#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 1.59 0.00 1.57 0.00 -1.26 -4.84 120.51 117.56 2fwu n ALA 502 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2fwu n ALA 502 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.30 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 0.00 2.45 3.03 0.00 0.00 -1.26 -4.20 105.19 105.21 2fwu n GLY 503 Ca 0.00 -1.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.90 1.81 -0.33 -0.61 1.09 -1.26 -4.50 121.20 115.50 2fwu s ILE 504 Ca 0.00 -1.11 0.01 0.00 -1.10 0.00 0.00 60.65 58.45 2fwu s ILE 504 Cb 0.00 -1.84 0.10 0.00 -1.06 0.00 0.00 42.46 39.66 2fwu s ILE 504 CO 0.00 0.20 0.10 -0.36 -0.10 0.00 0.00 174.94 174.79 2fwu s PHE 505 N 1.32 2.22 0.09 3.97 0.08 -1.24 -1.06 117.98 123.35 2fwu s PHE 505 Ca -0.01 -2.12 0.02 0.00 0.12 0.00 0.00 56.93 54.94 2fwu s PHE 505 Cb -0.16 -2.02 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 2fwu s PHE 505 CO -0.08 -0.88 -0.08 -0.08 -0.10 0.00 0.00 175.22 173.99 2fwu s THR 506 N 1.29 0.74 0.41 0.64 -1.32 -1.25 -0.18 115.64 115.97 2fwu s THR 506 Ca 0.11 -1.69 -0.12 0.00 -1.21 0.00 0.00 61.69 58.78 2fwu s THR 506 Cb -0.19 -1.39 -0.07 0.00 -1.51 0.00 0.00 72.50 69.34 2fwu s THR 506 CO -0.18 -0.69 0.79 -0.36 -2.21 0.00 0.00 174.62 171.97 2fwu s PHE 507 N -2.87 3.46 -0.07 9.09 0.08 -0.92 -0.68 117.98 126.07 2fwu s PHE 507 Ca 0.06 1.11 0.14 0.00 0.12 0.00 0.00 56.93 58.36 2fwu s PHE 507 Cb 0.00 -2.49 -0.09 0.00 -0.57 0.00 0.00 43.02 39.87 2fwu s PHE 507 CO -0.02 -0.12 1.12 1.49 -0.10 0.00 0.00 175.22 177.59 2fwu h GLU 508 N 1.31 0.00 -5.03 0.44 4.81 -1.36 -3.44 114.58 111.31 2fwu h GLU 508 Ca -0.47 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.10 2fwu h GLU 508 Cb 1.19 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 30.30 2fwu h GLU 508 CO 0.64 0.54 -0.71 -1.21 -0.73 0.00 0.00 179.01 177.54 2fwu s GLU 509 N -2.85 3.43 0.26 1.92 8.01 -1.26 -4.94 118.70 123.26 2fwu s GLU 509 Ca 0.00 -0.61 0.23 0.00 0.01 0.00 0.00 54.97 54.61 2fwu s GLU 509 Cb 0.08 -3.02 0.25 0.00 -4.31 0.00 0.00 34.13 27.14 2fwu s GLU 509 CO 0.79 -0.14 1.34 -1.00 0.01 0.00 0.00 175.26 176.26 2fwu h PRO 510 N 7.95 0.00 -2.82 0.39 0.13 -1.87 -3.41 132.00 132.37 2fwu h PRO 510 Ca -0.40 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.58 2fwu h PRO 510 Cb 1.17 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.02 2fwu h PRO 510 CO 0.60 0.00 -0.37 0.08 -0.23 0.00 0.00 178.00 178.08 2fwu s VAL 511 N -3.25 -0.03 0.02 1.56 1.01 -1.26 -1.10 120.40 117.34 2fwu s VAL 511 Ca 0.04 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.17 2fwu s VAL 511 Cb 0.09 -0.50 -0.02 0.00 0.00 0.00 0.00 36.38 35.95 2fwu s VAL 511 CO 0.72 0.04 -0.13 0.28 0.00 0.00 0.00 175.10 176.01 2fwu s THR 512 N 1.21 1.03 -0.14 3.92 -1.32 0.58 -4.87 115.64 116.05 2fwu s THR 512 Ca -0.08 -0.82 -0.02 0.00 -1.21 0.00 0.00 61.69 59.55 2fwu s THR 512 Cb -0.08 -0.92 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 2fwu s THR 512 CO -0.10 0.09 -0.05 -1.00 -2.21 0.00 0.00 174.62 171.35 2fwu s HIS 513 N -0.66 2.99 0.12 9.09 3.76 -1.26 -0.76 115.29 128.58 2fwu s HIS 513 Ca 0.02 -0.26 0.05 0.00 -0.15 0.00 0.00 55.06 54.72 2fwu s HIS 513 Cb -0.07 -1.90 -0.04 0.00 1.11 0.00 0.00 32.58 31.69 2fwu s HIS 513 CO 0.01 0.03 -0.13 0.14 -0.85 0.00 0.00 174.74 173.93 2fwu s VAL 514 N 0.12 1.24 0.46 -0.90 -7.23 -0.08 -4.95 120.40 109.07 2fwu s VAL 514 Ca -0.02 -1.71 -0.21 0.00 -1.81 0.00 0.00 61.98 58.24 2fwu s VAL 514 Cb -0.14 -1.50 -0.10 0.00 0.56 0.00 0.00 36.38 35.21 2fwu s VAL 514 CO 0.03 -0.45 1.00 -0.44 -0.31 0.00 0.00 175.10 174.93 2fwu s SER 515 N -2.47 6.59 0.30 4.85 0.01 -1.26 -1.02 113.70 120.71 2fwu s SER 515 Ca 0.08 1.83 0.12 0.00 1.31 0.00 0.00 55.95 59.29 2fwu s SER 515 Cb -0.04 -2.55 0.46 0.00 0.21 0.00 0.00 66.02 64.10 2fwu s SER 515 CO 0.02 -0.60 1.66 -0.08 0.41 0.00 0.00 173.24 174.65 2fwu h GLU 516 N 1.71 0.00 -3.00 12.44 4.81 -1.27 -3.35 114.58 125.92 2fwu h GLU 516 Ca -0.49 0.00 -0.73 0.00 -0.13 0.00 0.00 59.36 58.01 2fwu h GLU 516 Cb 1.20 0.00 -0.34 0.00 0.63 0.00 0.00 28.75 30.25 2fwu h GLU 516 CO 0.60 0.54 0.15 0.43 -0.73 0.00 0.00 179.01 180.00 2fwu n SER 517 N -3.79 4.96 -3.93 1.04 7.64 -1.26 -4.69 113.62 113.58 2fwu n SER 517 Ca -0.01 -3.27 -0.09 0.00 1.01 0.00 0.00 58.87 56.51 2fwu n SER 517 Cb 0.57 -1.08 -0.08 0.00 -1.01 0.00 0.00 64.21 62.61 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 -2.02 0.14 0.00 0.44 2.07 -1.26 -5.07 121.20 115.50 2fwu s ILE 518 Ca 0.32 -1.37 0.00 0.00 -1.41 0.00 0.00 60.65 58.18 2fwu s ILE 518 Cb 0.01 -1.48 0.00 0.00 0.13 0.00 0.00 42.46 41.11 2fwu s ILE 518 CO -0.03 -0.66 0.00 0.61 -1.91 0.00 0.00 174.94 172.95 2fwu n GLY 519 N -0.05 0.01 3.50 1.50 0.00 -1.26 -4.35 105.19 104.53 2fwu n GLY 519 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.43 4.11 -0.11 -0.61 -1.09 -1.26 -0.74 121.20 121.07 2fwu s ILE 520 Ca 0.00 -0.27 -0.05 0.00 -2.23 0.00 0.00 60.65 58.10 2fwu s ILE 520 Cb 0.00 -2.84 -0.04 0.00 -1.58 0.00 0.00 42.46 38.00 2fwu s ILE 520 CO 0.00 0.45 0.08 0.00 -1.23 0.00 0.00 174.94 174.24 2fwu s MET 521 N 0.72 3.24 0.20 2.79 0.23 0.08 -4.91 119.30 121.65 2fwu s MET 521 Ca 0.00 -0.25 0.09 0.00 -1.03 0.00 