.00 174.94 174.62 2fwu s ILE 646 N 2.60 4.99 0.03 2.92 1.09 -1.09 -1.56 121.20 130.18 2fwu s ILE 646 Ca 0.30 -0.95 0.04 0.00 -1.10 0.00 0.00 60.65 58.93 2fwu s ILE 646 Cb -0.15 -3.89 -0.04 0.00 -1.06 0.00 0.00 42.46 37.32 2fwu s ILE 646 CO 0.08 -0.43 -0.05 -1.83 -0.10 0.00 0.00 174.94 172.61 2fwu s GLU 647 N 1.61 2.52 0.19 2.79 -1.05 -1.00 -4.56 118.70 119.20 2fwu s GLU 647 Ca 0.04 -0.77 -0.33 0.00 -0.15 0.00 0.00 54.97 53.76 2fwu s GLU 647 Cb -0.22 -2.50 -0.14 0.00 -0.44 0.00 0.00 34.13 30.83 2fwu s GLU 647 CO 0.07 0.58 1.42 0.39 0.95 0.00 0.00 175.26 178.67 2fwu n GLU 648 N 1.27 1.85 -1.68 -4.83 4.71 -1.26 -1.78 120.64 118.92 2fwu n GLU 648 Ca -0.14 0.66 -0.45 0.00 -0.01 0.00 0.00 57.16 57.21 2fwu n GLU 648 Cb 0.52 -2.33 -0.04 0.00 -1.01 0.00 0.00 31.44 28.59 2fwu n GLU 648 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 2fwu n SER 649 N 2.54 3.59 0.12 1.62 7.64 -1.26 -4.72 113.62 123.16 2fwu n SER 649 Ca 0.14 1.00 0.00 0.00 1.01 0.00 0.00 58.87 61.02 2fwu n SER 649 Cb 0.28 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 2fwu n SER 649 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fwu n TYR 650 N 5.64 -2.91 -2.53 1.43 9.36 -1.26 -5.01 117.16 121.88 2fwu n TYR 650 Ca 0.20 0.70 0.00 0.00 3.32 0.00 0.00 57.90 62.12 2fwu n TYR 650 Cb 0.33 1.80 0.00 0.00 -0.63 0.00 0.00 39.34 40.83 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 -3.09 0.00 -4.14 2.98 2.13 -1.26 -5.16 120.64 112.10 2fwu n GLU 651 Ca 0.00 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 57.63 2fwu n GLU 651 Cb 0.00 0.00 -0.16 0.00 0.27 0.00 0.00 31.44 31.55 2fwu n GLU 651 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2fwu s PHE 652 N -4.15 0.66 0.01 4.31 5.36 -1.26 -4.94 117.98 117.98 2fwu s PHE 652 Ca 0.00 -0.17 0.05 0.00 -0.96 0.00 0.00 56.93 55.86 2fwu s PHE 652 Cb 0.00 -0.60 -0.03 0.00 -0.34 0.00 0.00 43.02 42.05 2fwu s PHE 652 CO 0.00 -0.17 -0.13 0.15 -1.46 0.00 0.00 175.22 173.61 2fwu s LYS 653 N 0.85 2.33 -0.45 10.12 -0.14 -1.26 -5.08 119.74 126.10 2fwu s LYS 653 Ca -0.11 -0.83 -0.06 0.00 -1.36 0.00 0.00 55.97 53.61 2fwu s LYS 653 Cb -0.14 -2.34 0.12 0.00 -1.68 0.00 0.00 37.83 33.79 2fwu s LYS 653 CO 0.00 0.58 0.29 -1.12 -0.76 0.00 0.00 175.35 174.34 2fwu s SER 654 N -1.30 5.48 -0.33 2.83 0.01 -1.26 -5.00 113.70 114.13 2fwu s SER 654 Ca 0.15 -2.03 -0.29 0.00 1.31 0.00 0.00 55.95 55.09 2fwu s SER 654 Cb -0.11 -1.92 -0.01 0.00 0.21 0.00 0.00 66.02 64.20 2fwu s SER 654 CO 0.05 -0.61 1.55 -0.89 0.41 0.00 0.00 173.24 173.76 2fwu s THR 655 N 1.17 3.77 0.17 1.44 2.01 -1.26 -5.00 115.64 117.94 2fwu s THR 655 Ca 0.08 0.81 0.02 0.00 0.31 0.00 0.00 61.69 62.90 2fwu s THR 655 Cb -0.24 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 2fwu s THR 655 CO -0.03 -0.52 0.33 0.68 -0.69 0.00 0.00 174.62 174.39 2fwu s VAL 656 N 5.64 5.28 0.00 3.82 -7.23 -1.26 -5.23 120.40 121.43 2fwu s VAL 656 Ca 0.68 -0.60 0.00 0.00 -1.81 0.00 0.00 61.98 60.25 2fwu s VAL 656 Cb -0.19 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.00 2fwu s VAL 656 CO 0.31 -0.14 0.00 -0.67 -0.31 0.00 0.00 175.10 174.29