#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 1.22 0.00 1.59 0.00 -1.26 -5.01 120.51 117.05 2fwu n ALA 502 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.36 2fwu n ALA 502 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2fwu n ALA 502 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fwu n GLY 503 N 1.43 1.04 2.97 0.00 0.00 -1.26 -4.59 105.19 104.78 2fwu n GLY 503 Ca -0.53 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.78 2fwu n GLY 503 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fwu s ILE 504 N -2.00 1.85 -0.25 -0.61 1.09 -1.26 -4.25 121.20 115.77 2fwu s ILE 504 Ca 0.00 -1.75 0.01 0.00 -1.10 0.00 0.00 60.65 57.82 2fwu s ILE 504 Cb 0.00 -2.21 0.05 0.00 -1.06 0.00 0.00 42.46 39.24 2fwu s ILE 504 CO 0.00 -0.35 -0.10 -0.36 -0.10 0.00 0.00 174.94 174.03 2fwu s PHE 505 N 1.18 3.16 0.04 3.97 0.08 -1.26 -1.78 117.98 123.37 2fwu s PHE 505 Ca 0.02 -2.04 -0.03 0.00 0.12 0.00 0.00 56.93 55.00 2fwu s PHE 505 Cb -0.19 -1.97 -0.02 0.00 -0.57 0.00 0.00 43.02 40.27 2fwu s PHE 505 CO -0.09 -0.84 0.02 -0.08 -0.10 0.00 0.00 175.22 174.13 2fwu s THR 506 N 1.18 0.15 0.31 0.64 -1.32 -1.16 -0.15 115.64 115.30 2fwu s THR 506 Ca -0.05 -1.27 -0.24 0.00 -1.21 0.00 0.00 61.69 58.92 2fwu s THR 506 Cb -0.18 -0.92 -0.10 0.00 -1.51 0.00 0.00 72.50 69.79 2fwu s THR 506 CO -0.06 -0.70 0.90 -0.36 -2.21 0.00 0.00 174.62 172.19 2fwu s PHE 507 N -2.73 3.66 0.13 9.09 0.40 -1.25 -0.18 117.98 127.11 2fwu s PHE 507 Ca -0.04 1.69 -0.15 0.00 -0.60 0.00 0.00 56.93 57.83 2fwu s PHE 507 Cb -0.01 -2.85 -0.01 0.00 0.51 0.00 0.00 43.02 40.66 2fwu s PHE 507 CO -0.05 0.21 1.61 1.49 0.70 0.00 0.00 175.22 179.18 2fwu h GLU 508 N 3.13 0.71 -4.87 0.44 4.81 -1.60 -3.42 114.58 113.78 2fwu h GLU 508 Ca -0.47 -0.19 -0.61 0.00 -0.13 0.00 0.00 59.36 57.96 2fwu h GLU 508 Cb 1.19 -0.08 -0.34 0.00 0.63 0.00 0.00 28.75 30.15 2fwu h GLU 508 CO 0.65 0.75 -0.84 -1.83 -0.73 0.00 0.00 179.01 177.00 2fwu s GLU 509 N -5.17 2.42 0.34 1.92 -1.05 -1.26 -4.99 118.70 110.91 2fwu s GLU 509 Ca -0.13 -0.64 0.27 0.00 -0.15 0.00 0.00 54.97 54.32 2fwu s GLU 509 Cb 0.10 -2.01 0.96 0.00 -0.44 0.00 0.00 34.13 32.74 2fwu s GLU 509 CO 0.79 -0.04 1.78 -1.00 0.95 0.00 0.00 175.26 177.74 2fwu h PRO 510 N 7.35 0.00 -4.18 -4.83 0.13 -1.80 -3.43 132.00 125.23 2fwu h PRO 510 Ca -0.31 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.41 2fwu h PRO 510 Cb 1.18 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.98 2fwu h PRO 510 CO 0.50 0.00 -0.78 0.08 -0.23 0.00 0.00 178.00 177.58 2fwu s VAL 511 N -3.34 0.60 0.02 1.56 1.01 -1.26 0.39 120.40 119.38 2fwu s VAL 511 Ca 0.05 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 61.87 2fwu s VAL 511 Cb 0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 2fwu s VAL 511 CO 0.51 0.23 -0.10 0.28 0.00 0.00 0.00 175.10 176.01 2fwu s THR 512 N 0.67 0.78 -0.15 3.92 -1.32 0.07 -4.72 115.64 114.89 2fwu s THR 512 Ca -0.09 -0.67 -0.00 0.00 -1.21 0.00 0.00 61.69 59.71 2fwu s THR 512 Cb -0.13 -0.71 -0.01 0.00 -1.51 0.00 0.00 72.50 70.15 2fwu s THR 512 CO 0.01 0.04 -0.13 -1.00 -2.21 0.00 0.00 174.62 171.33 2fwu s HIS 513 N -0.59 2.81 0.21 9.09 3.76 -1.26 -0.53 115.29 128.78 2fwu s HIS 513 Ca 0.01 -0.79 0.09 0.00 -0.15 0.00 0.00 55.06 54.21 2fwu s HIS 513 Cb -0.06 -1.88 -0.05 0.00 1.11 0.00 0.00 32.58 31.71 2fwu s HIS 513 CO 0.00 -0.32 -0.16 0.14 -0.85 0.00 0.00 174.74 173.55 2fwu s VAL 514 N 0.59 1.91 0.43 -0.90 -7.23 -0.23 -4.95 120.40 110.02 2fwu s VAL 514 Ca -0.08 -2.19 -0.22 0.00 -1.81 0.00 0.00 61.98 57.69 2fwu s VAL 514 Cb -0.16 -2.05 -0.10 0.00 0.56 0.00 0.00 36.38 34.63 2fwu s VAL 514 CO 0.03 -0.49 0.99 -0.55 -0.31 0.00 0.00 175.10 174.77 2fwu s SER 515 N -3.21 6.76 0.44 4.85 0.15 -1.26 -2.88 113.70 118.55 2fwu s SER 515 Ca 0.23 1.83 0.30 0.00 0.70 0.00 0.00 55.95 59.01 2fwu s SER 515 Cb -0.03 -2.56 1.32 0.00 -1.71 0.00 0.00 66.02 63.04 2fwu s SER 515 CO 0.08 -0.48 1.90 -0.08 1.20 0.00 0.00 173.24 175.86 2fwu h GLU 516 N 2.00 0.00 -0.38 5.44 4.81 -1.80 -2.94 114.58 121.72 2fwu h GLU 516 Ca -0.49 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.68 2fwu h GLU 516 Cb 1.20 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.54 2fwu h GLU 516 CO 0.61 0.00 0.03 0.43 -0.73 0.00 0.00 179.01 179.35 2fwu n SER 517 N -2.72 3.99 -4.93 1.04 7.64 -1.26 -4.13 113.62 113.25 2fwu n SER 517 Ca 0.01 -3.16 -0.25 0.00 1.01 0.00 0.00 58.87 56.48 2fwu n SER 517 Cb 0.24 -0.60 -0.01 0.00 -1.01 0.00 0.00 64.21 62.82 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 -2.92 5.05 -0.03 0.44 2.07 -1.11 -5.04 121.20 119.66 2fwu s ILE 518 Ca 0.46 -0.26 -0.04 0.00 -1.41 0.00 0.00 60.65 59.40 2fwu s ILE 518 Cb 0.37 -3.86 -0.01 0.00 0.13 0.00 0.00 42.46 39.10 2fwu s ILE 518 CO 0.09 -0.62 -0.07 0.61 -1.91 0.00 0.00 174.94 173.03 2fwu n GLY 519 N -1.86 -0.32 3.15 1.50 0.00 -1.26 -4.51 105.19 101.88 2fwu n GLY 519 Ca -0.03 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2fwu n GLY 519 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fwu s ILE 520 N -1.48 1.99 -0.12 -0.61 -1.09 -1.26 -1.27 121.20 117.37 2fwu s ILE 520 Ca -0.06 -0.93 -0.05 0.00 -2.23 0.00 0.00 60.65 57.38 2fwu s ILE 520 Cb 0.01 -1.77 -0.04 0.00 -1.58 0.00 0.00 42.46 39.08 2fwu s ILE 