0.00 55.69 54.50 2fwu s MET 521 Cb -0.14 -3.02 -0.04 0.00 -1.53 0.00 0.00 34.83 30.10 2fwu s MET 521 CO 0.02 0.75 -0.06 -1.21 -2.03 0.00 0.00 175.02 172.48 2fwu s GLU 522 N -0.97 2.15 -0.05 3.16 2.02 -1.25 -1.64 118.70 122.12 2fwu s GLU 522 Ca 0.14 -1.28 -0.00 0.00 0.02 0.00 0.00 54.97 53.85 2fwu s GLU 522 Cb -0.12 -2.18 0.03 0.00 0.10 0.00 0.00 34.13 31.96 2fwu s GLU 522 CO 0.03 0.42 -0.01 0.08 0.02 0.00 0.00 175.26 175.80 2fwu s VAL 523 N -1.85 0.37 -0.09 2.63 1.01 -1.16 -4.90 120.40 116.42 2fwu s VAL 523 Ca 0.27 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 2fwu s VAL 523 Cb -0.08 -0.47 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 2fwu s VAL 523 CO 0.17 0.22 1.02 -0.54 0.00 0.00 0.00 175.10 175.96 2fwu s LYS 524 N 1.34 4.44 -0.20 2.72 -0.14 -1.26 -2.48 119.74 124.16 2fwu s LYS 524 Ca -0.05 1.41 -0.04 0.00 -1.36 0.00 0.00 55.97 55.94 2fwu s LYS 524 Cb -0.13 -3.53 -0.02 0.00 -1.68 0.00 0.00 37.83 32.47 2fwu s LYS 524 CO -0.02 -0.29 -0.03 0.08 -0.76 0.00 0.00 175.35 174.33 2fwu s VAL 525 N 1.88 3.59 0.34 3.17 1.01 -0.29 -0.94 120.40 129.16 2fwu s VAL 525 Ca 0.49 -0.43 -0.25 0.00 0.00 0.00 0.00 61.98 61.79 2fwu s VAL 525 Cb -0.19 -2.62 -0.10 0.00 0.00 0.00 0.00 36.38 33.47 2fwu s VAL 525 CO 0.20 0.43 0.97 -0.76 0.00 0.00 0.00 175.10 175.94 2fwu s LEU 526 N 1.18 4.28 0.31 3.92 2.01 0.14 -2.76 118.68 127.76 2fwu s LEU 526 Ca 0.02 1.88 -0.11 0.00 0.01 0.00 0.00 54.13 55.94 2fwu s LEU 526 Cb -0.14 -4.07 -0.07 0.00 0.01 0.00 0.00 46.19 41.91 2fwu s LEU 526 CO -0.00 -0.18 0.67 -0.60 1.01 0.00 0.00 176.35 177.25 2fwu s ARG 527 N -2.20 3.84 0.37 1.70 3.52 -1.26 -3.76 118.95 121.16 2fwu s ARG 527 Ca 0.52 0.41 -0.28 0.00 -0.13 0.00 0.00 55.73 56.26 2fwu s ARG 527 Cb -0.19 -2.51 -0.11 0.00 -1.56 0.00 0.00 34.95 30.58 2fwu s ARG 527 CO 0.24 0.16 1.51 -2.37 -0.81 0.00 0.00 175.30 174.03 2fwu n THR 528 N -0.61 1.93 -0.01 4.11 5.66 -0.23 -4.76 114.28 120.37 2fwu n THR 528 Ca 0.02 -0.48 -0.18 0.00 -3.05 0.00 0.00 64.05 60.36 2fwu n THR 528 Cb 0.53 -2.00 -0.08 0.00 -1.55 0.00 0.00 70.33 67.24 2fwu n THR 528 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 2fwu h SER 529 N 3.11 0.89 -1.14 1.09 0.87 -1.94 -3.23 113.55 113.20 2fwu h SER 529 Ca -0.51 -0.65 -0.66 0.00 -1.23 0.00 0.00 61.79 58.74 2fwu h SER 529 Cb 1.24 -0.26 -0.14 0.00 -0.44 0.00 0.00 62.40 62.79 2fwu h SER 529 CO 0.65 1.40 1.70 0.61 -0.53 0.00 0.00 176.83 180.67 2fwu n GLY 530 N 0.78 4.94 3.55 5.77 0.00 -1.26 -4.92 105.19 114.05 2fwu n GLY 530 Ca -0.08 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.55 2fwu n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fwu s ALA 531 N -1.41 2.18 -0.32 4.61 0.00 -1.22 -4.86 121.76 120.74 2fwu s ALA 531 Ca 0.55 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.84 2fwu s ALA 531 Cb 0.25 -4.31 0.10 0.00 0.00 0.00 0.00 23.12 19.16 2fwu s ALA 531 CO -0.14 -3.89 0.08 1.03 0.00 0.00 0.00 175.76 172.84 2fwu s ARG 532 N 7.00 1.02 0.00 0.00 1.81 -1.26 -4.62 118.95 122.90 2fwu s ARG 532 Ca 0.66 -1.37 0.00 0.00 -1.72 0.00 0.00 55.73 53.30 2fwu s ARG 532 Cb -0.12 -2.46 0.00 0.00 -0.45 0.00 0.00 34.95 31.92 2fwu s ARG 532 CO 0.20 -0.96 0.00 0.41 -0.68 0.00 0.00 175.30 174.27 2fwu n GLY 533 N 4.62 1.91 3.68 -3.53 0.00 -1.26 -4.92 105.19 105.69 2fwu n GLY 533 Ca 0.00 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 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 0.00 7.17 -0.02 1.61 3.04 -1.26 -3.02 114.94 122.47 2fwu s ASN 534 Ca 0.00 1.49 0.06 0.00 0.04 0.00 0.00 52.86 54.45 2fwu s ASN 534 Cb 0.00 -2.55 -0.01 0.00 -1.54 0.00 0.00 41.25 37.15 2fwu s ASN 534 CO 0.00 -0.55 -0.20 -0.69 -3.04 0.00 0.00 177.10 172.62 2fwu s VAL 535 N 2.53 1.61 -0.11 -5.21 1.01 0.76 -0.55 120.40 120.43 2fwu s VAL 535 Ca 0.47 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 2fwu s VAL 535 Cb -0.17 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2fwu s VAL 535 CO 0.13 0.45 0.05 -0.63 0.00 0.00 0.00 175.10 175.11 2fwu s ILE 536 N -0.43 4.77 -0.28 2.22 -1.09 0.99 -0.02 121.20 127.37 2fwu s ILE 536 Ca 0.07 -0.07 0.02 0.00 -2.23 0.00 0.00 60.65 58.43 2fwu s ILE 536 Cb -0.08 -3.05 0.06 0.00 -1.58 0.00 0.00 42.46 37.81 2fwu s ILE 536 CO -0.00 0.60 -0.05 -0.69 -1.23 0.00 0.00 174.94 173.56 2fwu s VAL 537 N -0.83 2.43 0.26 2.92 1.01 0.56 0.35 120.40 127.10 2fwu s VAL 537 Ca 0.13 -1.67 -0.30 0.00 0.00 0.00 0.00 61.98 60.15 2fwu s VAL 537 Cb -0.12 -2.47 -0.09 0.00 0.00 0.00 0.00 36.38 33.70 2fwu s VAL 537 CO 0.03 -0.14 1.12 -2.16 0.00 0.00 0.00 175.10 173.95 2fwu s PRO 538 N 1.12 4.60 0.11 2.72 0.04 -1.26 0.10 135.00 142.43 2fwu s PRO 538 Ca -0.05 1.82 -0.08 0.00 0.04 0.00 0.00 61.00 62.73 2fwu s PRO 538 Cb -0.20 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 2fwu s PRO 538 CO -0.04 0.14 0.20 1.52 0.04 0.00 0.00 177.00 178.85 2fwu s TYR 539 N -0.91 0.26 -0.07 0.56 1.13 -0.15 0.07 117.35 118.24 2fwu s TYR 539 Ca 0.46 -0.68 -0.23 0.00 -1.41 0.00 0.00 57.07 55.22 2fwu s TYR 539 Cb -0.32 -0.09 0.05 0.00 -1.10 0.00 0.00 41.96 40.50 2fwu s TYR 539 CO 0.40 -0.58 0.52 -1.59 -2.51 0.00 0.00 175.55 171.80 2fwu s LYS 540 N -3.90 0.83 -0.00 -3.49 0.00 -0.57 -1.70 119.74 110.91 2fwu s LYS 540 Ca 0.09 0.22 -0.25 