#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 2.13 0.00 1.57 0.00 -1.26 -4.79 120.51 118.15 2fwu n ALA 502 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2fwu n ALA 502 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.63 3.91 3.39 0.00 0.00 -1.26 -4.26 105.19 107.60 2fwu n GLY 503 Ca 0.00 -0.67 -0.44 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 4.78 -0.26 -0.61 1.09 -1.26 -3.38 121.20 121.57 2fwu s ILE 504 Ca 0.00 -1.05 -0.03 0.00 -1.10 0.00 0.00 60.65 58.48 2fwu s ILE 504 Cb 0.00 -4.55 0.02 0.00 -1.06 0.00 0.00 42.46 36.88 2fwu s ILE 504 CO 0.00 -1.21 -0.03 -0.36 -0.10 0.00 0.00 174.94 173.24 2fwu s PHE 505 N 2.74 3.10 0.14 3.97 0.08 -1.25 -2.34 117.98 124.42 2fwu s PHE 505 Ca 0.15 -1.47 -0.11 0.00 0.12 0.00 0.00 56.93 55.62 2fwu s PHE 505 Cb -0.20 -2.10 0.00 0.00 -0.57 0.00 0.00 43.02 40.15 2fwu s PHE 505 CO 0.04 -0.71 0.29 -0.08 -0.10 0.00 0.00 175.22 174.67 2fwu s THR 506 N 1.35 0.09 0.44 0.64 -1.32 -1.26 -0.40 115.64 115.19 2fwu s THR 506 Ca 0.00 -1.14 -0.17 0.00 -1.21 0.00 0.00 61.69 59.17 2fwu s THR 506 Cb -0.17 -1.55 -0.09 0.00 -1.51 0.00 0.00 72.50 69.18 2fwu s THR 506 CO -0.03 -0.40 0.91 -0.36 -2.21 0.00 0.00 174.62 172.52 2fwu s PHE 507 N -3.90 3.39 -0.02 9.09 0.08 -1.25 -0.82 117.98 124.56 2fwu s PHE 507 Ca 0.10 1.42 0.18 0.00 0.12 0.00 0.00 56.93 58.76 2fwu s PHE 507 Cb 0.03 -2.73 0.42 0.00 -0.57 0.00 0.00 43.02 40.18 2fwu s PHE 507 CO -0.06 -0.17 1.61 1.49 -0.10 0.00 0.00 175.22 177.99 2fwu h GLU 508 N 1.53 0.00 -3.64 0.44 4.81 -1.73 -3.44 114.58 112.55 2fwu h GLU 508 Ca -0.48 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.46 2fwu h GLU 508 Cb 1.18 0.00 -0.32 0.00 0.63 0.00 0.00 28.75 30.24 2fwu h GLU 508 CO 0.62 0.39 -0.73 -1.83 -0.73 0.00 0.00 179.01 176.73 2fwu s GLU 509 N -3.28 0.05 0.00 1.92 -1.05 -1.26 -4.83 118.70 110.25 2fwu s GLU 509 Ca 0.02 0.11 0.29 0.00 -0.15 0.00 0.00 54.97 55.25 2fwu s GLU 509 Cb 0.09 -0.24 1.49 0.00 -0.44 0.00 0.00 34.13 35.03 2fwu s GLU 509 CO 0.70 -0.11 1.99 -0.35 0.95 0.00 0.00 175.26 178.44 2fwu n PRO 510 N 3.86 1.29 -3.77 -4.83 -0.04 -1.26 -4.78 135.00 125.47 2fwu n PRO 510 Ca -0.23 -0.42 -0.13 0.00 -0.04 0.00 0.00 63.50 62.68 2fwu n PRO 510 Cb 0.53 -1.48 -0.13 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.99 -0.02 -0.02 0.52 1.01 -1.26 0.06 120.40 118.69 2fwu s VAL 511 Ca 0.43 0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.45 2fwu s VAL 511 Cb 0.21 -0.31 0.01 0.00 0.00 0.00 0.00 36.38 36.29 2fwu s VAL 511 CO 0.35 0.03 0.07 0.28 0.00 0.00 0.00 175.10 175.83 2fwu s THR 512 N 0.63 0.01 -0.12 3.92 -1.32 -0.25 -3.25 115.64 115.27 2fwu s THR 512 Ca -0.04 -0.06 -0.01 0.00 -1.21 0.00 0.00 61.69 60.36 2fwu s THR 512 Cb -0.06 -0.13 -0.03 0.00 -1.51 0.00 0.00 72.50 70.78 2fwu s THR 512 CO -0.03 -0.04 -0.07 -1.00 -2.21 0.00 0.00 174.62 171.27 2fwu s HIS 513 N -0.08 2.94 0.17 9.09 3.76 -0.47 -0.74 115.29 129.96 2fwu s HIS 513 Ca -0.01 -0.26 0.06 0.00 -0.15 0.00 0.00 55.06 54.69 2fwu s HIS 513 Cb -0.01 -1.84 -0.05 0.00 1.11 0.00 0.00 32.58 31.79 2fwu s HIS 513 CO 0.00 0.05 -0.12 0.14 -0.85 0.00 0.00 174.74 173.97 2fwu s VAL 514 N -0.06 1.39 0.46 -0.90 -7.23 -0.55 -4.57 120.40 108.95 2fwu s VAL 514 Ca 0.00 -2.11 -0.20 0.00 -1.81 0.00 0.00 61.98 57.86 2fwu s VAL 514 Cb -0.13 -1.92 -0.09 0.00 0.56 0.00 0.00 36.38 34.80 2fwu s VAL 514 CO 0.03 -0.68 0.99 -0.55 -0.31 0.00 0.00 175.10 174.58 2fwu s SER 515 N -3.21 6.63 0.00 4.85 0.15 -1.26 -3.15 113.70 117.71 2fwu s SER 515 Ca 0.19 1.79 0.27 0.00 0.70 0.00 0.00 55.95 58.89 2fwu s SER 515 Cb 0.01 -2.55 0.79 