520 CO 0.09 0.54 0.06 0.00 -1.23 0.00 0.00 174.94 174.39 2fwu s MET 521 N 0.92 3.36 -0.45 2.79 0.23 -0.99 -4.93 119.30 120.23 2fwu s MET 521 Ca -0.05 -0.30 -0.02 0.00 -1.03 0.00 0.00 55.69 54.30 2fwu s MET 521 Cb -0.15 -3.02 0.12 0.00 -1.53 0.00 0.00 34.83 30.25 2fwu s MET 521 CO -0.04 0.63 0.24 -1.21 -2.03 0.00 0.00 175.02 172.62 2fwu s GLU 522 N -0.65 2.06 -0.01 3.16 8.01 -1.26 -2.39 118.70 127.63 2fwu s GLU 522 Ca 0.11 -2.03 -0.26 0.00 0.01 0.00 0.00 54.97 52.81 2fwu s GLU 522 Cb -0.12 -3.56 -0.04 0.00 -4.31 0.00 0.00 34.13 26.10 2fwu s GLU 522 CO 0.02 -1.08 0.79 0.08 0.01 0.00 0.00 175.26 175.09 2fwu s VAL 523 N 0.77 4.88 -0.09 2.63 1.01 -1.15 -4.83 120.40 123.62 2fwu s VAL 523 Ca 0.11 1.67 -0.25 0.00 0.00 0.00 0.00 61.98 63.51 2fwu s VAL 523 Cb -0.22 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2fwu s VAL 523 CO -0.04 0.27 0.77 -0.54 0.00 0.00 0.00 175.10 175.56 2fwu s LYS 524 N 0.52 4.41 -0.16 2.72 -0.14 -1.26 -2.33 119.74 123.50 2fwu s LYS 524 Ca 0.41 0.97 0.00 0.00 -1.36 0.00 0.00 55.97 56.00 2fwu s LYS 524 Cb -0.20 -3.49 0.00 0.00 -1.68 0.00 0.00 37.83 32.47 2fwu s LYS 524 CO 0.22 -0.06 -0.16 0.08 -0.76 0.00 0.00 175.35 174.67 2fwu s VAL 525 N 1.21 2.50 0.24 3.17 1.01 -0.66 -1.40 120.40 126.46 2fwu s VAL 525 Ca 0.39 -0.82 -0.27 0.00 0.00 0.00 0.00 61.98 61.29 2fwu s VAL 525 Cb -0.18 -2.05 -0.09 0.00 0.00 0.00 0.00 36.38 34.06 2fwu s VAL 525 CO 0.18 0.52 0.88 -0.76 0.00 0.00 0.00 175.10 175.91 2fwu s LEU 526 N 0.96 4.52 0.51 3.92 2.01 0.74 -2.33 118.68 129.01 2fwu s LEU 526 Ca -0.03 1.78 -0.06 0.00 0.01 0.00 0.00 54.13 55.84 2fwu s LEU 526 Cb -0.15 -3.64 -0.03 0.00 0.01 0.00 0.00 46.19 42.39 2fwu s LEU 526 CO -0.03 0.10 0.82 -0.60 1.01 0.00 0.00 176.35 177.65 2fwu s ARG 527 N -1.50 3.41 0.39 1.70 3.52 -1.26 -3.00 118.95 122.20 2fwu s ARG 527 Ca 0.42 0.18 -0.26 0.00 -0.13 0.00 0.00 55.73 55.94 2fwu s ARG 527 Cb -0.22 -2.34 -0.09 0.00 -1.56 0.00 0.00 34.95 30.74 2fwu s ARG 527 CO 0.27 -0.33 1.25 -0.08 -0.81 0.00 0.00 175.30 175.61 2fwu s THR 528 N -2.82 2.83 0.23 4.11 -1.32 -0.73 -4.77 115.64 113.18 2fwu s THR 528 Ca 0.49 0.74 -0.05 0.00 -1.21 0.00 0.00 61.69 61.66 2fwu s THR 528 Cb -0.10 -3.44 0.14 0.00 -1.51 0.00 0.00 72.50 67.59 2fwu s THR 528 CO 0.45 0.11 1.78 -1.28 -2.21 0.00 0.00 174.62 173.47 2fwu h SER 529 N 2.82 0.98 -3.56 8.08 0.87 -1.96 -3.28 113.55 117.51 2fwu h SER 529 Ca -0.49 -0.18 -0.80 0.00 -1.23 0.00 0.00 61.79 59.09 2fwu h SER 529 Cb 1.24 -0.26 -0.28 0.00 -0.44 0.00 0.00 62.40 62.66 2fwu h SER 529 CO 0.63 0.92 0.44 -0.83 -0.53 0.00 0.00 176.83 177.45 2fwu s GLY 530 N -3.50 3.24 -0.47 5.77 0.00 -1.26 -4.98 107.32 106.12 2fwu s GLY 530 Ca -0.11 -3.85 -0.19 0.00 0.00 0.00 0.00 44.72 40.56 2fwu s GLY 530 CO 0.83 1.32 0.61 0.00 0.00 0.00 0.00 173.10 175.86 2fwu s ALA 531 N -1.28 3.37 -0.26 3.20 0.00 -1.24 -4.81 121.76 120.75 2fwu s ALA 531 Ca 0.31 -1.51 0.02 0.00 0.00 0.00 0.00 51.96 50.78 2fwu s ALA 531 Cb -0.10 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.78 2fwu s ALA 531 CO -0.08 -1.87 -0.11 1.03 0.00 0.00 0.00 175.76 174.73 2fwu s ARG 532 N 2.64 2.34 3.58 0.00 1.81 -1.26 -4.44 118.95 123.61 2fwu s ARG 532 Ca 0.17 -1.29 0.00 0.00 -1.72 0.00 0.00 55.73 52.90 2fwu s ARG 532 Cb -0.17 -2.88 0.00 0.00 -0.45 0.00 0.00 34.95 31.45 2fwu s ARG 532 CO 0.15 -0.54 0.00 0.41 -0.68 0.00 0.00 175.30 174.64 2fwu n GLY 533 N 4.47 0.97 2.81 -3.53 0.00 -1.26 -4.75 105.19 103.89 2fwu n GLY 533 Ca -0.15 -0.94 -0.21 0.00 0.00 0.00 0.00 46.02 44.73 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 1.20 -0.11 1.61 3.04 -1.26 -0.77 114.94 114.65 2fwu s ASN 534 Ca 0.00 -0.08 0.02 0.00 0.04 0.00 0.00 52.86 52.84 2fwu s ASN 534 Cb 0.00 -0.39 0.01 0.00 -1.54 0.00 0.00 41.25 39.34 2fwu s ASN 534 CO 0.00 -0.14 -0.15 -0.69 -3.04 0.00 0.00 177.10 173.07 2fwu s VAL 535 N 1.55 1.52 -0.24 -5.21 1.01 0.11 -0.24 120.40 118.90 2fwu s VAL 535 Ca -0.02 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 2fwu s VAL 535 Cb -0.13 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 2fwu s VAL 535 CO -0.03 0.45 0.15 -0.63 0.00 0.00 0.00 175.10 175.03 2fwu s ILE 536 N 0.98 5.27 -0.26 2.22 -1.09 0.01 -0.73 121.20 127.59 2fwu s ILE 536 Ca -0.07 0.15 -0.00 0.00 -2.23 0.00 0.00 60.65 58.50 2fwu s ILE 536 Cb -0.15 -3.45 0.04 0.00 -1.58 0.00 0.00 42.46 37.32 2fwu s ILE 536 CO -0.02 0.35 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.29 2fwu s VAL 537 N 1.05 2.64 0.29 2.92 1.01 -0.17 -0.26 120.40 127.88 2fwu s VAL 537 Ca 0.07 -1.31 -0.29 0.00 0.00 0.00 0.00 61.98 60.45 2fwu s VAL 537 Cb -0.14 -2.44 -0.09 0.00 0.00 0.00 0.00 36.38 33.71 2fwu s VAL 537 CO 0.04 0.06 1.10 -2.16 0.00 0.00 0.00 175.10 174.14 2fwu s PRO 538 N 1.23 4.58 0.04 2.72 0.04 -1.26 0.06 135.00 142.41 2fwu s PRO 538 Ca -0.04 1.78 -0.02 0.00 0.04 0.00 0.00 61.00 62.76 2fwu s PRO 538 Cb -0.18 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 2fwu s PRO 538 CO -0.04 0.17 0.00 1.52 0.04 0.00 0.00 177.00 178.69 2fwu s TYR 539 N -1.21 0.37 0.10 0.56 1.13 0.76 -0.43 117.35 118.63 2fwu s TYR 539 Ca 0.46 -0.79 -0.19 0.00 -1.41 0.00 0.00 57.07 55.14 2fwu s TYR 539 Cb -0.31 -0.27 0.04 0.00 -1.10 0.00 0.00 41.96 40.32 2fwu s TYR 539 CO 0.40 -0.33 0.46 -1.59 -2.51 0.00 0.00 175.55 171.97 2fwu s LYS 540 N -2.97 1.06 -0.21 -3.49 -2.85 -0.60 -1.14 119.74 109.54 2fwu s LYS 540 Ca -0.02 -0.51 -0.15 0.00 -1.00 0.00 0.00 55.97 54.29 2fwu s LYS 540 Cb 0.01 0.47 -0.04 0.00 -2.06 0.00 0.00 37.83 36.22 2fwu s LYS 540 CO -0.06 -0.41 0.37 0.95 0.10 0.00 0.00 175.35 176.30 2fwu s THR 541 N -3.24 5.21 -0.16 3.79 -4.23 -1.03 -2.20 115.64 113.79 2fwu s THR 541 Ca -0.01 0.64 -0.17 0.00 -1.18 0.00 0.00 61.69 60.97 2fwu s THR 541 Cb 0.00 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.10 2fwu s THR 541 CO -0.08 0.25 0.42 -0.63 -0.54 0.00 0.00 174.62 174.04 2fwu s ILE 542 N 1.38 5.21 0.11 2.99 1.09 0.16 -4.87 121.20 127.27 2fwu s ILE 542 Ca 0.17 0.81 -0.22 0.00 -1.10 0.00 0.00 60.65 60.31 2fwu s ILE 542 Cb -0.15 -3.76 -0.09 0.00 -1.06 0.00 0.00 42.46 37.41 2fwu s ILE 542 CO 0.08 0.31 1.72 -0.33 -0.10 0.00 0.00 174.94 176.61 2fwu h GLU 543 N 6.94 -0.03 0.00 2.79 5.08 -1.86 -1.52 114.58 125.97 2fwu h GLU 543 Ca -0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2fwu h GLU 543 Cb 1.17 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2fwu h GLU 543 CO 0.75 -0.02 0.00 0.41 -1.00 0.00 0.00 179.01 179.15 2fwu n GLY 544 N -1.16 1.20 0.09 -3.84 0.00 -1.26 -1.26 105.19 98.96 2fwu n GLY 544 Ca -0.05 0.26 0.03 0.00 0.00 0.00 0.00 46.02 46.27 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 1.00 -4.34 2.61 5.66 -1.18 -5.02 114.28 113.02 2fwu n THR 545 Ca 0.00 -1.13 -0.28 0.00 -3.05 0.00 0.00 64.05 59.59 2fwu n THR 545 Cb 0.00 0.33 -0.11 0.00 -1.55 0.00 0.00 70.33 69.00 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 -1.33 2.72 -0.09 1.79 0.00 -0.39 -4.68 121.76 119.77 2fwu s ALA 546 Ca 0.11 -1.49 -0.21 0.00 0.00 0.00 0.00 51.96 50.37 2fwu s ALA 546 Cb 0.09 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2fwu s ALA 546 CO 0.01 0.49 0.58 0.50 0.00 0.00 0.00 175.76 177.34 2fwu s ARG 547 N -2.55 4.38 0.46 0.00 3.52 -1.26 -4.71 118.95 118.80 2fwu s ARG 547 Ca 0.21 0.64 0.04 0.00 -0.13 0.00 0.00 55.73 56.49 2fwu s ARG 547 Cb -0.09 -3.44 0.08 0.00 -1.56 0.00 0.00 34.95 29.95 2fwu s ARG 547 CO 0.12 0.12 0.64 0.41 -0.81 0.00 0.00 175.30 175.78 2fwu n GLY 548 N 3.18 1.36 1.93 8.12 0.00 -1.26 -0.26 105.19 118.25 2fwu n GLY 548 Ca -0.04 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 -0.25 0.42 0.79 -0.02 0.00 -1.04 -3.60 105.19 101.49 2fwu n GLY 549 Ca 0.12 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.66 0.80 0.00 -0.02 0.00 0.11 -4.91 105.19 99.50 2fwu n GLY 550 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.40 0.00 -0.06 1.61 -0.58 -1.24 -4.69 120.64 113.29 2fwu n GLU 551 Ca 0.00 0.26 -0.04 0.00 -0.42 0.00 0.00 57.16 56.97 2fwu n GLU 551 Cb 0.00 -0.75 -0.16 0.00 -0.57 0.00 0.00 31.44 29.96 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 -2.16 0.10 -3.71 1.62 8.00 0.64 -4.66 116.55 116.37 2fwu n ASP 552 Ca 0.00 0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.42 2fwu n ASP 552 Cb 0.00 1.16 -0.07 0.00 -0.02 0.00 0.00 41.12 42.19 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 -2.80 -0.19 -0.08 1.24 -0.71 -1.00 -2.15 117.98 112.29 2fwu s PHE 553 Ca -0.09 0.13 -0.23 0.00 -1.04 0.00 0.00 56.93 55.71 2fwu s PHE 553 Cb 0.08 0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 42.01 2fwu s PHE 553 CO 0.85 -0.52 0.69 -2.00 -1.34 0.00 0.00 175.22 172.89 2fwu s GLU 554 N -2.36 4.42 -0.38 1.99 -6.30 -0.05 0.06 118.70 116.07 2fwu s GLU 554 Ca -0.06 0.84 -0.24 0.00 -2.50 0.00 0.00 54.97 53.01 2fwu s GLU 554 Cb -0.01 -3.45 0.01 0.00 0.00 0.00 0.00 34.13 30.68 2fwu s GLU 554 CO -0.02 0.05 0.84 0.34 0.02 0.00 0.00 175.26 176.50 2fwu s ASP 555 N 0.81 6.57 -0.38 -1.70 2.15 -1.26 -4.50 116.67 118.36 2fwu s ASP 555 Ca 0.36 0.36 -0.05 0.00 0.43 0.00 0.00 52.55 53.65 2fwu s ASP 555 Cb -0.17 -2.42 0.08 0.00 -0.30 0.00 0.00 42.92 40.10 2fwu s ASP 555 CO 0.17 -0.82 0.16 0.28 -0.17 0.00 0.00 175.17 174.78 2fwu s THR 556 N 3.31 3.50 -0.23 1.71 -1.32 -1.26 -4.96 115.64 116.39 2fwu s THR 556 Ca 0.34 -1.62 0.01 0.00 -1.21 0.00 0.00 61.69 59.22 2fwu s THR 556 Cb -0.12 -3.19 0.06 0.00 -1.51 0.00 0.00 72.50 67.73 2fwu s THR 556 CO 0.19 -0.44 -0.08 0.00 -2.21 0.00 0.00 174.62 172.08 2fwu n GLY 558 N 4.61 2.88 2.88 0.00 0.00 -0.29 -4.99 105.19 110.27 2fwu n GLY 558 Ca -0.13 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 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 1.61 0.23 0.13 1.61 2.02 -1.26 -0.17 118.70 122.88 2fwu s GLU 559 Ca 0.00 -0.03 -0.08 0.00 0.02 0.00 0.00 54.97 54.88 2fwu s GLU 559 Cb 0.00 -0.30 -0.06 0.00 0.10 0.00 0.00 34.13 33.87 2fwu s GLU 559 CO 0.00 -0.01 0.43 -0.51 0.02 0.00 0.00 175.26 175.18 2fwu s LEU 560 N 0.33 4.28 -0.40 1.80 1.43 0.11 -4.87 118.68 121.36 2fwu s LEU 560 Ca -0.03 0.75 -0.11 0.00 -1.03 0.00 0.00 54.13 53.72 2fwu s LEU 560 Cb -0.06 -3.25 0.05 0.00 0.03 0.00 0.00 46.19 42.97 2fwu s LEU 560 CO -0.01 0.08 0.24 -0.70 0.23 0.00 0.00 176.35 176.20 2fwu s GLU 561 N -2.36 2.76 0.01 1.70 2.12 -1.26 -1.00 118.70 120.67 2fwu s GLU 561 Ca 0.39 -1.25 -0.01 0.00 0.36 0.00 0.00 54.97 54.46 2fwu s GLU 561 Cb -0.13 -3.79 -0.04 0.00 0.26 0.00 0.00 34.13 30.43 2fwu s GLU 561 CO 0.21 -0.83 0.15 -0.06 -0.54 0.00 0.00 175.26 174.19 2fwu s PHE 562 N 