0.00 0.00 0.00 0.00 55.97 56.03 2fwu s LYS 540 Cb 0.05 0.39 -0.04 0.00 0.00 0.00 0.00 37.83 38.22 2fwu s LYS 540 CO -0.08 -0.22 0.77 0.95 0.00 0.00 0.00 175.35 176.77 2fwu s THR 541 N -0.89 4.86 -0.21 3.79 -4.23 -0.85 -2.05 115.64 116.06 2fwu s THR 541 Ca -0.09 1.62 -0.17 0.00 -1.18 0.00 0.00 61.69 61.87 2fwu s THR 541 Cb -0.03 -4.11 -0.04 0.00 1.34 0.00 0.00 72.50 69.66 2fwu s THR 541 CO 0.06 0.30 0.44 -0.63 -0.54 0.00 0.00 174.62 174.24 2fwu s ILE 542 N 0.39 5.16 0.11 2.99 1.09 0.12 -4.91 121.20 126.15 2fwu s ILE 542 Ca 0.40 0.77 -0.25 0.00 -1.10 0.00 0.00 60.65 60.47 2fwu s ILE 542 Cb -0.20 -3.76 -0.10 0.00 -1.06 0.00 0.00 42.46 37.35 2fwu s ILE 542 CO 0.22 0.21 1.67 -0.33 -0.10 0.00 0.00 174.94 176.62 2fwu h GLU 543 N 7.50 -0.30 0.00 2.79 3.07 -1.86 -2.41 114.58 123.37 2fwu h GLU 543 Ca -0.35 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.53 2fwu h GLU 543 Cb 1.16 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 2fwu h GLU 543 CO 0.72 -0.20 0.00 0.41 -1.40 0.00 0.00 179.01 178.54 2fwu n GLY 544 N -1.29 1.46 0.00 -3.84 0.00 -1.26 -0.97 105.19 99.29 2fwu n GLY 544 Ca -0.07 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 0.19 -3.57 2.61 5.66 -1.25 -5.07 114.28 112.85 2fwu n THR 545 Ca 0.00 -0.27 -0.24 0.00 -3.05 0.00 0.00 64.05 60.49 2fwu n THR 545 Cb 0.00 1.19 0.02 0.00 -1.55 0.00 0.00 70.33 70.00 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 -0.19 4.55 -0.09 1.79 0.00 -0.15 -4.91 121.76 122.76 2fwu s ALA 546 Ca 0.00 -1.58 0.01 0.00 0.00 0.00 0.00 51.96 50.39 2fwu s ALA 546 Cb 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 23.12 22.14 2fwu s ALA 546 CO 0.00 -0.61 -0.10 0.50 0.00 0.00 0.00 175.76 175.55 2fwu s ARG 547 N -4.43 1.63 0.00 0.00 3.00 -1.26 -4.76 118.95 113.13 2fwu s ARG 547 Ca 0.44 -0.33 0.00 0.00 -1.00 0.00 0.00 55.73 54.84 2fwu s ARG 547 Cb -0.03 -1.53 0.00 0.00 0.00 0.00 0.00 34.95 33.39 2fwu s ARG 547 CO 0.28 -0.14 0.00 0.41 0.00 0.00 0.00 175.30 175.84 2fwu n GLY 548 N 4.46 0.86 2.42 8.12 0.00 -1.26 -0.85 105.19 118.94 2fwu n GLY 548 Ca -0.17 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 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 5.00 1.39 2.02 -0.02 0.00 -1.24 -2.23 105.19 110.10 2fwu n GLY 549 Ca 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.20 0.34 0.11 -0.02 0.00 -0.73 -4.98 105.19 98.72 2fwu n GLY 550 Ca -0.13 -0.69 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 2fwu n GLY 550 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fwu n GLU 551 N -1.31 0.21 -0.10 1.61 4.07 -0.95 -4.80 120.64 119.37 2fwu n GLU 551 Ca -0.03 0.08 -0.12 0.00 -0.06 0.00 0.00 57.16 57.03 2fwu n GLU 551 Cb 0.53 -0.85 -0.13 0.00 -0.06 0.00 0.00 31.44 30.93 2fwu n GLU 551 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2fwu n ASP 552 N -3.30 1.06 -3.89 4.31 -0.08 -0.03 -4.59 116.55 110.02 2fwu n ASP 552 Ca -0.06 -0.05 -0.09 0.00 -1.51 0.00 0.00 54.79 53.08 2fwu n ASP 552 Cb 0.21 0.42 -0.06 0.00 2.34 0.00 0.00 41.12 44.02 2fwu n ASP 552 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 2fwu s PHE 553 N -2.47 0.25 -0.39 -0.67 -0.71 -1.04 -2.39 117.98 110.56 2fwu s PHE 553 Ca -0.19 -0.61 -0.18 0.00 -1.04 0.00 0.00 56.93 54.91 2fwu s PHE 553 Cb 0.07 0.05 0.01 0.00 -1.21 0.00 0.00 43.02 41.94 2fwu s PHE 553 CO 0.69 -0.75 0.50 -2.00 -1.34 0.00 0.00 175.22 172.32 2fwu s GLU 554 N -3.93 3.37 -0.67 1.99 -6.30 -0.07 -1.77 118.70 111.32 2fwu s GLU 554 Ca 0.14 -0.42 -0.27 0.00 -2.50 0.00 0.00 54.97 51.92 2fwu s GLU 554 Cb 0.02 -3.89 0.02 0.00 0.00 0.00 0.00 34.13 30.28 2fwu s GLU 554 CO -0.02 -0.78 1.44 0.16 0.02 0.00 0.00 175.26 176.08 2fwu s ASP 555 N 1.83 5.95 -0.23 -1.70 -4.77 -1.26 -4.34 116.67 112.14 2fwu s ASP 555 Ca 0.17 -0.12 -0.19 0.00 -3.30 0.00 0.00 52.55 49.11 2fwu s ASP 555 Cb -0.16 -2.55 -0.03 0.00 -1.09 0.00 0.00 42.92 39.10 2fwu s ASP 555 CO 0.15 -1.94 0.54 0.28 0.70 0.00 0.00 175.17 174.90 2fwu s THR 556 N 6.57 5.07 -0.07 2.11 -1.32 -1.26 -4.86 115.64 121.87 2fwu s THR 556 Ca 0.46 0.97 -0.02 0.00 -1.21 0.00 0.00 61.69 61.89 2fwu s THR 556 Cb -0.10 -3.86 0.03 0.00 -1.51 0.00 0.00 72.50 67.07 2fwu s THR 556 CO 0.18 0.11 0.02 0.00 -2.21 0.00 0.00 174.62 172.73 2fwu n GLY 558 N 5.19 2.06 2.86 0.00 0.00 -0.69 -5.00 105.19 109.62 2fwu n GLY 558 Ca -0.06 -0.45 -0.20 0.00 0.00 0.00 0.00 46.02 45.31 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 1.71 0.72 0.38 1.61 2.02 -1.26 -0.98 118.70 122.90 2fwu s GLU 559 Ca 0.00 -0.04 -0.08 0.00 0.02 0.00 0.00 54.97 54.87 2fwu s GLU 559 Cb 0.00 -0.83 -0.06 0.00 0.10 0.00 0.00 34.13 33.35 2fwu s GLU 559 CO 0.00 -0.14 0.71 -0.51 0.02 0.00 0.00 175.26 175.34 2fwu s LEU 560 N 1.16 3.87 -0.16 1.80 1.43 0.12 -4.85 118.68 122.04 2fwu s LEU 560 Ca -0.07 0.97 0.01 0.00 -1.03 0.00 0.00 54.13 54.01 2fwu s LEU 560 Cb -0.14 -3.85 0.02 0.00 0.03 0.00 0.00 46.19 42.26 2fwu s LEU 560 CO -0.01 -0.37 -0.15 -0.70 0.23 0.00 0.00 176.35 175.35 2fwu s GLU 561 N -3.90 2.43 0.08 1.70 2.12 -1.26 -0.32 118.70 119.55 2fwu s GLU 561 Ca 0.48 -0.66 0.07 0.00 0.36 0.00 0.00 54.97 55.22 2fwu s GLU 561 Cb -0.10 -2.