0.00 -1.71 0.00 0.00 66.02 62.56 2fwu s SER 515 CO 0.03 -0.58 1.59 1.21 1.20 0.00 0.00 173.24 176.69 2fwu n GLU 516 N -0.89 0.46 -0.09 5.44 2.13 -1.13 -3.29 120.64 123.26 2fwu n GLU 516 Ca 0.08 -0.24 0.12 0.00 0.66 0.00 0.00 57.16 57.78 2fwu n GLU 516 Cb 0.53 -1.50 0.15 0.00 0.27 0.00 0.00 31.44 30.90 2fwu n GLU 516 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2fwu n SER 517 N -1.06 3.21 -4.82 4.31 2.88 -1.26 -4.72 113.62 112.16 2fwu n SER 517 Ca 0.10 -1.99 -0.33 0.00 -1.33 0.00 0.00 58.87 55.32 2fwu n SER 517 Cb 0.33 -0.12 -0.04 0.00 -0.75 0.00 0.00 64.21 63.63 2fwu n SER 517 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2fwu s ILE 518 N -1.73 4.27 0.00 2.46 2.07 -1.21 -5.01 121.20 122.05 2fwu s ILE 518 Ca 0.33 1.27 0.00 0.00 -1.41 0.00 0.00 60.65 60.84 2fwu s ILE 518 Cb 0.21 -3.59 0.00 0.00 0.13 0.00 0.00 42.46 39.21 2fwu s ILE 518 CO 0.31 -0.45 0.00 0.61 -1.91 0.00 0.00 174.94 173.50 2fwu n GLY 519 N -0.92 -0.43 3.37 1.50 0.00 -1.26 -4.20 105.19 103.24 2fwu n GLY 519 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.92 3.30 -0.04 -0.61 -1.09 -1.26 -1.21 121.20 119.36 2fwu s ILE 520 Ca 0.00 -0.55 -0.01 0.00 -2.23 0.00 0.00 60.65 57.86 2fwu s ILE 520 Cb 0.00 -2.44 -0.04 0.00 -1.58 0.00 0.00 42.46 38.41 2fwu s ILE 520 CO 0.00 0.48 0.05 0.00 -1.23 0.00 0.00 174.94 174.24 2fwu s MET 521 N 0.76 3.02 0.15 2.79 0.23 -0.02 -4.91 119.30 121.32 2fwu s MET 521 Ca -0.04 -0.45 0.11 0.00 -1.03 0.00 0.00 55.69 54.28 2fwu s MET 521 Cb -0.15 -2.83 -0.04 0.00 -1.53 0.00 0.00 34.83 30.28 2fwu s MET 521 CO 0.02 0.67 -0.25 -1.21 -2.03 0.00 0.00 175.02 172.22 2fwu s GLU 522 N -1.35 1.39 -0.02 3.16 2.02 -1.26 -1.00 118.70 121.64 2fwu s GLU 522 Ca 0.18 -1.38 0.03 0.00 0.02 0.00 0.00 54.97 53.82 2fwu s GLU 522 Cb -0.12 -1.78 -0.00 0.00 0.10 0.00 0.00 34.13 32.34 2fwu s GLU 522 CO 0.08 0.41 -0.11 0.08 0.02 0.00 0.00 175.26 175.74 2fwu s VAL 523 N -1.32 0.93 -0.14 2.63 1.01 -1.20 -4.91 120.40 117.39 2fwu s VAL 523 Ca 0.15 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.47 2fwu s VAL 523 Cb -0.09 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 2fwu s VAL 523 CO 0.07 0.28 0.55 -0.54 0.00 0.00 0.00 175.10 175.46 2fwu s LYS 524 N 0.01 4.30 -0.20 2.72 -0.14 -1.26 -2.63 119.74 122.53 2fwu s LYS 524 Ca -0.01 0.54 -0.03 0.00 -1.36 0.00 0.00 55.97 55.12 2fwu s LYS 524 Cb -0.08 -3.50 -0.01 0.00 -1.68 0.00 0.00 37.83 32.57 2fwu s LYS 524 CO 0.00 -0.01 -0.06 0.08 -0.76 0.00 0.00 175.35 174.60 2fwu s VAL 525 N 1.15 3.27 0.38 3.17 1.01 -0.50 -1.82 120.40 127.06 2fwu s VAL 525 Ca 0.28 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.47 2fwu s VAL 525 Cb -0.16 -2.47 -0.09 0.00 0.00 0.00 0.00 36.38 33.67 2fwu s VAL 525 CO 0.11 0.45 1.05 -0.76 0.00 0.00 0.00 175.10 175.95 2fwu s LEU 526 N 1.25 4.21 0.12 3.92 2.01 0.00 -3.18 118.68 127.01 2fwu s LEU 526 Ca 0.03 2.06 -0.30 0.00 0.01 0.00 0.00 54.13 55.92 2fwu s LEU 526 Cb -0.14 -4.10 -0.06 0.00 0.01 0.00 0.00 46.19 41.89 2fwu s LEU 526 CO -0.02 -0.42 1.12 -0.60 1.01 0.00 0.00 176.35 177.44 2fwu s ARG 527 N -2.33 4.53 0.92 1.70 6.06 -1.26 -4.11 118.95 124.47 2fwu s ARG 527 Ca 0.55 1.70 -0.11 0.00 -2.50 0.00 0.00 55.73 55.37 2fwu s ARG 527 Cb -0.23 -3.32 0.11 0.00 0.06 0.00 0.00 34.95 31.57 2fwu s ARG 527 CO 0.29 -0.06 0.92 -2.37 -2.50 0.00 0.00 175.30 171.59 2fwu n THR 528 N 3.10 0.07 -0.21 4.11 5.66 -0.99 -4.92 114.28 121.10 2fwu n THR 528 Ca 0.05 -0.07 -0.02 0.00 -3.05 0.00 0.00 64.05 60.97 2fwu n THR 528 Cb 0.47 -0.89 0.18 0.00 -1.55 0.00 0.00 70.33 68.54 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 -1.77 0.89 -3.34 1.09 0.87 -1.96 -3.41 113.55 105.92 2fwu h SER 529 Ca -0.43 -0.10 -0.39 0.00 -1.23 0.00 0.00 61.79 59.64 2fwu h SER 529 Cb 1.27 -0.23 -0.37 0.00 -0.44 0.00 0.00 62.40 62.63 2fwu h SER 529 CO 0.39 0.75 -0.75 -0.83 -0.53 0.00 0.00 176.83 175.86 2fwu s GLY 530 N -3.45 0.32 -0.17 5.77 0.00 -1.26 -5.10 107.32 103.42 2fwu s GLY 530 Ca -0.11 0.06 -0.01 0.00 0.00 0.00 0.00 44.72 44.66 2fwu s GLY 530 CO 0.80 1.07 -0.03 0.00 0.00 0.00 0.00 173.10 174.94 2fwu s ALA 531 N 1.77 1.38 -0.51 3.20 0.00 -1.26 -4.45 121.76 121.89 2fwu s ALA 531 Ca 0.01 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.20 2fwu s ALA 531 Cb -0.13 -1.14 0.13 0.00 0.00 0.00 0.00 23.12 21.99 2fwu s ALA 531 CO -0.03 -0.88 0.26 1.03 0.00 0.00 0.00 175.76 176.13 2fwu s ARG 532 N 1.68 1.92 0.00 0.00 1.81 -1.26 -4.73 118.95 118.36 2fwu s ARG 532 Ca -0.00 -2.57 0.00 0.00 -1.72 0.00 0.00 55.73 51.44 2fwu s ARG 532 Cb -0.16 -3.24 0.00 0.00 -0.45 0.00 0.00 34.95 31.10 2fwu s ARG 532 CO -0.07 -1.11 0.00 0.41 -0.68 0.00 0.00 175.30 173.84 2fwu n GLY 533 N 3.15 0.83 3.73 -3.53 0.00 -1.26 -4.81 105.19 103.31 2fwu n GLY 533 Ca 0.05 -2.28 -0.38 0.00 0.00 0.00 0.00 46.02 43.42 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 -0.46 6.70 -0.03 1.61 3.04 -1.26 -2.03 114.94 122.51 2fwu s ASN 534 Ca 0.00 0.84 0.07 0.00 0.04 0.00 0.00 52.86 53.81 2fwu s ASN 534 Cb 0.00 -2.28 -0.02 0.00 -1.54 0.00 0.00 41.25 37.41 2fwu s ASN 534 CO 0.00 0.04 -0.24 -0.69 -3.04 0.00 0.00 177.10 173.17 2fwu s VAL 535 N 0.43 2.21 -0.21 -5.21 1.01 0.12 -0.35 120.40 118.40 2fwu s VAL 535 Ca 0.26 -1.04 -0.07 0.00 0.00 0.00 0.00 61.98 61.13 2fwu s VAL 535 Cb -0.15 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 2fwu s VAL 535 CO 0.11 0.58 0.06 -0.63 0.00 0.00 0.00 175.10 175.21 2fwu s ILE 536 N -0.53 4.46 -0.34 2.22 -1.09 0.64 -0.41 121.20 126.14 2fwu s ILE 536 Ca 0.07 -0.14 -0.03 0.00 -2.23 0.00 0.00 60.65 58.33 2fwu s ILE 536 Cb -0.11 -3.04 0.07 0.00 -1.58 0.00 0.00 42.46 37.80 2fwu s ILE 536 CO 0.00 0.40 0.09 -0.69 -1.23 0.00 0.00 174.94 173.51 2fwu s VAL 537 N 0.99 3.20 0.37 2.92 1.01 0.38 -0.12 120.40 129.14 2fwu s VAL 537 Ca 0.04 -1.60 -0.25 0.00 0.00 0.00 0.00 61.98 60.16 2fwu s VAL 537 Cb -0.14 -2.97 -0.09 0.00 0.00 0.00 0.00 36.38 33.17 2fwu s VAL 537 CO 0.03 -0.33 1.01 -2.16 0.00 0.00 0.00 175.10 173.65 2fwu s PRO 538 N 1.23 4.33 0.11 2.72 0.04 -1.26 0.14 135.00 142.30 2fwu s PRO 538 Ca 0.00 1.45 -0.04 0.00 0.04 0.00 0.00 61.00 62.46 2fwu s PRO 538 Cb -0.21 -2.64 -0.03 0.00 0.04 0.00 0.00 34.50 31.67 2fwu s PRO 538 CO -0.02 0.02 0.09 1.52 0.04 0.00 0.00 177.00 178.65 2fwu s TYR 539 N -1.65 0.57 0.03 0.56 -0.85 0.54 -0.01 117.35 116.56 2fwu s TYR 539 Ca 0.55 -1.00 -0.17 0.00 -0.52 0.00 0.00 57.07 55.93 2fwu s TYR 539 Cb -0.21 -0.31 0.03 0.00 0.38 0.00 0.00 41.96 41.85 2fwu s TYR 539 CO 0.26 -0.52 0.37 -1.59 -1.52 0.00 0.00 175.55 172.55 2fwu s LYS 540 N -3.97 0.85 -0.23 -3.49 -2.85 -0.14 -1.81 119.74 108.09 2fwu s LYS 540 Ca 0.15 -0.36 -0.11 0.00 -1.00 0.00 0.00 55.97 54.65 2fwu s LYS 540 Cb 0.06 0.37 -0.05 0.00 -2.06 0.00 0.00 37.83 36.16 2fwu s LYS 540 CO -0.04 -0.28 0.19 0.95 0.10 0.00 0.00 175.35 176.28 2fwu s THR 541 N -2.25 5.34 -0.29 3.79 -4.23 -0.77 -1.41 115.64 115.82 2fwu s THR 541 Ca -0.07 0.25 -0.15 0.00 -1.18 0.00 0.00 61.69 60.54 2fwu s THR 541 Cb -0.02 -3.53 -0.03 0.00 1.34 0.00 0.00 72.50 70.27 2fwu s THR 541 CO -0.01 0.33 0.37 -0.63 -0.54 0.00 0.00 174.62 174.15 2fwu s ILE 542 N 1.08 5.17 0.13 2.99 1.09 0.15 -4.85 121.20 126.95 2fwu s ILE 542 Ca 0.09 0.41 -0.21 0.00 -1.10 0.00 0.00 60.65 59.85 2fwu s ILE 542 Cb -0.14 -3.74 -0.03 0.00 -1.06 0.00 0.00 42.46 37.49 2fwu s ILE 542 CO 0.05 0.07 1.69 -0.33 -0.10 0.00 0.00 174.94 176.33 2fwu h GLU 543 N 8.27 -0.06 0.00 2.79 5.08 -1.85 -0.83 114.58 127.98 2fwu h GLU 543 Ca -0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2fwu h GLU 543 Cb 1.16 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2fwu h GLU 543 CO 0.66 -0.04 0.00 0.41 -1.00 0.00 0.00 179.01 179.04 2fwu n GLY 544 N -1.22 1.27 0.30 -3.84 0.00 -1.26 -1.36 105.19 99.07 2fwu n GLY 544 Ca -0.03 0.22 0.06 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 0.00 -2.79 2.61 5.66 -1.23 -4.98 114.28 113.55 2fwu n THR 545 Ca 0.00 -0.40 -0.20 0.00 -3.05 0.00 0.00 64.05 60.40 2fwu n THR 545 Cb 0.00 1.16 0.04 0.00 -1.55 0.00 0.00 70.33 69.97 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 -1.43 4.17 -0.21 1.79 0.00 -0.46 -4.88 121.76 120.73 2fwu s ALA 546 Ca 0.10 -1.56 -0.02 0.00 0.00 0.00 0.00 51.96 50.49 2fwu s ALA 546 Cb 0.10 -1.86 0.01 0.00 0.00 0.00 0.00 23.12 21.36 2fwu s ALA 546 CO 0.27 -0.67 -0.11 0.50 0.00 0.00 0.00 175.76 175.75 2fwu s ARG 547 N -4.65 3.17 0.00 0.00 6.06 -1.26 -4.76 118.95 117.51 2fwu s ARG 547 Ca 0.58 -0.74 0.00 0.00 -2.50 0.00 0.00 55.73 53.07 2fwu s ARG 547 Cb -0.09 -2.84 0.00 0.00 0.06 0.00 0.00 34.95 32.08 2fwu s ARG 547 CO 0.37 -0.22 0.00 0.41 -2.50 0.00 0.00 175.30 173.36 2fwu n GLY 548 N 4.72 0.80 2.28 8.12 0.00 -1.26 -0.71 105.19 119.14 2fwu n GLY 548 Ca -0.19 -1.68 -0.06 0.00 0.00 0.00 0.00 46.02 44.08 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 0.84 1.61 -0.02 0.00 -1.23 -2.48 105.19 108.91 2fwu n GLY 549 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.82 0.63 0.00 -0.02 0.00 -0.49 -4.87 105.19 98.62 2fwu n GLY 550 Ca -0.06 -0.77 -0.00 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.51 0.01 -0.07 1.61 4.07 -1.04 -4.80 120.64 118.91 2fwu n GLU 551 Ca 0.00 0.02 -0.05 0.00 -0.06 0.00 0.00 57.16 57.07 2fwu n GLU 551 Cb 0.29 -0.54 -0.14 0.00 -0.06 0.00 0.00 31.44 30.99 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 -2.53 0.75 -3.87 4.31 2.03 0.11 -4.70 116.55 112.65 2fwu n ASP 552 Ca -0.00 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.22 2fwu n ASP 552 Cb 0.01 1.12 -0.08 0.00 -0.72 0.00 0.00 41.12 41.45 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 -2.60 0.15 -0.32 -0.67 -0.71 -1.04 -2.64 117.98 110.14 2fwu s PHE 553 Ca -0.08 -0.52 -0.22 0.00 -1.04 0.00 0.00 56.93 55.06 2fwu s PHE 553 Cb 0.07 -0.08 -0.00 0.00 -1.21 0.00 0.00 43.02 41.80 2fwu s PHE 553 CO 0.72 -0.49 0.74 -2.00 -1.34 0.00 0.00 175.22 172.85 2fwu s GLU 554 N -3.42 3.90 0.11 1.99 -6.30 0.23 -1.40 118.70 113.81 2fwu s GLU 554 Ca 0.02 0.45 -0.30 0.00 -2.50 0.00 0.00 54.97 52.63 2fwu s GLU 554 Cb 0.03 -3.75 -0.06 0.00 0.00 0.00 0.00 34.13 30.35 2fwu s GLU 554 CO -0.09 -0.69 1.12 0.34 0.02 0.00 0.00 175.26 175.96 2fwu s ASP 555 N 1.67 7.22 -0.11 -1.70 -1.08 -1.26 -4.43 116.67 116.97 2fwu s ASP 555 Ca 0.30 1.99 -0.01 0.00 -0.52 0.00 0.00 52.55 54.31 2fwu s ASP 555 Cb -0.14 -2.59 0.03 0.00 -1.46 0.00 0.00 42.92 38.76 2fwu s ASP 555 CO 0.13 -0.31 -0.01 0.28 0.52 0.00 0.00 175.17 175.78 2fwu s THR 556 N 0.42 0.58 -0.31 1.71 -1.32 -1.26 -4.84 115.64 110.62 2fwu s THR 556 Ca 0.53 -0.13 -0.00 0.00 -1.21 0.00 0.00 61.69 60.88 2fwu s THR 556 Cb -0.28 -0.77 0.10 0.00 -1.51 0.00 0.00 72.50 70.03 2fwu s THR 556 CO 0.32 0.19 0.08 0.00 -2.21 0.00 0.00 174.62 173.00 2fwu n GLY 558 N 4.77 4.57 2.92 0.00 0.00 -0.75 -4.96 105.19 111.74 2fwu n GLY 558 Ca -0.02 -1.22 -0.17 0.00 0.00 0.00 0.00 46.02 44.62 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 1.03 0.46 -0.10 1.61 2.02 -1.26 -0.34 118.70 122.12 2fwu s GLU 559 Ca 0.00 -0.13 -0.14 0.00 0.02 0.00 0.00 54.97 54.72 2fwu s GLU 559 Cb 0.00 -0.48 -0.05 0.00 0.10 0.00 0.00 34.13 33.70 2fwu s GLU 559 CO 0.00 0.04 0.33 -0.51 0.02 0.00 0.00 175.26 175.15 2fwu s LEU 560 N 0.22 4.34 -0.69 1.80 1.43 0.12 -4.89 118.68 121.01 2fwu s LEU 560 Ca -0.02 0.68 -0.19 0.00 -1.03 0.00 0.00 54.13 53.57 2fwu s LEU 560 Cb -0.06 -2.45 0.12 0.00 0.03 0.00 0.00 46.19 43.83 2fwu s LEU 560 CO -0.00 0.19 0.83 -0.70 0.23 0.00 0.00 176.35 176.90 2fwu s GLU 561 N -0.16 3.22 -0.42 1.70 2.12 -1.26 -0.47 118.70 123.43 2fwu s GLU 561 Ca 0.20 -1.46 -0.13 0.00 0.36 0.00 0.00 54.97 53.94 2fwu s GLU 561 Cb -0.14 -4.40 0.04 0.00 0.26 0.00 0.00 34.13 29.89 2fwu s GLU 561 CO 0.08 -1.60 0.30 0.12 -0.54 0.00 0.00 175.26 173.61 2fwu s PHE 562 N 2.62 3.25 0.51 5.30 2.19 0.45 -4.98 117.98 127.33 2fwu s PHE 562 Ca 0.18 -0.87 0.06 0.00 0.33 0.00 0.00 56.93 56.62 2fwu s PHE 562 Cb -0.18 -2.73 0.04 0.00 -1.31 0.00 0.00 43.02 38.84 2fwu s PHE 562 CO 0.02 -0.69 0.71 -0.65 1.83 0.00 0.00 175.22 176.44 2fwu s GLN 563 N 1.61 2.54 0.27 10.12 -0.21 -1.24 0.15 119.66 132.90 2fwu s GLN 563 Ca 0.04 -1.19 0.25 0.00 0.02 0.00 0.00 55.36 54.48 2fwu s GLN 563 Cb -0.21 -2.63 0.74 0.00 1.00 0.00 0.00 33.01 31.91 2fwu s GLN 563 CO 0.07 -0.61 1.74 -2.95 -2.12 0.00 0.00 175.29 171.42 2fwu h ASN 564 N 0.29 0.00 0.00 5.90 -1.07 -1.70 -3.32 115.58 115.68 2fwu h ASN 564 Ca -0.38 0.00 -0.20 0.00 0.07 0.00 0.00 56.30 55.79 2fwu h ASN 564 Cb 1.28 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 37.51 2fwu h ASN 564 CO 0.46 0.00 -1.46 -0.67 0.07 0.00 0.00 177.43 175.83 2fwu n ASP 565 N -2.47 1.90 -4.77 6.14 -0.08 -1.26 -4.93 116.55 111.09 2fwu n ASP 565 Ca 0.05 0.41 -0.41 0.00 -1.51 0.00 0.00 54.79 53.33 2fwu n ASP 565 Cb 0.43 -0.84 -0.01 0.00 2.34 0.00 0.00 41.12 43.04 2fwu n ASP 565 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2fwu s GLU 566 N -2.54 4.23 0.13 -0.67 2.56 -1.25 -5.02 118.70 116.14 2fwu s GLU 566 Ca -0.29 2.39 0.02 0.00 0.00 0.00 0.00 54.97 57.08 2fwu s GLU 566 Cb 0.08 -3.04 0.02 0.00 2.00 0.00 0.00 34.13 33.18 2fwu s GLU 566 CO 0.44 -0.40 0.13 0.44 -0.56 0.00 0.00 175.26 175.31 2fwu n ILE 567 N 1.14 0.00 0.00 -3.70 -5.35 -1.26 -3.68 119.36 106.51 2fwu n ILE 567 Ca 0.03 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 2fwu n ILE 567 Cb 0.40 -0.59 0.00 0.00 -1.74 0.00 0.00 39.64 37.71 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 -0.99 0.00 -4.20 7.28 3.14 -1.26 -4.85 118.33 117.45 2fwu n VAL 568 Ca 0.01 0.00 -0.30 0.00 -2.96 0.00 0.00 64.34 61.09 2fwu n VAL 568 Cb 0.14 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 32.83 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 2.44 -0.10 1.45 -0.14 -1.19 -4.94 119.74 117.26 2fwu s LYS 569 Ca 0.00 -0.87 0.03 0.00 -1.36 0.00 0.00 55.97 53.77 2fwu s LYS 569 Cb 0.00 -2.47 0.01 0.00 -1.68 0.00 0.00 37.83 33.68 2fwu s LYS 569 CO 0.00 0.54 -0.20 0.95 -0.76 0.00 0.00 175.35 175.88 2fwu s THR 570 N -1.24 1.79 -0.60 2.17 -4.23 -1.25 -1.41 115.64 110.87 2fwu s THR 570 Ca 0.23 -0.85 -0.25 0.00 -1.18 0.00 0.00 61.69 59.64 2fwu s THR 570 Cb -0.11 -1.58 0.04 0.00 1.34 0.00 0.00 72.50 72.19 2fwu s THR 570 CO 0.15 0.50 1.06 -0.63 -0.54 0.00 0.00 174.62 175.16 2fwu s ILE 571 N 0.61 4.18 -0.44 2.99 1.09 -1.08 -4.81 121.20 123.75 2fwu s ILE 571 Ca -0.14 0.37 -0.26 0.00 -1.10 0.00 0.00 60.65 59.53 2fwu s ILE 571 Cb -0.17 -4.66 0.02 0.00 -1.06 0.00 