1.52 3.44 0.23 5.30 0.08 0.09 -4.94 117.98 123.69 2fwu s PHE 562 Ca 0.02 0.27 0.02 0.00 0.12 0.00 0.00 56.93 57.37 2fwu s PHE 562 Cb -0.21 -1.77 -0.01 0.00 -0.57 0.00 0.00 43.02 40.46 2fwu s PHE 562 CO 0.05 0.60 0.26 1.04 -0.10 0.00 0.00 175.22 177.08 2fwu n GLN 563 N 0.87 0.38 0.10 0.44 6.02 -1.25 0.05 117.38 123.98 2fwu n GLN 563 Ca -0.10 -2.11 -0.06 0.00 -0.01 0.00 0.00 57.00 54.72 2fwu n GLN 563 Cb 0.52 1.87 0.05 0.00 1.02 0.00 0.00 30.24 33.71 2fwu n GLN 563 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 177.06 175.08 2fwu h ASN 564 N 1.38 0.15 0.01 1.08 -1.24 -1.17 -3.28 115.58 112.51 2fwu h ASN 564 Ca -0.17 -0.11 -0.02 0.00 0.71 0.00 0.00 56.30 56.71 2fwu h ASN 564 Cb 0.82 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.83 2fwu h ASN 564 CO 0.24 0.86 -0.07 -0.78 -1.29 0.00 0.00 177.43 176.39 2fwu h ASP 565 N 0.07 0.05 -3.83 1.15 3.58 -1.91 -3.46 116.42 112.06 2fwu h ASP 565 Ca -0.02 -0.94 -0.53 0.00 0.42 0.00 0.00 57.03 55.96 2fwu h ASP 565 Cb 1.35 -0.01 0.07 0.00 1.72 0.00 0.00 39.33 42.46 2fwu h ASP 565 CO 0.11 0.98 0.68 -1.61 -2.88 0.00 0.00 179.24 176.52 2fwu s GLU 566 N -2.46 4.30 0.04 0.28 0.41 -1.24 -5.03 118.70 114.99 2fwu s GLU 566 Ca -0.18 2.29 0.00 0.00 -0.41 0.00 0.00 54.97 56.67 2fwu s GLU 566 Cb -0.02 -3.06 0.00 0.00 -1.78 0.00 0.00 34.13 29.27 2fwu s GLU 566 CO 0.70 -0.28 0.01 0.44 -0.49 0.00 0.00 175.26 175.64 2fwu n ILE 567 N 0.91 0.00 0.00 -1.63 -5.35 -1.26 -3.97 119.36 108.06 2fwu n ILE 567 Ca 0.01 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 2fwu n ILE 567 Cb 0.41 -0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.13 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 -0.30 0.00 -3.81 7.28 3.14 -1.26 -4.92 118.33 118.46 2fwu n VAL 568 Ca -0.01 0.00 -0.21 0.00 -2.96 0.00 0.00 64.34 61.16 2fwu n VAL 568 Cb 0.04 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 32.79 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 2.77 -0.07 1.45 -0.14 -0.99 -4.92 119.74 117.85 2fwu s LYS 569 Ca 0.00 -1.26 -0.02 0.00 -1.36 0.00 0.00 55.97 53.34 2fwu s LYS 569 Cb 0.00 -2.51 0.03 0.00 -1.68 0.00 0.00 37.83 33.67 2fwu s LYS 569 CO 0.00 0.12 0.03 0.95 -0.76 0.00 0.00 175.35 175.69 2fwu s THR 570 N -2.28 0.15 -0.53 2.17 -4.23 -1.25 -1.65 115.64 108.02 2fwu s THR 570 Ca 0.41 0.22 -0.24 0.00 -1.18 0.00 0.00 61.69 60.90 2fwu s THR 570 Cb -0.06 -0.39 0.04 0.00 1.34 0.00 0.00 72.50 73.43 2fwu s THR 570 CO 0.27 0.19 0.91 -0.63 -0.54 0.00 0.00 174.62 174.81 2fwu s ILE 571 N 2.06 4.45 -0.49 2.99 1.09 -0.98 -4.80 121.20 125.51 2fwu s ILE 571 Ca 0.05 0.27 -0.26 0.00 -1.10 0.00 0.00 60.65 59.61 2fwu s ILE 571 Cb -0.12 -4.50 0.03 0.00 -1.06 0.00 0.00 42.46 36.81 2fwu s ILE 571 CO -0.05 -1.04 0.97 -0.94 -0.10 0.00 0.00 174.94 173.79 2fwu s SER 572 N 2.73 6.49 -0.14 3.58 1.04 -1.25 -2.93 113.70 123.22 2fwu s SER 572 Ca 0.30 0.09 -0.01 0.00 0.48 0.00 0.00 55.95 56.81 2fwu s SER 572 Cb -0.13 -2.47 -0.01 0.00 0.10 0.00 0.00 66.02 63.51 2fwu s SER 572 CO 0.20 -1.13 -0.12 -0.69 0.98 0.00 0.00 173.24 172.47 2fwu s VAL 573 N 3.96 3.08 -0.62 5.02 1.01 -1.00 -4.93 120.40 126.91 2fwu s VAL 573 Ca 0.38 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.46 2fwu s VAL 573 Cb -0.10 -2.31 0.04 0.00 0.00 0.00 0.00 36.38 34.01 2fwu s VAL 573 CO 0.26 0.51 1.10 -0.75 0.00 0.00 0.00 175.10 176.22 2fwu s LYS 574 N 0.52 3.31 0.13 2.72 2.47 -1.25 -2.35 119.74 125.28 2fwu s LYS 574 Ca -0.08 -0.22 -0.30 0.00 -1.56 0.00 0.00 55.97 53.81 2fwu s LYS 574 Cb -0.16 -4.10 -0.06 0.00 -1.46 0.00 0.00 37.83 32.05 2fwu s LYS 574 CO 0.04 -1.76 1.00 0.08 0.16 0.00 0.00 175.35 174.87 2fwu s VAL 575 N 4.67 4.31 -0.10 4.02 1.01 -0.39 -0.87 120.40 133.05 2fwu s VAL 575 Ca 0.33 1.95 -0.09 0.00 0.00 0.00 0.00 61.98 64.17 2fwu s VAL 575 Cb -0.11 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2fwu s VAL 575 CO 0.18 0.31 0.19 -0.63 0.00 0.00 0.00 175.10 175.16 2fwu s ILE 576 N -0.10 5.41 -0.18 2.22 -1.09 -0.91 -4.57 121.20 121.97 2fwu s ILE 576 Ca 0.47 0.34 -0.35 0.00 -2.23 0.00 0.00 60.65 58.88 2fwu s ILE 576 Cb -0.25 -3.46 -0.12 0.00 -1.58 0.00 0.00 42.46 37.05 2fwu s ILE 576 CO 0.31 0.61 1.94 -0.67 -1.23 0.00 0.00 174.94 175.90 2fwu n ASP 577 N 1.97 3.01 -4.66 3.58 2.03 -1.26 -4.73 116.55 116.49 2fwu n ASP 577 Ca -0.19 0.83 -0.42 0.00 0.52 0.00 0.00 54.79 55.53 2fwu n ASP 577 Cb 0.54 -1.32 -0.03 0.00 -0.72 0.00 0.00 41.12 39.59 2fwu n ASP 577 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2fwu s ASP 578 N 4.92 6.51 0.36 1.67 2.15 -1.26 -4.89 116.67 126.13 2fwu s ASP 578 Ca 0.98 2.55 0.23 0.00 0.43 0.00 0.00 52.55 56.73 2fwu s ASP 578 Cb -0.76 -2.53 0.35 0.00 -0.30 0.00 0.00 42.92 39.67 2fwu s ASP 578 CO 0.53 -1.01 1.54 1.05 -0.17 0.00 0.00 175.17 177.10 2fwu h GLU 579 N 10.18 0.00 0.00 4.34 9.09 -1.88 -3.47 114.58 132.83 2fwu h GLU 579 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.95 2fwu h GLU 579 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.32 2fwu h GLU 579 CO 0.94 0.00 0.00 -0.85 0.05 0.00 0.00 179.01 179.15 2fwu n GLU 580 N -2.89 1.38 -1.63 1.06 0.00 -1.26 -5.12 120.64 112.17 2fwu n GLU 580 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.84 2fwu n GLU 580 Cb 0.52 0.00 0.07 0.00 0.00 0.00 0.00 31.44 