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.99 2fwu s GLU 561 CO 0.33 -0.26 -0.12 -0.06 -0.54 0.00 0.00 175.26 174.61 2fwu s PHE 562 N 1.43 2.69 0.29 5.30 0.08 0.98 -4.99 117.98 123.76 2fwu s PHE 562 Ca 0.04 -0.18 0.05 0.00 0.12 0.00 0.00 56.93 56.96 2fwu s PHE 562 Cb -0.13 -1.44 -0.06 0.00 -0.57 0.00 0.00 43.02 40.81 2fwu s PHE 562 CO -0.11 0.38 0.01 -0.65 -0.10 0.00 0.00 175.22 174.75 2fwu s GLN 563 N -1.96 1.56 0.50 0.44 -0.21 -1.25 -0.17 119.66 118.56 2fwu s GLN 563 Ca 0.19 -1.83 0.26 0.00 0.02 0.00 0.00 55.36 54.00 2fwu s GLN 563 Cb -0.11 -0.91 1.29 0.00 1.00 0.00 0.00 33.01 34.28 2fwu s GLN 563 CO 0.11 -0.10 2.00 -2.95 -2.12 0.00 0.00 175.29 172.22 2fwu h ASN 564 N 2.23 0.00 -0.01 5.90 7.08 -1.79 -2.49 115.58 126.49 2fwu h ASN 564 Ca -0.40 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.82 2fwu h ASN 564 Cb 1.24 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.48 2fwu h ASN 564 CO 0.68 0.15 -0.44 -0.67 -2.08 0.00 0.00 177.43 175.08 2fwu n ASP 565 N -3.56 1.78 -4.39 6.14 2.03 -1.26 -4.90 116.55 112.39 2fwu n ASP 565 Ca -0.01 -1.39 -0.33 0.00 0.52 0.00 0.00 54.79 53.58 2fwu n ASP 565 Cb 0.30 0.51 -0.14 0.00 -0.72 0.00 0.00 41.12 41.06 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 -2.24 2.88 0.34 -0.67 2.12 -0.94 -5.11 118.70 115.08 2fwu s GLU 566 Ca 0.15 -0.73 0.09 0.00 0.36 0.00 0.00 54.97 54.84 2fwu s GLU 566 Cb 0.16 -2.44 -0.05 0.00 0.26 0.00 0.00 34.13 32.06 2fwu s GLU 566 CO 0.51 0.40 0.06 0.96 -0.54 0.00 0.00 175.26 176.66 2fwu s ILE 567 N -0.17 2.83 0.27 -3.70 -4.36 -1.26 -3.88 121.20 110.92 2fwu s ILE 567 Ca -0.01 -1.85 0.00 0.00 -0.26 0.00 0.00 60.65 58.52 2fwu s ILE 567 Cb -0.14 -2.87 0.00 0.00 1.25 0.00 0.00 42.46 40.70 2fwu s ILE 567 CO 0.03 -0.20 0.00 0.55 0.24 0.00 0.00 174.94 175.56 2fwu n VAL 568 N -1.03 -0.20 -3.46 8.37 3.14 -1.26 -5.02 118.33 118.86 2fwu n VAL 568 Ca -0.04 0.34 -0.11 0.00 -2.96 0.00 0.00 64.34 61.57 2fwu n VAL 568 Cb 0.62 -0.58 -0.02 0.00 -1.06 0.00 0.00 33.84 32.80 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 -3.79 1.26 -0.05 1.45 2.47 -1.11 -4.95 119.74 115.01 2fwu s LYS 569 Ca 0.00 -0.49 0.01 0.00 -1.56 0.00 0.00 55.97 53.93 2fwu s LYS 569 Cb 0.00 0.56 0.02 0.00 -1.46 0.00 0.00 37.83 36.95 2fwu s LYS 569 CO 0.00 -0.55 -0.04 0.95 0.16 0.00 0.00 175.35 175.86 2fwu s THR 570 N -3.68 0.58 -0.06 3.43 -4.23 -1.24 -1.14 115.64 109.30 2fwu s THR 570 Ca 0.02 -0.12 -0.30 0.00 -1.18 0.00 0.00 61.69 60.12 2fwu s THR 570 Cb -0.01 -0.62 -0.03 0.00 1.34 0.00 0.00 72.50 73.18 2fwu s THR 570 CO -0.11 0.25 1.15 -0.63 -0.54 0.00 0.00 174.62 174.74 2fwu s ILE 571 N 1.11 4.39 -0.42 2.99 1.09 -1.03 -4.78 121.20 124.54 2fwu s ILE 571 Ca -0.08 1.70 -0.15 0.00 -1.10 0.00 0.00 60.65 61.02 2fwu s ILE 571 Cb -0.14 -4.09 0.03 0.00 -1.06 0.00 0.00 42.46 37.19 2fwu s ILE 571 CO -0.01 0.00 0.34 -0.44 -0.10 0.00 0.00 174.94 174.73 2fwu s SER 572 N 1.36 6.13 -0.20 3.58 0.01 -1.26 -2.97 113.70 120.36 2fwu s SER 572 Ca 0.54 -0.92 -0.01 0.00 1.31 0.00 0.00 55.95 56.87 2fwu s SER 572 Cb -0.23 -2.17 0.01 0.00 0.21 0.00 0.00 66.02 63.83 2fwu s SER 572 CO 0.21 -0.50 -0.13 -0.69 0.41 0.00 0.00 173.24 172.54 2fwu s VAL 573 N 1.76 2.64 -0.09 3.43 1.01 -0.65 -4.87 120.40 123.62 2fwu s VAL 573 Ca 0.06 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 61.02 2fwu s VAL 573 Cb -0.19 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 2fwu s VAL 573 CO 0.10 0.49 0.91 -0.75 0.00 0.00 0.00 175.10 175.85 2fwu s LYS 574 N 1.37 4.42 -0.04 2.72 2.20 -1.26 -0.74 119.74 128.41 2fwu s LYS 574 Ca 0.05 1.23 -0.18 0.00 -0.36 0.00 0.00 55.97 56.71 2fwu s LYS 574 Cb -0.14 -3.52 -0.05 0.00 -1.51 0.00 0.00 37.83 32.61 2fwu s LYS 574 CO -0.09 -0.21 0.49 0.08 -0.36 0.00 0.00 175.35 175.26 2fwu s VAL 575 N 1.66 5.04 0.25 4.02 1.01 0.08 -0.89 120.40 131.58 2fwu s VAL 575 Ca 0.45 1.00 0.07 0.00 0.00 0.00 0.00 61.98 63.49 2fwu s VAL 575 Cb -0.18 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2fwu s VAL 575 CO 0.19 0.44 0.20 -0.63 0.00 0.00 0.00 175.10 175.30 2fwu s ILE 576 N -0.20 4.46 0.16 2.22 -1.09 -1.00 -4.72 121.20 121.03 2fwu s ILE 576 Ca 0.26 -1.39 -0.31 0.00 -2.23 0.00 0.00 60.65 56.98 2fwu s ILE 576 Cb -0.17 -3.41 -0.09 0.00 -1.58 0.00 0.00 42.46 37.22 2fwu s ILE 576 CO 0.13 -0.35 1.37 1.51 -1.23 0.00 0.00 174.94 176.37 2fwu s ASP 577 N -3.85 6.83 0.16 3.58 -4.77 -1.26 -4.75 116.67 112.61 2fwu s ASP 577 Ca 0.33 2.40 -0.32 0.00 -3.30 0.00 0.00 52.55 51.66 2fwu s ASP 577 Cb -0.08 -2.60 -0.11 0.00 -1.09 0.00 0.00 42.92 39.05 2fwu s ASP 577 CO 0.25 -0.61 1.67 -1.81 0.70 0.00 0.00 175.17 175.36 2fwu s ASP 578 N 0.74 6.49 0.00 2.11 1.01 -1.26 -4.76 116.67 120.99 2fwu s ASP 578 Ca 0.61 2.71 0.24 0.00 0.71 0.00 0.00 52.55 56.82 2fwu s ASP 578 Cb -0.37 -2.59 0.15 0.00 1.01 0.00 0.00 42.92 41.12 2fwu s ASP 578 CO 0.35 -0.91 1.22 -1.84 0.21 0.00 0.00 175.17 174.20 2fwu n GLU 579 N 4.38 2.12 -3.16 8.23 -0.00 -1.26 -4.99 120.64 125.95 2fwu n GLU 579 Ca 0.15 -1.76 -0.11 0.00 -0.00 0.00 0.00 57.16 55.45 2fwu n GLU 579 Cb 0.37 -1.46 -0.04 0.00 -0.00 0.00 0.00 31.44 30.32 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 1.11 0.36 -1.59 3.44 0.00 -1.26 -5.14 120.64 117.56 2fwu n GLU 580 Ca 0.13 -1.71 -0.34 0.00 0.00 0.00 0.00 57.16 55.24 2fwu n GLU 580 Cb 0.57 1.27 0.07 0.00 