0.00 42.46 36.59 2fwu s ILE 571 CO 0.04 -1.33 0.93 -0.94 -0.10 0.00 0.00 174.94 173.54 2fwu s SER 572 N 3.12 6.55 -0.08 3.58 1.04 -1.25 -3.27 113.70 123.39 2fwu s SER 572 Ca 0.33 0.25 0.02 0.00 0.48 0.00 0.00 55.95 57.03 2fwu s SER 572 Cb -0.11 -2.46 -0.02 0.00 0.10 0.00 0.00 66.02 63.53 2fwu s SER 572 CO 0.19 -1.01 -0.14 -0.69 0.98 0.00 0.00 173.24 172.57 2fwu s VAL 573 N 3.70 3.04 -0.21 5.02 1.01 -0.17 -4.91 120.40 127.88 2fwu s VAL 573 Ca 0.38 -0.71 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 2fwu s VAL 573 Cb -0.10 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 2fwu s VAL 573 CO 0.25 0.57 0.37 -0.75 0.00 0.00 0.00 175.10 175.53 2fwu s LYS 574 N -0.36 4.15 -0.10 2.72 2.20 -1.26 -0.84 119.74 126.26 2fwu s LYS 574 Ca 0.04 0.13 -0.16 0.00 -0.36 0.00 0.00 55.97 55.62 2fwu s LYS 574 Cb -0.12 -3.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.61 2fwu s LYS 574 CO 0.02 -0.03 0.40 0.08 -0.36 0.00 0.00 175.35 175.46 2fwu s VAL 575 N 1.31 5.18 0.41 4.02 1.01 -0.35 -0.60 120.40 131.37 2fwu s VAL 575 Ca 0.17 0.80 -0.02 0.00 0.00 0.00 0.00 61.98 62.93 2fwu s VAL 575 Cb -0.15 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2fwu s VAL 575 CO 0.08 0.42 0.65 -0.63 0.00 0.00 0.00 175.10 175.61 2fwu s ILE 576 N 0.10 4.92 -0.18 2.22 -1.09 -1.08 -4.73 121.20 121.36 2fwu s ILE 576 Ca 0.22 -0.22 -0.36 0.00 -2.23 0.00 0.00 60.65 58.06 2fwu s ILE 576 Cb -0.15 -3.83 -0.13 0.00 -1.58 0.00 0.00 42.46 36.78 2fwu s ILE 576 CO 0.09 -0.64 1.87 -0.67 -1.23 0.00 0.00 174.94 174.35 2fwu n ASP 577 N -1.99 2.99 -4.88 3.58 2.03 -1.26 -4.83 116.55 112.19 2fwu n ASP 577 Ca -0.02 0.95 -0.31 0.00 0.52 0.00 0.00 54.79 55.93 2fwu n ASP 577 Cb 0.56 -1.29 -0.05 0.00 -0.72 0.00 0.00 41.12 39.63 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 4.24 6.58 0.00 1.67 2.15 -1.26 -4.88 116.67 125.17 2fwu s ASP 578 Ca 0.96 0.90 0.00 0.00 0.43 0.00 0.00 52.55 54.84 2fwu s ASP 578 Cb -0.83 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 39.57 2fwu s ASP 578 CO 0.56 -0.12 0.00 -1.84 -0.17 0.00 0.00 175.17 173.60 2fwu n GLU 579 N -0.39 2.40 -4.09 4.34 0.00 -1.26 -5.13 120.64 116.51 2fwu n GLU 579 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 57.16 56.89 2fwu n GLU 579 Cb 0.53 -0.80 -0.02 0.00 0.00 0.00 0.00 31.44 31.14 2fwu n GLU 579 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.13 175.30 2fwu s GLU 580 N -1.48 2.24 0.74 3.44 1.03 -1.26 -5.10 118.70 118.32 2fwu s GLU 580 Ca 0.00 -2.10 -0.15 0.00 0.03 0.00 0.00 54.97 52.76 2fwu s GLU 580 Cb 0.00 -1.97 0.05 0.00 -0.80 0.00 0.00 34.13 31.41 2fwu s GLU 580 CO 0.00 -0.54 1.21 1.52 -1.33 0.00 0.00 175.26 176.12 2fwu s TYR 581 N -2.79 2.00 0.22 4.83 -0.85 -1.26 -5.01 117.35 114.50 2fwu s TYR 581 Ca 0.28 1.61 -0.04 0.00 -0.52 0.00 0.00 57.07 58.39 2fwu s TYR 581 Cb -0.01 -3.48 -0.05 0.00 0.38 0.00 0.00 41.96 38.79 2fwu s TYR 581 CO 0.17 -2.67 0.46 -2.00 -1.52 0.00 0.00 175.55 169.98 2fwu s GLU 582 N -3.94 3.61 0.08 -3.49 2.56 -1.26 -5.07 118.70 111.19 2fwu s GLU 582 Ca 0.74 -0.09 0.02 0.00 0.00 0.00 0.00 54.97 55.64 2fwu s GLU 582 Cb -0.29 -2.76 -0.01 0.00 2.00 0.00 0.00 34.13 33.07 2fwu s GLU 582 CO 0.46 0.35 0.06 0.36 -0.56 0.00 0.00 175.26 175.93 2fwu n LYS 583 N -0.48 0.27 -2.54 4.30 2.85 -1.26 -5.03 118.16 116.28 2fwu n LYS 583 Ca -0.02 -0.75 -0.40 0.00 -1.05 0.00 0.00 58.31 56.08 2fwu n LYS 583 Cb 0.53 0.57 -0.03 0.00 -0.65 0.00 0.00 35.03 35.45 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 -1.53 6.38 -0.37 -5.58 2.47 -1.26 -4.89 114.94 110.16 2fwu s ASN 584 Ca 0.08 -1.25 -0.09 0.00 0.42 