32.03 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 -0.71 2.14 -0.25 -1.84 1.13 -1.26 -4.99 117.35 111.58 2fwu s TYR 581 Ca 0.00 1.55 0.02 0.00 -1.41 0.00 0.00 57.07 57.24 2fwu s TYR 581 Cb 0.00 -3.52 0.06 0.00 -1.10 0.00 0.00 41.96 37.40 2fwu s TYR 581 CO 0.00 -2.57 -0.09 -2.00 -2.51 0.00 0.00 175.55 168.37 2fwu s GLU 582 N -3.67 2.03 0.98 -3.49 2.12 -1.26 -5.08 118.70 110.33 2fwu s GLU 582 Ca 0.77 -1.19 -0.17 0.00 0.36 0.00 0.00 54.97 54.74 2fwu s GLU 582 Cb -0.31 -2.75 0.23 0.00 0.26 0.00 0.00 34.13 31.55 2fwu s GLU 582 CO 0.41 -0.56 1.31 1.63 -0.54 0.00 0.00 175.26 177.51 2fwu n LYS 583 N 4.53 -1.37 -2.44 4.30 5.02 -1.26 -4.91 118.16 122.02 2fwu n LYS 583 Ca -0.14 -2.03 -0.39 0.00 -2.02 0.00 0.00 58.31 53.74 2fwu n LYS 583 Cb 0.43 -1.37 -0.02 0.00 -0.02 0.00 0.00 35.03 34.05 2fwu n LYS 583 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2fwu s ASN 584 N -5.77 6.30 0.01 4.39 3.84 -1.26 -4.91 114.94 117.54 2fwu s ASN 584 Ca 0.75 -1.84 0.02 0.00 0.21 0.00 0.00 52.86 51.99 2fwu s ASN 584 Cb -0.02 -2.58 -0.04 0.00 -0.55 0.00 0.00 41.25 38.07 2fwu s ASN 584 CO 0.53 -1.72 -0.01 -1.59 -2.79 0.00 0.00 177.10 171.51 2fwu s LYS 585 N 5.07 2.71 -0.03 0.43 0.00 -1.26 -5.04 119.74 121.63 2fwu s LYS 585 Ca 0.55 -0.66 -0.17 0.00 0.00 0.00 0.00 55.97 55.69 2fwu s LYS 585 Cb 0.01 -2.62 0.03 0.00 0.00 0.00 0.00 37.83 35.25 2fwu s LYS 585 CO 0.02 0.61 0.38 -0.08 0.00 0.00 0.00 175.35 176.28 2fwu s THR 586 N -1.09 0.04 0.07 3.79 -1.32 -1.26 -3.12 115.64 112.77 2fwu s THR 586 Ca 0.19 -0.37 0.09 0.00 -1.21 0.00 0.00 61.69 60.40 2fwu s THR 586 Cb -0.11 -0.67 -0.03 0.00 -1.51 0.00 0.00 72.50 70.17 2fwu s THR 586 CO 0.10 -0.20 -0.22 0.72 -2.21 0.00 0.00 174.62 172.81 2fwu s PHE 587 N -1.21 2.44 -0.03 9.09 -0.12 -1.20 -3.09 117.98 123.86 2fwu s PHE 587 Ca -0.12 -0.32 0.00 0.00 -0.05 0.00 0.00 56.93 56.43 2fwu s PHE 587 Cb -0.04 -1.38 -0.03 0.00 -0.63 0.00 0.00 43.02 40.93 2fwu s PHE 587 CO 0.05 0.26 0.00 -0.06 -0.05 0.00 0.00 175.22 175.42 2fwu s PHE 588 N -0.96 3.12 -0.17 3.49 0.08 -0.57 -2.03 117.98 120.93 2fwu s PHE 588 Ca 0.14 0.13 -0.02 0.00 0.12 0.00 0.00 56.93 57.30 2fwu s PHE 588 Cb -0.10 -1.72 -0.01 0.00 -0.57 0.00 0.00 43.02 40.61 2fwu s PHE 588 CO 0.05 0.47 -0.07 -1.17 -0.10 0.00 0.00 175.22 174.40 2fwu s LEU 589 N -1.30 2.90 0.05 -0.37 1.98 -0.12 0.39 118.68 122.21 2fwu s LEU 589 Ca 0.17 -0.32 0.03 0.00 -2.89 0.00 0.00 54.13 51.13 2fwu s LEU 589 Cb -0.11 -1.70 -0.02 0.00 0.66 0.00 0.00 46.19 45.01 2fwu s LEU 589 CO 0.07 0.09 -0.10 -0.70 -1.89 0.00 0.00 176.35 173.81 2fwu s GLU 590 N 0.84 0.65 0.06 1.98 2.12 -0.94 -1.31 118.70 122.11 2fwu s GLU 590 Ca -0.02 -0.80 0.04 0.00 0.36 0.00 0.00 54.97 54.55 2fwu s GLU 590 Cb -0.15 -0.53 -0.04 0.00 0.26 0.00 0.00 34.13 33.68 2fwu s GLU 590 CO 0.01 0.11 -0.02 0.96 -0.54 0.00 0.00 175.26 175.79 2fwu s ILE 591 N -1.25 3.95 0.00 -3.70 -4.36 -1.26 -1.55 121.20 113.03 2fwu s ILE 591 Ca -0.06 -0.89 0.00 0.00 -0.26 0.00 0.00 60.65 59.44 2fwu s ILE 591 Cb -0.09 -2.83 0.00 0.00 1.25 0.00 0.00 42.46 40.79 2fwu s ILE 591 CO 0.01 0.22 0.00 0.61 0.24 0.00 0.00 174.94 176.02 2fwu n GLY 592 N 0.90 2.30 3.63 6.27 0.00 0.43 -4.97 105.19 113.75 2fwu n GLY 592 Ca -0.12 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 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 4.96 3.95 0.40 1.61 2.12 -1.26 -4.80 118.70 125.68 2fwu s GLU 593 Ca 0.00 1.12 -0.24 0.00 0.36 0.00 0.00 54.97 56.21 2fwu s GLU 593 Cb 0.00 -3.83 -0.09 0.00 0.26 0.00 0.00 34.13 30.47 2fwu s GLU 593 CO 0.00 -1.06 1.03 -1.25 -0.54 0.00 0.00 175.26 173.44 2fwu s PRO 594 N 4.00 4.20 -0.03 4.30 0.04 -1.26 -4.39 135.00 141.86 2fwu s PRO 594 Ca 0.51 1.47 0.06 0.00 0.04 0.00 0.00 61.00 63.08 2fwu s PRO 594 Cb -0.14 -2.54 -0.01 0.00 0.04 0.00 0.00 34.50 31.85 2fwu s PRO 594 CO 0.21 -0.10 -0.22 -0.98 0.04 0.00 0.00 177.00 175.95 2fwu s ARG 595 N -2.51 1.93 -0.28 4.56 1.70 0.64 -4.22 118.95 120.77 2fwu s ARG 595 Ca 0.57 -0.78 -0.23 0.00 -0.47 0.00 0.00 55.73 54.83 2fwu s ARG 595 Cb -0.21 -1.78 -0.00 0.00 -0.57 0.00 0.00 34.95 32.39 2fwu s ARG 595 CO 0.26 0.41 0.77 -1.17 -1.08 0.00 0.00 175.30 174.50 2fwu s LEU 596 N -0.35 4.08 0.10 -1.89 1.98 -1.26 -0.81 118.68 120.53 2fwu s LEU 596 Ca 0.04 0.75 -0.05 0.00 -2.89 0.00 0.00 54.13 51.99 2fwu s LEU 596 Cb -0.10 -3.07 -0.21 0.00 0.66 0.00 0.00 46.19 43.48 2fwu s LEU 596 CO 0.01 -0.56 1.20 0.58 -1.89 0.00 0.00 176.35 175.69 2fwu h VAL 597 N 5.53 1.45 -2.50 1.68 2.07 -0.99 -3.45 116.25 120.05 2fwu h VAL 597 Ca -0.24 -2.80 0.00 0.00 0.82 0.00 0.00 66.70 64.48 2fwu h VAL 597 Cb 1.10 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 33.61 2fwu h VAL 597 CO 0.86 0.82 0.00 -0.62 0.02 0.00 0.00 177.57 178.66 2fwu n GLU 598 N -3.63 0.47 -3.15 1.57 -0.58 -1.24 -4.66 120.64 109.42 2fwu n GLU 598 Ca -0.08 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.52 2fwu n GLU 598 Cb 0.95 0.00 0.07 0.00 -0.57 0.00 0.00 31.44 31.89 2fwu n GLU 598 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 2fwu n MET 599 N -0.88 -5.33 -0.02 3.49 2.81 -1.26 -4.93 117.12 111.00 2fwu n MET 599 Ca 0.00 0.65 -0.18 0.00 -1.81 0.00 0.00 57.70 56.36 2fwu n MET 599 Cb 0.00 -5.09 -0.07 0.00 -0.71 0.00 0.00 33.22 27.34 