0.00 0.00 0.00 31.44 33.35 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 -2.58 2.30 0.36 -1.84 -0.85 -1.26 -5.00 117.35 108.47 2fwu s TYR 581 Ca 0.17 1.58 -0.13 0.00 -0.52 0.00 0.00 57.07 58.18 2fwu s TYR 581 Cb 0.01 -3.34 -0.08 0.00 0.38 0.00 0.00 41.96 38.93 2fwu s TYR 581 CO 0.12 -2.20 0.75 -1.21 -1.52 0.00 0.00 175.55 171.49 2fwu s GLU 582 N -3.96 3.89 0.30 -3.49 0.41 -1.26 -5.06 118.70 109.54 2fwu s GLU 582 Ca 0.71 0.57 -0.17 0.00 -0.41 0.00 0.00 54.97 55.67 2fwu s GLU 582 Cb -0.25 -2.41 0.02 0.00 -1.78 0.00 0.00 34.13 29.71 2fwu s GLU 582 CO 0.43 0.06 0.68 -1.59 -0.49 0.00 0.00 175.26 174.35 2fwu s LYS 583 N -3.39 1.86 -0.80 1.61 -2.85 -1.26 -5.08 119.74 109.83 2fwu s LYS 583 Ca 0.53 -1.20 -0.26 0.00 -1.00 0.00 0.00 55.97 54.04 2fwu s LYS 583 Cb -0.10 0.58 0.04 0.00 -2.06 0.00 0.00 37.83 36.28 2fwu s LYS 583 CO 0.24 -0.84 1.29 1.21 0.10 0.00 0.00 175.35 177.35 2fwu s ASN 584 N -3.00 6.24 -0.08 0.03 3.84 -1.26 -4.96 114.94 115.76 2fwu s ASN 584 Ca 0.15 -0.73 0.02 0.00 0.21 0.00 0.00 52.86 52.51 2fwu s ASN 584 Cb -0.04 -2.55 -0.02 0.00 -0.55 0.00 0.00 41.25 38.08 2fwu s ASN 584 CO 0.09 -1.73 -0.13 -0.75 -2.79 0.00 0.00 177.10 171.80 2fwu s LYS 585 N 5.40 2.88 -0.06 0.43 2.36 -1.26 -5.08 119.74 124.41 2fwu s LYS 585 Ca 0.36 -0.68 -0.17 0.00 -2.55 0.00 0.00 55.97 52.94 2fwu s LYS 585 Cb -0.07 -2.50 0.03 0.00 -1.05 0.00 0.00 37.83 34.24 2fwu s LYS 585 CO 0.09 0.46 0.38 -0.08 1.55 0.00 0.00 175.35 177.76 2fwu s THR 586 N -0.31 0.03 0.20 3.43 -1.32 -1.26 -2.84 115.64 113.57 2fwu s THR 586 Ca 0.03 -0.27 0.10 0.00 -1.21 0.00 0.00 61.69 60.34 2fwu s THR 586 Cb -0.13 -0.65 -0.04 0.00 -1.51 0.00 0.00 72.50 70.17 2fwu s THR 586 CO 0.03 -0.15 -0.21 0.72 -2.21 0.00 0.00 174.62 172.80 2fwu s PHE 587 N -0.85 2.09 0.03 9.09 -0.12 -1.09 -3.89 117.98 123.25 2fwu s PHE 587 Ca -0.09 -0.40 0.04 0.00 -0.05 0.00 0.00 56.93 56.42 2fwu s PHE 587 Cb -0.04 -1.02 -0.04 0.00 -0.63 0.00 0.00 43.02 41.30 2fwu s PHE 587 CO 0.04 0.46 -0.06 -0.06 -0.05 0.00 0.00 175.22 175.55 2fwu s PHE 588 N -1.98 2.89 -0.20 3.49 0.08 -0.91 -0.82 117.98 120.53 2fwu s PHE 588 Ca 0.20 -0.05 -0.01 0.00 0.12 0.00 0.00 56.93 57.19 2fwu s PHE 588 Cb -0.06 -1.58 0.01 0.00 -0.57 0.00 0.00 43.02 40.81 2fwu s PHE 588 CO 0.09 0.40 -0.12 -1.17 -0.10 0.00 0.00 175.22 174.32 2fwu s LEU 589 N -1.64 2.53 -0.02 -0.37 1.98 -0.31 0.13 118.68 120.98 2fwu s LEU 589 Ca 0.19 -0.56 0.05 0.00 -2.89 0.00 0.00 54.13 50.92 2fwu s LEU 589 Cb -0.11 -1.60 -0.01 0.00 0.66 0.00 0.00 46.19 45.12 2fwu s LEU 589 CO 0.10 -0.02 -0.19 -0.70 -1.89 0.00 0.00 176.35 173.65 2fwu s GLU 590 N 1.37 1.61 0.09 1.98 2.12 -0.87 -2.46 118.70 122.54 2fwu s GLU 590 Ca 0.05 -0.66 0.02 0.00 0.36 0.00 0.00 54.97 54.74 2fwu s GLU 590 Cb -0.14 -1.51 -0.04 0.00 0.26 0.00 0.00 34.13 32.70 2fwu s GLU 590 CO -0.08 0.37 0.13 0.96 -0.54 0.00 0.00 175.26 176.10 2fwu s ILE 591 N -0.32 4.80 0.00 -3.70 -4.36 -1.26 -1.52 121.20 114.84 2fwu s ILE 591 Ca 0.04 -0.71 0.00 0.00 -0.26 0.00 0.00 60.65 59.73 2fwu s ILE 591 Cb -0.08 -3.35 0.00 0.00 1.25 0.00 0.00 42.46 40.28 2fwu s ILE 591 CO 0.00 0.08 0.00 0.61 0.24 0.00 0.00 174.94 175.87 2fwu n GLY 592 N 0.23 1.59 3.63 6.27 0.00 0.11 -4.97 105.19 112.06 2fwu n GLY 592 Ca -0.08 -1.77 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 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 2.74 4.14 0.61 1.61 2.12 -1.26 -4.78 118.70 123.87 2fwu s GLU 593 Ca 0.00 0.80 -0.19 0.00 0.36 0.00 0.00 54.97 55.94 2fwu s GLU 593 Cb 0.00 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 2fwu s GLU 593 CO 0.00 -0.51 1.14 -0.35 -0.54 0.00 0.00 175.26 175.00 2fwu n PRO 594 N 5.96 1.10 -4.62 4.30 -0.04 -1.25 -4.52 135.00 135.93 2fwu n PRO 594 Ca 0.04 0.42 -0.24 0.00 -0.04 0.00 0.00 63.50 63.68 2fwu n PRO 594 Cb 0.48 -2.36 -0.16 0.00 -0.04 0.00 0.00 33.50 31.42 2fwu n PRO 594 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2fwu s ARG 595 N -2.98 1.57 -0.01 0.54 1.70 0.16 -4.03 118.95 115.88 2fwu s ARG 595 Ca 0.78 -0.45 -0.30 0.00 -0.47 0.00 0.00 55.73 55.29 2fwu s ARG 595 Cb -0.41 -1.34 -0.03 0.00 -0.57 0.00 0.00 34.95 32.60 2fwu s ARG 595 CO 0.45 0.11 1.09 -1.17 -1.08 0.00 0.00 175.30 174.70 2fwu s LEU 596 N 0.37 4.33 0.04 -1.89 1.98 -1.26 -0.00 118.68 122.25 2fwu s LEU 596 Ca -0.09 1.77 -0.16 0.00 -2.89 0.00 0.00 54.13 52.75 2fwu s LEU 596 Cb -0.13 -3.57 -0.24 0.00 0.66 0.00 0.00 46.19 42.91 2fwu s LEU 596 CO 0.03 -0.42 1.14 0.58 -1.89 0.00 0.00 176.35 175.78 2fwu h VAL 597 N 4.82 1.34 -3.37 1.68 2.07 -1.18 -3.44 116.25 118.17 2fwu h VAL 597 Ca -0.38 -2.22 -0.56 0.00 0.82 0.00 0.00 66.70 64.37 2fwu h VAL 597 Cb 1.19 2.52 -0.05 0.00 -1.52 0.00 0.00 31.29 33.44 2fwu h VAL 597 CO 0.81 0.67 0.15 -1.61 0.02 0.00 0.00 177.57 177.62 2fwu s GLU 598 N -3.21 4.44 -0.03 1.57 2.02 -1.25 -4.98 118.70 117.25 2fwu s GLU 598 Ca -0.11 0.97 -0.30 0.00 0.02 0.00 0.00 54.97 55.55 2fwu s GLU 598 Cb 0.05 -3.46 -0.06 0.00 0.10 0.00 0.00 34.13 30.76 2fwu s GLU 598 CO 0.88 0.01 1.59 0.00 0.02 0.00 0.00 175.26 177.76 2fwu s MET 599 N 0.96 4.20 -0.56 1.61 0.23 -1.26 -4.95 119.30 119.54 2fwu s MET 599 Ca 0.40 2.14 0.03 0.00 -1.03 0.00 0.00 55.69 57.23 2fwu s MET 599 Cb -0.18 -3.85 0.14 0.00 -1.53 0.00 0.00 34.83 29.42 2fwu s MET 599 CO 0.19 -0.78 0.32 -1.54 -2.03 0.00 0.00 175.02 171.19 2fwu s SER 600 N 2.88 4.55 -0.94 -1.18 1.04 -1.26 -5.03 113.70 113.76 2fwu s SER 600 Ca 0.71 -3.09 -0.24 0.00 0.48 0.00 0.00 55.95 53.81 2fwu s SER 600 Cb -0.33 -1.68 0.02 0.00 0.10 0.00 0.00 66.02 64.13 2fwu s SER 600 CO 0.29 -0.24 1.55 -0.70 0.98 0.00 0.00 173.24 175.11 2fwu s GLU 601 N -0.40 3.29 -1.27 4.02 2.12 -1.26 -4.88 118.70 120.32 2fwu s GLU 601 Ca 0.18 -0.76 -0.15 0.00 0.36 0.00 0.00 54.97 54.60 2fwu s GLU 601 Cb -0.23 -5.10 0.12 0.00 0.26 0.00 0.00 34.13 29.18 2fwu s GLU 601 CO -0.02 -2.46 1.65 0.36 -0.54 0.00 0.00 175.26 174.24 2fwu n LYS 602 N 8.96 3.28 -2.06 4.30 2.85 -1.26 -4.96 118.16 129.27 2fwu n LYS 602 Ca 0.30 -3.51 -0.32 0.00 -1.05 0.00 0.00 58.31 53.74 2fwu n LYS 602 Cb 0.50 -3.24 -0.00 0.00 -0.65 0.00 0.00 35.03 31.64 2fwu n LYS 602 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 2fwu s LYS 603 N 2.68 3.68 0.00 -1.58 -2.85 -1.26 -2.40 119.74 118.00 2fwu s LYS 603 Ca 0.47 0.87 0.00 0.00 -1.00 0.00 0.00 55.97 56.31 2fwu s LYS 603 Cb 0.02 -2.09 0.00 0.00 -2.06 0.00 0.00 37.83 33.70 2fwu s LYS 603 CO 0.03 -0.50 0.00 0.41 0.10 0.00 0.00 175.35 175.39 2fwu n GLY 604 N -2.15 2.99 0.13 0.59 0.00 -1.26 -4.60 105.19 100.90 2fwu n GLY 604 Ca 0.06 -0.80 -0.21 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 -0.54 3.92 -0.02 0.00 -1.26 -4.91 105.19 102.39 2fwu n GLY 605 Ca 0.00 -0.22 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.53 3.48 0.74 1.61 0.40 -1.01 -5.10 117.98 115.58 2fwu s PHE 606 Ca -0.26 0.34 -0.08 0.00 -0.60 0.00 0.00 56.93 56.33 2fwu s PHE 606 Cb 0.07 -1.85 0.16 0.00 0.51 0.00 0.00 43.02 41.92 2fwu s PHE 606 CO 0.71 0.41 1.02 0.25 0.70 0.00 0.00 175.22 178.31 2fwu n THR 607 N -0.48 0.00 -2.21 0.64 -2.24 -1.26 -4.35 114.28 104.38 2fwu n THR 607 Ca -0.05 -1.09 -0.41 0.00 -2.27 0.00 0.00 64.05 60.23 2fwu n THR 607 Cb 0.53 -1.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.48 2fwu n THR 607 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2fwu n ILE 608 N -3.15 5.13 -3.74 2.28 2.08 -1.26 -4.86 119.36 115.85 2fwu n ILE 608 Ca 0.14 -4.62 -0.13 0.00 0.56 0.00 0.00 62.75 58.70 2fwu n ILE 608 Cb 0.51 -2.09 -0.11 0.00 -0.75 0.00 0.00 39.64 37.20 2fwu n ILE 608 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 2fwu s THR 609 N -1.23 -0.01 -1.04 1.39 2.01 -1.26 -5.09 115.64 110.41 2fwu s THR 609 Ca 0.47 0.02 -0.07 0.00 0.31 0.00 0.00 61.69 62.42 2fwu s THR 609 Cb 0.16 -0.53 0.26 0.00 0.01 0.00 0.00 72.50 72.40 2fwu s THR 609 CO -0.06 0.01 1.01 -1.61 -0.69 0.00 0.00 174.62 173.28 2fwu s GLU 610 N 0.45 3.94 0.06 4.92 8.01 -1.26 -5.00 118.70 129.83 2fwu s GLU 610 Ca -0.02 -3.20 0.02 0.00 0.01 0.00 0.00 54.97 51.78 2fwu s GLU 610 Cb -0.04 -4.40 -0.03 0.00 -4.31 0.00 0.00 34.13 25.35 2fwu s GLU 610 CO -0.02 -1.25 -0.07 -1.21 0.01 0.00 0.00 175.26 172.72 2fwu s GLU 611 N -1.22 0.62 -1.37 1.61 0.41 -1.26 -4.86 118.70 112.63 2fwu s GLU 611 Ca 0.29 -0.98 0.00 0.00 -0.41 0.00 0.00 54.97 53.87 2fwu s GLU 611 Cb -0.09 -0.19 0.00 0.00 -1.78 0.00 0.00 34.13 32.06 2fwu s GLU 611 CO -0.09 0.01 0.00 0.66 -0.49 0.00 0.00 175.26 175.35 2fwu n TYR 612 N 0.85 -0.55 -4.76 1.61 4.01 -1.26 -4.99 117.16 112.08 2fwu n TYR 612 Ca -0.19 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.23 2fwu n TYR 612 Cb 0.57 -3.05 -0.16 0.00 -0.31 0.00 0.00 39.34 36.40 2fwu n TYR 612 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2fwu s ASP 613 N -2.44 3.56 0.14 7.72 1.01 -1.26 -5.06 116.67 120.34 2fwu s ASP 613 Ca 0.00 -0.47 -0.25 0.00 0.71 0.00 0.00 52.55 52.54 2fwu s ASP 613 Cb 0.00 -1.53 0.08 0.00 1.01 0.00 0.00 42.92 42.48 2fwu s ASP 613 CO 0.00 0.12 1.04 -0.62 0.21 0.00 0.00 175.17 175.92 2fwu s ASP 614 N 0.60 -0.10 -1.34 0.27 2.15 -1.26 -5.03 116.67 111.96 2fwu s ASP 614 Ca -0.10 -0.45 -0.12 0.00 0.43 0.00 0.00 52.55 52.31 2fwu s ASP 614 Cb -0.16 0.44 0.11 0.00 -0.30 0.00 0.00 42.92 43.01 2fwu s ASP 614 CO 0.03 -0.84 1.94 0.29 -0.17 0.00 0.00 175.17 176.42 2fwu n LYS 615 N -0.56 3.28 -3.39 4.34 5.02 -1.26 -4.94 118.16 120.66 2fwu n LYS 615 Ca -0.05 -3.22 -0.28 0.00 -2.02 0.00 0.00 58.31 52.74 2fwu n LYS 615 Cb 0.61 -3.12 -0.03 0.00 -0.02 0.00 0.00 35.03 32.47 2fwu n LYS 615 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2fwu s GLN 616 N 1.88 3.59 0.00 1.97 -1.52 -1.26 -5.11 119.66 119.20 2fwu s GLN 616 Ca 0.44 -0.10 0.00 0.00 -1.95 0.00 0.00 55.36 53.75 2fwu s GLN 616 Cb 0.09 -2.68 0.00 0.00 -0.22 0.00 0.00 33.01 30.20 2fwu s GLN 616 CO -0.02 0.23 0.00 -2.30 -0.25 0.00 0.00 175.29 172.95 2fwu n PRO 617 N -1.03 0.08 -2.05 2.91 -0.02 -1.26 -4.79 135.00 128.84 2fwu n PRO 617 Ca -0.03 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.04 2fwu n PRO 617 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.99 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 3.42 -0.40 2.45 2.01 -1.26 -4.85 118.68 120.05 2fwu s LEU 618 Ca 0.00 0.84 0.08 0.00 0.01 0.00 0.00 54.13 55.06 2fwu s LEU 618 Cb 0.00 -3.08 0.26 0.00 0.01 0.00 0.00 46.19 43.38 2fwu s LEU 618 CO 0.00 -1.98 0.56 0.35 1.01 0.00 0.00 176.35 176.29 2fwu n THR 619 N 7.30 -0.48 0.11 5.49 -2.24 -1.26 -4.90 114.28 