2fwu n MET 599 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2fwu h SER 600 N -1.60 0.95 -2.60 7.83 0.02 -1.92 -3.40 113.55 112.84 2fwu h SER 600 Ca -0.45 -0.64 -0.67 0.00 -0.84 0.00 0.00 61.79 59.19 2fwu h SER 600 Cb 1.27 -0.28 -0.17 0.00 0.14 0.00 0.00 62.40 63.36 2fwu h SER 600 CO 0.39 1.43 0.61 -1.61 -1.14 0.00 0.00 176.83 176.51 2fwu s GLU 601 N -3.73 3.33 -0.24 3.45 2.02 -1.26 -4.90 118.70 117.38 2fwu s GLU 601 Ca -0.10 -1.36 -0.18 0.00 0.02 0.00 0.00 54.97 53.34 2fwu s GLU 601 Cb 0.08 -4.55 0.07 0.00 0.10 0.00 0.00 34.13 29.83 2fwu s GLU 601 CO 0.91 -1.75 0.61 0.21 0.02 0.00 0.00 175.26 175.26 2fwu s LYS 602 N 3.16 0.67 -0.43 1.61 2.20 -1.26 -5.11 119.74 120.58 2fwu s LYS 602 Ca 0.25 0.95 -0.28 0.00 -0.36 0.00 0.00 55.97 56.53 2fwu s LYS 602 Cb -0.12 0.24 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 2fwu s LYS 602 CO 0.00 -0.11 1.52 -1.59 -0.36 0.00 0.00 175.35 174.80 2fwu s LYS 603 N 0.84 3.43 -1.25 4.03 0.00 -1.26 -4.91 119.74 120.61 2fwu s LYS 603 Ca -0.04 0.94 -0.14 0.00 0.00 0.00 0.00 55.97 56.72 2fwu s LYS 603 Cb -0.05 -4.10 0.14 0.00 0.00 0.00 0.00 37.83 33.82 2fwu s LYS 603 CO -0.07 -1.75 1.59 0.41 0.00 0.00 0.00 175.35 175.53 2fwu n GLY 604 N 5.22 3.33 0.00 0.59 0.00 -1.26 -4.24 105.19 108.82 2fwu n GLY 604 Ca 0.17 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 4.33 -1.79 0.12 -0.02 0.00 -1.06 -4.20 105.19 102.56 2fwu n GLY 605 Ca 0.41 0.62 -0.22 0.00 0.00 0.00 0.00 46.02 46.83 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 0.00 1.05 -4.49 1.61 -1.74 -1.26 -4.65 117.46 107.99 2fwu n PHE 606 Ca 0.00 0.36 -0.24 0.00 -0.56 0.00 0.00 57.45 57.01 2fwu n PHE 606 Cb 0.00 -1.12 -0.17 0.00 1.52 0.00 0.00 39.48 39.72 2fwu n PHE 606 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 2fwu s THR 607 N -2.44 1.00 -1.34 1.97 -4.23 -1.26 -4.79 115.64 104.55 2fwu s THR 607 Ca -0.27 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 2fwu s THR 607 Cb 0.07 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 72.97 2fwu s THR 607 CO 0.65 0.33 0.00 -0.38 -0.54 0.00 0.00 174.62 174.67 2fwu n ILE 608 N 3.86 0.00 -2.18 2.99 5.41 -1.26 -0.79 119.36 127.39 2fwu n ILE 608 Ca -0.23 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.38 2fwu n ILE 608 Cb 0.51 -1.57 -0.01 0.00 -0.71 0.00 0.00 39.64 37.86 2fwu n ILE 608 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2fwu n THR 609 N -2.28 -0.59 -1.79 1.39 -1.04 -1.26 -4.95 114.28 103.76 2fwu n THR 609 Ca -0.13 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.47 2fwu n THR 609 Cb 0.59 -2.06 -0.03 0.00 -1.82 0.00 0.00 70.33 67.01 2fwu n THR 609 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2fwu s GLU 610 N -4.53 3.06 -0.28 -2.82 0.41 0.02 -4.61 118.70 109.95 2fwu s GLU 610 Ca 0.00 1.61 0.08 0.00 -0.41 0.00 0.00 54.97 56.25 2fwu s GLU 610 Cb 0.00 -4.33 0.46 0.00 -1.78 0.00 0.00 34.13 28.48 2fwu s GLU 610 CO 0.00 -2.18 1.31 -0.85 -0.49 0.00 0.00 175.26 173.05 2fwu n GLU 611 N 8.69 2.37 -1.99 1.61 0.28 -1.26 -2.58 120.64 127.76 2fwu n GLU 611 Ca 0.27 -3.57 -0.01 0.00 -0.16 0.00 0.00 57.16 53.69 2fwu n GLU 611 Cb 0.47 -1.92 0.00 0.00 1.43 0.00 0.00 31.44 31.43 2fwu n GLU 611 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2fwu n TYR 612 N -0.98 -0.89 -2.55 -1.84 4.01 -1.26 -4.97 117.16 108.68 2fwu n TYR 612 Ca 0.33 0.34 -0.42 0.00 -0.16 0.00 0.00 57.90 57.99 2fwu n TYR 612 Cb 0.86 -2.44 0.01 0.00 -0.31 0.00 0.00 39.34 37.46 2fwu n TYR 612 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2fwu n ASP 613 N -1.39 6.61 -3.08 7.72 8.00 -1.26 -4.85 116.55 128.30 2fwu n ASP 613 Ca -0.00 -3.34 -0.07 0.00 0.71 0.00 0.00 54.79 52.08 2fwu n ASP 613 Cb 0.51 -1.32 0.02 0.00 -0.02 0.00 0.00 41.12 40.31 2fwu n ASP 613 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2fwu s ASP 614 N -0.60 -0.01 -0.06 -2.24 -4.77 -1.26 -5.06 116.67 102.67 2fwu s ASP 614 Ca 0.39 -1.01 0.16 0.00 -3.30 0.00 0.00 52.55 48.80 2fwu s ASP 614 Cb 0.12 0.77 0.30 0.00 -1.09 0.00 0.00 42.92 43.02 2fwu s ASP 614 CO -0.01 -1.52 1.14 2.29 0.70 0.00 0.00 175.17 177.77 2fwu n LYS 615 N -0.56 0.31 -3.86 2.11 2.85 -1.26 -5.12 118.16 112.63 2fwu n LYS 615 Ca -0.07 -1.81 -0.22 0.00 -1.05 0.00 0.00 58.31 55.16 2fwu n LYS 615 Cb 0.60 -0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.93 2fwu n LYS 615 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 2fwu s GLN 616 N -0.45 2.52 0.00 -1.58 -2.07 -1.26 -5.13 119.66 111.69 2fwu s GLN 616 Ca 0.21 -1.49 0.00 0.00 -1.82 0.00 0.00 55.36 52.26 2fwu s GLN 616 Cb 0.26 -2.32 0.00 0.00 -1.09 0.00 0.00 33.01 29.87 2fwu s GLN 616 CO -0.10 -0.00 0.00 -2.30 -1.32 0.00 0.00 175.29 171.57 2fwu n PRO 617 N -1.34 -1.17 -1.82 9.60 -0.02 -1.26 -4.84 135.00 134.14 2fwu n PRO 617 Ca -0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.05 2fwu n PRO 617 Cb 0.61 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.06 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 3.80 -0.04 2.45 2.01 -1.26 -4.93 118.68 120.72 2fwu s LEU 618 Ca 0.00 1.91 0.01 0.00 0.01 0.00 0.00 54.13 56.06 2fwu s LEU 618 Cb 0.00 -3.52 0.02 0.00 0.01 0.00 0.00 46.19 42.70 2fwu s LEU 618 CO 0.00 -1.52 -0.04 0.42 1.01 0.00 0.00 176.35 176.22 2fwu s THR 619 N 6.36 0.46 -0.28 5.49 -4.23 -1.26 -5.10 115.64 117.08 2fwu s THR 619 Ca 0.87 -0.11 -0.18 0.00 -1.18 0.00 0.00 61.69 61.09 2fwu s THR 619 Cb -0.31 -0.49 0.10 0.00 1.34 0.00 0.00 72.50 73.14 2fwu s THR 619 CO 0.35 0.20 0.83 -0.44 -0.54 0.00 0.00 174.62 175.01 2fwu s SER 620 N 0.78 -0.72 0.00 3.99 0.01 -1.26 -4.82 113.70 111.68 2fwu s SER 620 Ca -0.10 1.20 0.00 0.00 1.31 0.00 0.00 55.95 58.36 2fwu s SER 620 Cb -0.13 1.28 0.00 0.00 0.21 0.00 0.00 66.02 67.38 2fwu s SER 620 CO -0.00 -0.19 0.00 0.29 0.41 0.00 0.00 173.24 173.74 2fwu n LYS 621 N 3.62 0.00 0.00 12.44 5.02 -1.26 -4.92 118.16 133.06 2fwu n LYS 621 Ca -0.18 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.12 2fwu n LYS 621 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 2fwu n LYS 621 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2fwu n GLU 622 N -2.32 0.41 -2.78 1.97 0.28 -1.26 -4.98 120.64 111.95 2fwu n GLU 622 Ca 0.00 -0.48 -0.43 0.00 -0.16 0.00 0.00 57.16 56.09 2fwu n GLU 622 Cb 0.00 -0.95 -0.04 0.00 1.43 0.00 0.00 31.44 31.88 2fwu n GLU 622 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2fwu s GLU 623 N -0.28 3.45 0.21 3.44 8.01 -1.26 -4.86 118.70 127.42 2fwu s GLU 623 Ca 0.01 0.00 -0.01 0.00 0.01 0.00 0.00 54.97 54.99 2fwu s GLU 623 Cb 0.01 -3.99 0.19 0.00 -4.31 0.00 0.00 34.13 26.03 2fwu s GLU 623 CO 0.02 -1.41 1.55 1.05 0.01 0.00 0.00 175.26 176.48 2fwu h GLU 624 N 9.26 0.47 -0.78 1.61 9.09 -1.99 -2.38 114.58 129.85 2fwu h GLU 624 Ca -0.25 -0.28 0.03 0.00 0.05 0.00 0.00 59.36 58.90 2fwu h GLU 624 Cb 1.07 0.03 -0.04 0.00 -1.65 0.00 0.00 28.75 28.15 2fwu h GLU 624 CO 1.08 0.88 0.52 0.93 0.05 0.00 0.00 179.01 182.46 2fwu h GLU 625 N 0.37 0.96 -0.46 1.06 3.07 -2.00 -1.90 114.58 115.69 2fwu h GLU 625 Ca 0.01 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 58.69 2fwu h GLU 625 Cb 1.03 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.71 2fwu h GLU 625 CO 0.09 0.64 -0.22 -0.09 -1.40 0.00 0.00 179.01 178.02 2fwu h ARG 626 N 0.99 0.94 -0.14 2.33 9.65 -1.84 -1.14 114.38 125.17 2fwu h ARG 626 Ca 0.31 -0.40 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2fwu h ARG 626 Cb -0.00 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 2fwu h ARG 626 CO -0.08 1.06 0.08 0.00 2.80 0.00 0.00 179.97 183.83 2fwu h ARG 627 N 0.81 0.19 -0.21 0.20 2.47 -0.88 0.34 114.38 117.31 2fwu h ARG 627 Ca 0.10 -0.01 -0.19 0.00 -1.26 0.00 0.00 59.98 58.62 2fwu h ARG 627 Cb 0.79 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 29.07 2fwu h ARG 627 CO 0.07 0.14 -0.63 0.82 0.56 0.00 0.00 179.97 180.93 2fwu h ILE 628 N 0.20 1.29 -0.54 2.04 2.04 -0.70 -2.28 117.51 119.55 2fwu h ILE 628 Ca 0.05 -1.83 -0.09 0.00 1.00 0.00 0.00 64.86 64.00 2fwu h ILE 628 Cb 0.00 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 2fwu h ILE 628 CO -0.01 0.58 -0.01 0.00 0.00 0.00 0.00 178.15 178.71 2fwu h ALA 629 N 0.60 0.96 0.00 1.87 0.00 0.04 -2.37 119.26 120.36 2fwu h ALA 629 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2fwu h ALA 629 Cb 1.25 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2fwu h ALA 629 CO 0.13 0.63 0.00 0.39 0.00 0.00 0.00 179.25 180.40 2fwu n GLU 630 N -4.19 0.63 -0.01 0.00 -0.58 0.11 -0.82 120.64 115.77 2fwu n GLU 630 Ca 0.03 0.01 0.07 0.00 -0.42 0.00 0.00 57.16 56.86 2fwu n GLU 630 Cb 0.33 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.77 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 -1.05 1.17 0.02 3.49 0.00 -0.87 -4.07 117.12 115.80 2fwu n MET 631 Ca 0.16 -1.44 -0.16 0.00 0.00 0.00 0.00 57.70 56.26 2fwu n MET 631 Cb 0.09 -1.29 -0.14 0.00 0.00 0.00 0.00 33.22 31.88 2fwu n MET 631 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 2fwu h GLY 632 N 2.93 0.21 -2.51 3.17 0.00 -0.88 -3.45 103.07 102.54 2fwu h GLY 632 Ca 0.00 -0.54 -0.46 0.00 0.00 0.00 0.00 47.33 46.33 2fwu h GLY 632 CO 0.00 0.48 0.33 0.50 0.00 0.00 0.00 176.54 177.84 2fwu s ARG 633 N -2.59 4.36 0.50 4.80 0.52 -0.91 -4.88 118.95 120.75 2fwu s ARG 633 Ca -0.13 1.18 -0.18 0.00 -0.52 0.00 0.00 55.73 56.08 2fwu s ARG 633 Cb 0.07 -2.45 -0.08 0.00 0.52 0.00 0.00 34.95 33.01 2fwu s ARG 633 CO 0.81 0.11 0.99 -1.25 0.02 0.00 0.00 175.30 175.98 2fwu s PRO 634 N -2.70 3.95 0.45 3.54 0.04 -1.26 -4.80 135.00 134.22 2fwu s PRO 634 Ca 0.57 1.03 0.01 0.00 0.04 0.00 0.00 61.00 62.65 2fwu s PRO 634 Cb -0.13 -2.13 -0.00 0.00 0.04 0.00 0.00 34.50 32.27 2fwu s PRO 634 CO 0.18 -0.27 0.04 0.44 0.04 0.00 0.00 177.00 177.42 2fwu n ILE 635 N -1.39 0.00 -2.58 0.56 -5.35 -1.26 -4.32 119.36 105.02 2fwu n ILE 635 Ca 0.07 -2.25 -0.15 0.00 -0.27 0.00 0.00 62.75 60.15 2fwu n ILE 635 Cb 0.54 0.55 0.08 0.00 -1.74 0.00 0.00 39.64 39.06 2fwu n ILE 635 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2fwu n LEU 636 N 0.00 0.00 0.00 7.28 -0.00 -1.26 -4.14 117.00 118.88 2fwu n LEU 636 Ca -0.16 -1.49 0.00 0.00 -0.00 0.00 0.00 56.01 54.36 2fwu n LEU 636 Cb 0.60 -0.42 0.00 0.00 -0.00 0.00 0.00 43.42 43.59 2fwu n LEU 636 CO 0.32 -0.81 0.00 0.61 -0.00 0.00 0.00 177.39 177.51 2fwu n GLY 637 N -0.21 0.81 0.79 1.47 0.00 0.79 -4.18 105.19 104.65 2fwu n GLY 637 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 0.15 -3.57 1.61 4.07 -1.26 -4.88 120.64 116.75 2fwu n GLU 638 Ca 0.00 0.06 -0.41 0.00 -0.06 0.00 0.00 