118.30 2fwu n THR 619 Ca 0.21 -4.15 0.09 0.00 -2.27 0.00 0.00 64.05 57.94 2fwu n THR 619 Cb 0.49 -1.72 0.01 0.00 -2.10 0.00 0.00 70.33 67.01 2fwu n THR 619 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2fwu h SER 620 N 3.86 0.00 0.00 3.42 0.02 -1.90 -3.48 113.55 115.47 2fwu h SER 620 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2fwu h SER 620 Cb 0.88 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2fwu h SER 620 CO 0.48 0.12 0.00 1.17 -1.14 0.00 0.00 176.83 177.46 2fwu n LYS 621 N -2.80 0.00 0.00 3.45 4.81 -1.26 -3.15 118.16 119.20 2fwu n LYS 621 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 2fwu n LYS 621 Cb 0.60 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.65 2fwu n LYS 621 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2fwu n GLU 622 N 0.00 0.00 -1.62 1.64 2.13 -1.26 -5.14 120.64 116.39 2fwu n GLU 622 Ca 0.00 0.00 -0.54 0.00 0.66 0.00 0.00 57.16 57.28 2fwu n GLU 622 Cb 0.00 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.65 2fwu n GLU 622 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2fwu n GLU 623 N 0.00 1.11 -0.29 5.31 2.13 -1.19 -4.84 120.64 122.87 2fwu n GLU 623 Ca 0.00 0.40 -0.05 0.00 0.66 0.00 0.00 57.16 58.17 2fwu n GLU 623 Cb 0.00 -2.05 0.08 0.00 0.27 0.00 0.00 31.44 29.74 2fwu n GLU 623 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2fwu h GLU 624 N 5.29 1.19 -1.00 5.31 4.81 -1.99 -0.20 114.58 127.99 2fwu h GLU 624 Ca -0.47 -0.20 0.08 0.00 -0.13 0.00 0.00 59.36 58.63 2fwu h GLU 624 Cb 1.33 -0.20 -0.07 0.00 0.63 0.00 0.00 28.75 30.44 2fwu h GLU 624 CO 0.83 0.94 0.64 0.93 -0.73 0.00 0.00 179.01 181.63 2fwu h GLU 625 N 1.17 1.11 -0.06 1.92 4.39 -1.95 0.55 114.58 121.71 2fwu h GLU 625 Ca 0.27 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.85 2fwu h GLU 625 Cb 0.18 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2fwu h GLU 625 CO -0.03 0.73 -0.20 -0.09 -1.16 0.00 0.00 179.01 178.26 2fwu h ARG 626 N 1.14 0.24 -0.96 2.33 9.65 -1.68 -2.43 114.38 122.67 2fwu h ARG 626 Ca 0.45 -0.18 0.14 0.00 -1.10 0.00 0.00 59.98 59.28 2fwu h ARG 626 Cb 0.23 0.03 -0.09 0.00 -1.39 0.00 0.00 29.97 28.76 2fwu h ARG 626 CO -0.19 0.81 0.58 0.00 2.80 0.00 0.00 179.97 183.97 2fwu h ARG 627 N -0.27 0.85 -0.59 0.20 3.08 -0.15 0.44 114.38 117.94 2fwu h ARG 627 Ca -0.01 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 2fwu h ARG 627 Cb 0.83 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 2fwu h ARG 627 CO 0.04 0.56 0.14 0.82 -1.07 0.00 0.00 179.97 180.46 2fwu h ILE 628 N 0.88 1.25 -0.26 2.04 2.04 -0.89 -2.01 117.51 120.56 2fwu h ILE 628 Ca 0.50 -0.91 -0.13 0.00 1.00 0.00 0.00 64.86 65.31 2fwu h ILE 628 Cb 0.58 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 2fwu h ILE 628 CO -0.30 0.34 -0.39 0.00 0.00 0.00 0.00 178.15 177.79 2fwu h ALA 629 N 1.03 0.84 -0.47 1.87 0.00 -0.47 -2.53 119.26 119.53 2fwu h ALA 629 Ca 0.18 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2fwu h ALA 629 Cb 0.36 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2fwu h ALA 629 CO 0.00 0.64 0.20 0.93 0.00 0.00 0.00 179.25 181.02 2fwu h GLU 630 N 0.49 0.66 -0.26 0.00 4.39 -0.05 0.02 114.58 119.84 2fwu h GLU 630 Ca 0.04 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2fwu h GLU 630 Cb 0.90 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 2fwu h GLU 630 CO 0.08 0.54 0.00 0.00 -1.16 0.00 0.00 179.01 178.47 2fwu n MET 631 N -4.36 1.78 0.21 2.33 0.00 -0.77 -2.66 117.12 113.64 2fwu n MET 631 Ca 0.04 -1.20 0.10 0.00 0.00 0.00 0.00 57.70 56.64 2fwu n MET 631 Cb 0.15 -1.34 0.19 0.00 0.00 0.00 0.00 33.22 32.22 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 5.11 0.00 -4.17 3.17 0.00 -0.57 -3.42 103.07 103.18 2fwu h GLY 632 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.69 2fwu h GLY 632 CO 0.00 0.00 -0.68 0.50 0.00 0.00 0.00 176.54 176.36 2fwu s ARG 633 N -3.21 2.43 0.48 4.80 3.00 -1.09 -5.02 118.95 120.33 2fwu s ARG 633 Ca 0.05 -0.95 -0.24 0.00 0.00 0.00 0.00 55.73 54.60 2fwu s ARG 633 Cb 0.06 -2.44 -0.07 0.00 0.00 0.00 0.00 34.95 32.50 2fwu s ARG 633 CO 0.68 0.51 1.33 -1.25 0.00 0.00 0.00 175.30 176.57 2fwu s PRO 634 N -2.48 3.53 0.37 3.54 0.04 -1.26 -4.64 135.00 134.11 2fwu s PRO 634 Ca 0.25 2.19 0.06 0.00 0.04 0.00 0.00 61.00 63.54 2fwu s PRO 634 Cb -0.11 -2.47 -0.07 0.00 0.04 0.00 0.00 34.50 31.88 2fwu s PRO 634 CO 0.18 -0.86 0.01 0.96 0.04 0.00 0.00 177.00 177.33 2fwu s ILE 635 N -1.31 1.79 0.90 0.56 -5.25 -1.26 -3.78 121.20 112.84 2fwu s ILE 635 Ca 0.65 -2.03 -0.12 0.00 -0.99 0.00 0.00 60.65 58.16 2fwu s ILE 635 Cb -0.39 -2.88 0.13 0.00 2.95 0.00 0.00 42.46 42.27 2fwu s ILE 635 CO 0.48 -0.04 1.12 -1.48 -1.79 0.00 0.00 174.94 173.23 2fwu s LEU 636 N -3.63 2.10 0.00 0.37 -0.00 -1.26 -3.73 118.68 112.54 2fwu s LEU 636 Ca 0.35 1.11 0.00 0.00 -0.00 0.00 0.00 54.13 55.59 2fwu s LEU 636 Cb 0.09 -3.49 0.00 0.00 -0.00 0.00 0.00 46.19 42.78 2fwu s LEU 636 CO 0.17 -2.51 0.00 0.61 -0.00 0.00 0.00 176.35 174.62 2fwu n GLY 637 N -1.94 5.37 0.43 -3.48 0.00 0.74 -4.43 105.19 101.89 2fwu n GLY 637 Ca 0.06 -1.99 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.16 -3.03 1.61 4.81 -1.96 -3.38 114.58 112.46 2fwu h GLU 638 Ca 0.00 0.01 -0.46 0.00 -0.13 0.00 0.00 59.36 58.78 2fwu h GLU 638 Cb 0.00 0.04 -0.41 0.00 0.63 0.00 0.00 28.75 29.01 2fwu h GLU 638 CO 0.00 -0.11 -0.75 -3.38 -0.73 0.00 0.00 179.01 174.04 2fwu s HIS 639 N -5.61 0.19 -0.57 0.92 -3.43 -1.26 -5.07 115.29 100.46 2fwu s HIS 639 Ca -0.13 -0.32 -0.01 0.00 -0.80 0.00 0.00 55.06 53.79 2fwu s HIS 639 Cb 0.11 -0.69 0.15 0.00 -1.43 0.00 0.00 32.58 30.71 2fwu s HIS 639 CO 0.63 -0.52 0.36 0.95 -2.00 0.00 0.00 174.74 174.15 2fwu s THR 640 N 2.14 3.35 -0.29 -5.38 -4.23 -1.26 -2.16 115.64 107.80 2fwu s THR 640 Ca 0.02 -2.93 -0.23 0.00 -1.18 0.00 0.00 61.69 57.37 2fwu s THR 640 Cb -0.16 -3.23 0.17 0.00 1.34 0.00 0.00 72.50 70.62 2fwu s THR 640 CO -0.10 -0.83 1.27 -0.75 -0.54 0.00 0.00 174.62 173.67 2fwu s LYS 641 N 0.04 0.19 -0.14 3.99 2.36 -1.26 -4.85 119.74 120.07 2fwu s LYS 641 Ca 0.16 0.25 -0.02 0.00 -2.55 0.00 0.00 55.97 53.81 2fwu s LYS 641 Cb -0.22 0.08 0.05 0.00 -1.05 0.00 0.00 37.83 36.69 2fwu s LYS 641 CO -0.03 -0.03 0.02 -1.17 1.55 0.00 0.00 175.35 175.70 2fwu s LEU 642 N 0.38 0.88 -0.42 5.43 2.96 -1.03 -4.05 118.68 122.83 2fwu s LEU 642 Ca 0.02 -0.50 -0.16 0.00 -0.22 0.00 0.00 54.13 53.27 2fwu s LEU 642 Cb -0.04 -0.51 0.02 0.00 0.50 0.00 0.00 46.19 46.16 2fwu s LEU 642 CO -0.12 -0.26 0.37 -0.70 -1.32 0.00 0.00 176.35 174.31 2fwu s GLU 643 N 1.92 3.04 -0.53 1.98 2.12 -0.26 -1.16 118.70 125.81 2fwu s GLU 643 Ca 0.02 -0.88 -0.17 0.00 0.36 0.00 0.00 54.97 54.29 2fwu s GLU 643 Cb -0.15 -3.97 0.10 0.00 0.26 0.00 0.00 34.13 30.36 2fwu s GLU 643 CO -0.07 -0.80 0.56 0.08 -0.54 0.00 0.00 175.26 174.49 2fwu s VAL 644 N 1.92 5.04 -0.25 3.70 1.01 -0.00 -0.31 120.40 131.51 2fwu s VAL 644 Ca 0.09 -1.08 -0.21 0.00 0.00 0.00 0.00 61.98 60.77 2fwu s VAL 644 Cb -0.18 -4.33 -0.02 0.00 0.00 0.00 0.00 36.38 31.85 2fwu s VAL 644 CO 0.12 -0.87 0.65 -0.63 0.00 0.00 0.00 175.10 174.37 2fwu s ILE 645 N 2.11 4.97 -0.45 2.22 1.09 0.06 -2.66 121.20 128.54 2fwu s ILE 645 Ca 0.08 1.18 -0.15 0.00 -1.10 0.00 0.00 60.65 60.65 2fwu s ILE 645 Cb -0.25 -3.95 0.06 0.00 -1.06 0.00 0.00 42.46 37.25 2fwu s ILE 645 CO 0.06 0.02 0.37 -0.63 -0.10 0.00 0.00 174.94 174.67 2fwu s ILE 646 N 2.51 5.23 0.17 2.92 1.09 -1.13 -0.90 121.20 131.09 2fwu s ILE 646 Ca 0.27 -0.92 0.05 0.00 -1.10 0.00 0.00 60.65 58.95 2fwu s ILE 646 Cb -0.15 -4.07 -0.04 0.00 -1.06 0.00 0.00 42.46 37.14 2fwu s ILE 646 CO 0.08 -0.50 0.16 -1.83 -0.10 0.00 0.00 174.94 172.76 2fwu s GLU 647 N 1.68 2.98 0.98 2.79 -1.05 -0.19 -4.63 118.70 121.27 2fwu s GLU 647 Ca 0.05 -0.85 -0.11 0.00 -0.15 0.00 0.00 54.97 53.91 2fwu s GLU 647 Cb -0.22 -2.68 0.18 0.00 -0.44 0.00 0.00 34.13 30.96 2fwu s GLU 647 CO 0.08 0.48 1.11 -1.21 0.95 0.00 0.00 175.26 176.67 2fwu s GLU 648 N -3.20 0.49 -0.19 -4.83 0.41 -1.26 -0.88 118.70 109.25 2fwu s GLU 648 Ca 0.32 1.34 -0.01 0.00 -0.41 0.00 0.00 54.97 56.21 2fwu s GLU 648 Cb -0.10 -1.68 0.12 0.00 -1.78 0.00 0.00 34.13 30.69 2fwu s GLU 648 CO 0.24 -2.93 2.02 0.45 -0.49 0.00 0.00 175.26 174.56 2fwu n SER 649 N -4.42 6.00 0.01 -0.19 2.88 -1.26 -3.68 113.62 112.96 2fwu n SER 649 Ca 0.09 -2.79 -0.21 0.00 -1.33 0.00 0.00 58.87 54.63 2fwu n SER 649 Cb 0.53 -1.09 -0.14 0.00 -0.75 0.00 0.00 64.21 62.76 2fwu n SER 649 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2fwu h TYR 650 N 1.29 0.43 -1.59 0.66 3.20 -2.04 -3.49 116.97 115.44 2fwu h TYR 650 Ca 0.17 -0.31 0.37 0.00 3.14 0.00 0.00 58.73 62.09 2fwu h TYR 650 Cb 0.95 -0.02 -0.11 0.00 1.54 0.00 0.00 36.73 39.10 2fwu h TYR 650 CO 0.58 1.50 0.93 -2.00 -1.64 0.00 0.00 178.16 177.53 2fwu s GLU 651 N -2.46 0.22 -0.11 1.82 -6.30 -1.24 -5.15 118.70 105.48 2fwu s GLU 651 Ca -0.19 -0.13 -0.02 0.00 -2.50 0.00 0.00 54.97 52.12 2fwu s GLU 651 Cb 0.04 0.07 0.04 0.00 0.00 0.00 0.00 34.13 34.27 2fwu s GLU 651 CO 0.77 -0.10 0.03 0.12 0.02 0.00 0.00 175.26 176.10 2fwu s PHE 652 N -2.13 0.57 0.39 5.30 5.36 -1.26 -4.68 117.98 121.53 2fwu s PHE 652 Ca 0.22 -0.26 0.04 0.00 -0.96 0.00 0.00 56.93 55.96 2fwu s PHE 652 Cb 0.04 -0.78 -0.04 0.00 -0.34 0.00 0.00 43.02 41.90 2fwu s PHE 652 CO -0.04 -0.39 0.08 0.15 -1.46 0.00 0.00 175.22 173.56 2fwu s LYS 653 N 2.01 1.87 -0.45 10.12 -0.14 -1.26 -5.09 119.74 126.80 2fwu s LYS 653 Ca 0.03 -2.11 0.06 0.00 -1.36 0.00 0.00 55.97 52.59 2fwu s LYS 653 Cb -0.14 -0.89 0.20 0.00 -1.68 0.00 0.00 37.83 35.32 2fwu s LYS 653 CO -0.06 -0.33 0.55 0.43 -0.76 0.00 0.00 175.35 175.18 2fwu n SER 654 N -1.05 -1.50 -4.58 2.83 7.64 -1.26 -4.84 113.62 110.85 2fwu n SER 654 Ca -0.06 -2.70 -0.42 0.00 1.01 0.00 0.00 58.87 56.70 2fwu n SER 654 Cb 0.66 0.38 -0.03 0.00 -1.01 0.00 0.00 64.21 64.21 2fwu n SER 654 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2fwu s THR 655 N 0.13 3.49 -0.09 0.44 2.01 -1.26 -4.27 115.64 116.09 2fwu s THR 655 Ca 0.32 0.45 -0.01 0.00 0.31 0.00 0.00 61.69 62.76 2fwu s THR 655 Cb 0.08 -3.79 0.01 0.00 0.01 0.00 0.00 72.50 68.80 2fwu s THR 655 CO -0.15 -0.59 0.03 0.55 -0.69 0.00 0.00 174.62 173.77 2fwu n VAL 656 N 7.32 -5.35 0.27 3.82 3.14 -1.26 -5.17 118.33 121.11 2fwu n VAL 656 Ca 0.21 0.97 0.03 0.00 -2.96 0.00 0.00 64.34 62.59 2fwu n VAL 656 Cb 0.48 -4.21 0.03 0.00 -1.06 0.00 0.00 33.84 29.09 2fwu n VAL 656 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47