57.16 56.75 2fwu n GLU 638 Cb 0.00 -0.76 -0.07 0.00 -0.06 0.00 0.00 31.44 30.55 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 -2.25 3.51 -0.65 4.31 -3.43 -1.26 -4.98 115.29 110.53 2fwu s HIS 639 Ca -0.08 -2.25 -0.06 0.00 -0.80 0.00 0.00 55.06 51.87 2fwu s HIS 639 Cb 0.01 -3.46 0.17 0.00 -1.43 0.00 0.00 32.58 27.88 2fwu s HIS 639 CO 0.12 -0.93 0.50 0.95 -2.00 0.00 0.00 174.74 173.37 2fwu s THR 640 N 0.50 4.14 -0.29 -5.38 -4.23 -1.26 -3.75 115.64 105.37 2fwu s THR 640 Ca 0.13 -2.76 -0.16 0.00 -1.18 0.00 0.00 61.69 57.73 2fwu s THR 640 Cb -0.20 -3.66 0.14 0.00 1.34 0.00 0.00 72.50 70.12 2fwu s THR 640 CO -0.04 -0.90 0.96 -0.75 -0.54 0.00 0.00 174.62 173.35 2fwu s LYS 641 N 0.11 0.39 -0.21 3.99 2.36 -1.26 -4.74 119.74 120.38 2fwu s LYS 641 Ca 0.16 0.69 0.01 0.00 -2.55 0.00 0.00 55.97 54.28 2fwu s LYS 641 Cb -0.18 0.11 0.05 0.00 -1.05 0.00 0.00 37.83 36.75 2fwu s LYS 641 CO -0.04 -0.09 -0.08 -1.17 1.55 0.00 0.00 175.35 175.52 2fwu s LEU 642 N 1.44 2.33 -0.46 5.43 2.96 -0.43 -4.21 118.68 125.75 2fwu s LEU 642 Ca -0.09 -0.98 -0.17 0.00 -0.22 0.00 0.00 54.13 52.68 2fwu s LEU 642 Cb -0.04 -1.17 0.05 0.00 0.50 0.00 0.00 46.19 45.53 2fwu s LEU 642 CO -0.15 -0.19 0.44 -0.70 -1.32 0.00 0.00 176.35 174.43 2fwu s GLU 643 N 1.42 3.03 -0.54 1.98 2.12 0.16 -0.95 118.70 125.93 2fwu s GLU 643 Ca -0.03 -1.06 -0.19 0.00 0.36 0.00 0.00 54.97 54.05 2fwu s GLU 643 Cb -0.17 -4.06 0.08 0.00 0.26 0.00 0.00 34.13 30.24 2fwu s GLU 643 CO -0.07 -0.98 0.63 0.08 -0.54 0.00 0.00 175.26 174.38 2fwu s VAL 644 N 1.96 4.89 -0.24 3.70 1.01 -0.86 -0.75 120.40 130.11 2fwu s VAL 644 Ca 0.08 -0.76 -0.20 0.00 0.00 0.00 0.00 61.98 61.10 2fwu s VAL 644 Cb -0.21 -4.36 -0.02 0.00 0.00 0.00 0.00 36.38 31.79 2fwu s VAL 644 CO 0.10 -0.91 0.62 -0.63 0.00 0.00 0.00 175.10 174.27 2fwu s ILE 645 N 2.54 5.00 -0.19 2.22 1.09 0.31 -3.23 121.20 128.95 2fwu s ILE 645 Ca 0.12 1.12 -0.07 0.00 -1.10 0.00 0.00 60.65 60.73 2fwu s ILE 645 Cb -0.22 -3.93 -0.04 0.00 -1.06 0.00 0.00 42.46 37.22 2fwu s ILE 645 CO 0.09 0.06 0.05 -0.63 -0.10 0.00 0.00 174.94 174.40 2fwu s ILE 646 N 2.33 4.59 0.24 2.92 1.09 -1.18 -1.07 121.20 130.11 2fwu s ILE 646 Ca 0.26 -0.10 -0.08 0.00 -1.10 0.00 0.00 60.65 59.63 2fwu s ILE 646 Cb -0.16 -3.07 -0.02 0.00 -1.06 0.00 0.00 42.46 38.16 2fwu s ILE 646 CO 0.09 0.45 0.35 -1.83 -0.10 0.00 0.00 174.94 173.90 2fwu s GLU 647 N 0.53 1.45 0.27 2.79 -1.05 -1.14 -4.50 118.70 117.05 2fwu s GLU 647 Ca 0.02 -1.43 -0.30 0.00 -0.15 0.00 0.00 54.97 53.11 2fwu s GLU 647 Cb -0.13 0.40 -0.14 0.00 -0.44 0.00 0.00 34.13 33.82 2fwu s GLU 647 CO 0.01 -0.56 1.23 0.39 0.95 0.00 0.00 175.26 177.28 2fwu n GLU 648 N -0.36 1.75 -2.53 -4.83 -0.58 -1.26 -2.37 120.64 110.47 2fwu n GLU 648 Ca -0.00 0.62 -0.41 0.00 -0.42 0.00 0.00 57.16 56.95 2fwu n GLU 648 Cb 0.63 -2.15 -0.02 0.00 -0.57 0.00 0.00 31.44 29.33 2fwu n GLU 648 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2fwu s SER 649 N -0.13 6.51 -0.07 1.62 0.15 -1.26 -4.41 113.70 116.10 2fwu s SER 649 Ca 0.63 -1.79 -0.09 0.00 0.70 0.00 0.00 55.95 55.40 2fwu s SER 649 Cb -0.67 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.03 2fwu s SER 649 CO 0.56 -1.50 -0.19 0.00 1.20 0.00 0.00 173.24 173.31 2fwu n TYR 650 N 9.14 0.00 -3.65 3.44 9.36 -1.26 -5.09 117.16 129.11 2fwu n TYR 650 Ca 0.40 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.60 2fwu n TYR 650 Cb 0.49 -0.32 -0.02 0.00 -0.63 0.00 0.00 39.34 38.86 2fwu n TYR 650 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2fwu s GLU 651 N -2.45 0.01 -0.34 2.98 2.12 -1.26 -5.12 118.70 114.63 2fwu s GLU 651 Ca -0.17 -0.00 0.04 0.00 0.36 0.00 0.00 54.97 55.20 2fwu s GLU 651 Cb 0.03 0.00 0.10 0.00 0.26 0.00 0.00 34.13 34.53 2fwu s GLU 651 CO 0.24 -0.00 0.06 -0.06 -0.54 0.00 0.00 175.26 174.95 2fwu s PHE 652 N -2.01 3.58 -0.94 5.30 0.08 -1.26 -5.02 117.98 117.71 2fwu s PHE 652 Ca 0.12 -2.91 -0.24 0.00 0.12 0.00 0.00 56.93 54.02 2fwu s PHE 652 Cb -0.01 -2.83 0.04 0.00 -0.57 0.00 0.00 43.02 39.65 2fwu s PHE 652 CO -0.02 -0.94 1.47 0.15 -0.10 0.00 0.00 175.22 175.78 2fwu s LYS 653 N 0.93 3.39 0.11 0.44 -0.14 -1.26 -4.94 119.74 118.27 2fwu s LYS 653 Ca 0.11 -0.82 -0.31 0.00 -1.36 0.00 0.00 55.97 53.59 2fwu s LYS 653 Cb -0.19 -5.07 -0.10 0.00 -1.68 0.00 0.00 37.83 30.79 2fwu s LYS 653 CO -0.09 -2.32 1.75 0.45 -0.76 0.00 0.00 175.35 174.38 2fwu s SER 654 N 5.10 6.49 -0.89 2.83 0.15 -1.26 -4.90 113.70 121.23 2fwu s SER 654 Ca 0.47 2.66 -0.25 0.00 0.70 0.00 0.00 55.95 59.53 2fwu s SER 654 Cb -0.03 -2.57 0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2fwu s SER 654 CO -0.03 -0.95 1.64 -0.89 1.20 0.00 0.00 173.24 174.21 2fwu s THR 655 N 2.61 3.66 -0.26 6.45 2.01 -1.26 -4.95 115.64 123.90 2fwu s THR 655 Ca 0.78 -0.33 -0.29 0.00 0.31 0.00 0.00 61.69 62.16 2fwu s THR 655 Cb -0.44 -4.54 -0.00 0.00 0.01 0.00 0.00 72.50 67.53 2fwu s THR 655 CO 0.35 -1.46 1.29 -0.69 -0.69 0.00 0.00 174.62 173.41 2fwu s VAL 656 N 7.33 4.18 0.00 3.82 1.01 -1.26 -4.59 120.40 130.89 2fwu s VAL 656 Ca 0.55 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.89 2fwu s VAL 656 Cb -0.05 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.22 2fwu s VAL 656 CO 0.01 -0.38 0.00 -0.67 0.00 0.00 0.00 175.10 174.06