0.00 0.00 52.86 52.02 2fwu s ASN 584 Cb 0.00 -2.57 0.04 0.00 -1.45 0.00 0.00 41.25 37.28 2fwu s ASN 584 CO 0.06 -1.62 0.18 -0.75 -3.72 0.00 0.00 177.10 171.25 2fwu s LYS 585 N 5.19 2.71 -0.01 0.43 2.36 -1.26 -4.91 119.74 124.25 2fwu s LYS 585 Ca 0.45 -1.18 -0.03 0.00 -2.55 0.00 0.00 55.97 52.66 2fwu s LYS 585 Cb -0.02 -3.64 -0.00 0.00 -1.05 0.00 0.00 37.83 33.12 2fwu s LYS 585 CO -0.05 -0.73 0.07 -0.08 1.55 0.00 0.00 175.35 176.11 2fwu s THR 586 N 1.48 0.06 0.14 3.43 -1.32 -1.26 -1.96 115.64 116.20 2fwu s THR 586 Ca 0.01 -0.46 0.06 0.00 -1.21 0.00 0.00 61.69 60.09 2fwu s THR 586 Cb -0.20 -0.26 -0.04 0.00 -1.51 0.00 0.00 72.50 70.49 2fwu s THR 586 CO 0.05 -0.25 -0.14 0.72 -2.21 0.00 0.00 174.62 172.78 2fwu s PHE 587 N -0.80 1.46 -0.09 9.09 -0.12 -1.02 -3.48 117.98 123.02 2fwu s PHE 587 Ca -0.09 -0.56 -0.00 0.00 -0.05 0.00 0.00 56.93 56.22 2fwu s PHE 587 Cb -0.05 -0.75 -0.03 0.00 -0.63 0.00 0.00 43.02 41.56 2fwu s PHE 587 CO 0.00 0.18 -0.05 -0.06 -0.05 0.00 0.00 175.22 175.24 2fwu s PHE 588 N -2.29 2.99 -0.18 3.49 0.08 -0.32 -1.07 117.98 120.68 2fwu s PHE 588 Ca 0.11 -0.01 -0.03 0.00 0.12 0.00 0.00 56.93 57.12 2fwu s PHE 588 Cb -0.04 -1.77 -0.02 0.00 -0.57 0.00 0.00 43.02 40.62 2fwu s PHE 588 CO 0.03 0.28 -0.05 -1.17 -0.10 0.00 0.00 175.22 174.22 2fwu s LEU 589 N -0.61 3.02 -0.06 -0.37 1.98 0.49 0.32 118.68 123.45 2fwu s LEU 589 Ca 0.09 -0.27 0.03 0.00 -2.89 0.00 0.00 54.13 51.09 2fwu s LEU 589 Cb -0.12 -1.74 0.01 0.00 0.66 0.00 0.00 46.19 45.00 2fwu s LEU 589 CO 0.02 0.09 -0.14 -0.70 -1.89 0.00 0.00 176.35 173.73 2fwu s GLU 590 N 0.84 1.75 -0.08 1.98 2.12 -0.50 -0.87 118.70 123.94 2fwu s GLU 590 Ca -0.01 -0.47 -0.16 0.00 0.36 0.00 0.00 54.97 54.69 2fwu s GLU 590 Cb -0.15 -1.45 -0.05 0.00 0.26 0.00 0.00 34.13 32.74 2fwu s GLU 590 CO 0.01 0.08 0.40 0.96 -0.54 0.00 0.00 175.26 176.17 2fwu s ILE 591 N 0.51 5.16 0.00 -3.70 -4.36 -1.26 -0.97 121.20 116.58 2fwu s ILE 591 Ca -0.12 0.79 0.00 0.00 -0.26 0.00 0.00 60.65 61.06 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 0.04 0.44 0.00 0.61 0.24 0.00 0.00 174.94 176.27 2fwu n GLY 592 N 2.72 1.25 3.66 6.27 0.00 0.99 -4.90 105.19 115.18 2fwu n GLY 592 Ca -0.11 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 43.92 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 1.47 4.23 0.85 1.61 2.12 -1.26 -4.78 118.70 122.94 2fwu s GLU 593 Ca 0.00 0.67 -0.11 0.00 0.36 0.00 0.00 54.97 55.89 2fwu s GLU 593 Cb 0.00 -3.57 0.10 0.00 0.26 0.00 0.00 34.13 30.92 2fwu s GLU 593 CO 0.00 -0.23 1.10 -1.25 -0.54 0.00 0.00 175.26 174.34 2fwu s PRO 594 N 1.87 1.65 0.02 4.30 0.04 -1.26 -4.54 135.00 137.08 2fwu s PRO 594 Ca 0.30 1.08 0.04 0.00 0.04 0.00 0.00 61.00 62.46 2fwu s PRO 594 Cb -0.16 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2fwu s PRO 594 CO 0.11 -2.04 -0.14 -0.98 0.04 0.00 0.00 177.00 173.99 2fwu s ARG 595 N -4.87 0.98 -0.08 4.56 1.70 0.82 -4.27 118.95 117.79 2fwu s ARG 595 Ca 0.63 -0.64 -0.25 0.00 -0.47 0.00 0.00 55.73 55.00 2fwu s ARG 595 Cb -0.18 -0.96 -0.03 0.00 -0.57 0.00 0.00 34.95 33.20 2fwu s ARG 595 CO 0.57 0.25 0.76 -1.17 -1.08 0.00 0.00 175.30 174.63 2fwu s LEU 596 N -0.80 4.29 0.16 -1.89 1.98 -1.26 -0.26 118.68 120.90 2fwu s LEU 596 Ca 0.03 1.24 -0.09 0.00 -2.89 0.00 0.00 54.13 52.41 2fwu s LEU 596 Cb -0.07 -3.17 0.02 0.00 0.66 0.00 0.00 46.19 43.63 2fwu s LEU 596 CO 0.01 -0.19 1.55 0.58 -1.89 0.00 0.00 176.35 176.40 2fwu h VAL 597 N 4.86 1.27 -3.33 1.68 2.07 -1.05 -3.43 116.25 118.31 2fwu h VAL 597 Ca -0.38 -1.41 -0.65 0.00 0.82 0.00 0.00 66.70 65.08 2fwu h VAL 597 Cb 1.19 1.17 -0.15 0.00 -1.52 0.00 0.00 31.29 31.98 2fwu h VAL 597 CO 0.77 0.48 -0.72 -1.83 0.02 0.00 0.00 177.57 176.29 2fwu s GLU 598 N -4.62 2.15 -0.33 1.57 -1.05 -1.26 -5.06 118.70 110.10 2fwu s GLU 598 Ca -0.11 -1.09 -0.27 0.00 -0.15 0.00 0.00 54.97 53.35 2fwu s GLU 598 Cb 0.12 -2.28 0.01 0.00 -0.44 0.00 0.00 34.13 31.54 2fwu s GLU 598 CO 0.87 0.48 0.96 -1.64 0.95 0.00 0.00 175.26 176.88 2fwu s MET 599 N -2.46 3.97 -0.33 -4.83 -1.94 -1.26 -4.94 119.30 107.50 2fwu s MET 599 Ca 0.23 0.79 -0.38 0.00 -1.71 0.00 0.00 55.69 54.63 2fwu s MET 599 Cb -0.10 -3.76 -0.13 0.00 2.01 0.00 0.00 34.83 32.85 2fwu s MET 599 CO 0.15 -0.87 2.03 0.43 -0.01 0.00 0.00 175.02 176.75 2fwu n SER 600 N 6.69 2.15 -4.19 3.03 7.64 -1.26 -4.83 113.62 122.85 2fwu n SER 600 Ca 0.08 0.67 -0.40 0.00 1.01 0.00 0.00 58.87 60.24 2fwu n SER 600 Cb 0.48 -1.20 -0.02 0.00 -1.01 0.00 0.00 64.21 62.46 2fwu n SER 600 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2fwu n GLU 601 N 7.20 2.47 -3.91 1.43 -0.58 -1.26 -4.86 120.64 121.13 2fwu n GLU 601 Ca 0.37 -2.68 -0.36 0.00 -0.42 0.00 0.00 57.16 54.08 2fwu n GLU 601 Cb 0.18 -3.39 -0.11 0.00 -0.57 0.00 0.00 31.44 27.54 2fwu n GLU 601 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2fwu s LYS 602 N 4.57 3.80 -0.87 3.49 -2.85 -1.26 -5.02 119.74 121.60 2fwu s LYS 602 Ca 0.56 -0.42 -0.24 0.00 -1.00 0.00 0.00 55.97 54.87 2fwu s LYS 602 Cb 0.07 -3.26 0.05 0.00 -2.06 0.00 0.00 37.83 32.64 2fwu s LYS 602 CO 0.05 0.03 1.30 0.21 0.10 0.00 0.00 175.35 177.05 2fwu s LYS 603 N 1.02 3.40 -0.15 1.78 2.20 -1.26 -4.53 119.74 122.20 2fwu s LYS 603 Ca 0.04 -0.85 -0.11 0.00 -0.36 0.00 0.00 55.97 54.70 2fwu s LYS 603 Cb -0.14 -4.77 -0.07 0.00 -1.51 0.00 0.00 37.83 31.34 2fwu s LYS 603 CO 0.03 -2.10 -0.24 0.41 -0.36 0.00 0.00 175.35 173.09 2fwu n GLY 604 N 6.03 -0.34 2.44 5.54 0.00 -1.26 -5.03 105.19 112.58 2fwu n GLY 604 Ca 0.17 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 2fwu n GLY 604 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fwu n GLY 605 N 1.92 -0.15 3.52 -0.02 0.00 -1.26 -5.01 105.19 104.19 2fwu n GLY 605 Ca -0.27 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.27 2fwu n GLY 605 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2fwu s PHE 606 N -2.84 2.40 0.74 1.61 5.36 -1.26 -5.14 117.98 118.85 2fwu s PHE 606 Ca 0.11 -0.33 0.00 0.00 -0.96 0.00 0.00 56.93 55.76 2fwu s PHE 606 Cb -0.05 -1.10 0.14 0.00 -0.34 0.00 0.00 43.02 41.68 2fwu s PHE 606 CO 0.14 0.67 1.02 0.95 -1.46 0.00 0.00 175.22 176.54 2fwu s THR 607 N -2.48 2.03 0.51 0.12 -4.23 -1.26 -5.13 115.64 105.21 2fwu s THR 607 Ca 0.31 -0.63 0.06 0.00 -1.18 0.00 0.00 61.69 60.25 2fwu s THR 607 Cb -0.04 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 71.41 2fwu s THR 607 CO 0.16 0.00 0.36 -0.63 -0.54 0.00 0.00 174.62 173.97 2fwu s ILE 608 N -3.16 1.84 -0.63 2.99 1.01 -1.26 -4.99 121.20 116.99 2fwu s ILE 608 Ca 0.68 -1.52 0.00 0.00 0.00 0.00 0.00 60.65 59.81 2fwu s ILE 608 Cb -0.04 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 40.07 2fwu s ILE 608 CO 0.45 0.00 0.38 0.41 0.00 0.00 0.00 174.94 176.18 2fwu n THR 609 N -1.65 0.21 -1.26 2.92 -1.04 -1.26 -4.75 114.28 107.45 2fwu n THR 609 Ca -0.02 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.91 2fwu n THR 609 Cb 0.64 -0.47 -0.04 0.00 -1.82 0.00 0.00 70.33 68.65 2fwu n THR 609 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2fwu n GLU 610 N 0.40 -1.67 -2.75 -2.82 -0.58 -1.26 -4.98 120.64 106.99 2fwu n GLU 610 Ca 0.00 0.79 -0.22 0.00 -0.42 0.00 0.00 57.16 57.31 2fwu n GLU 610 Cb 0.19 -5.18 0.10 0.00 -0.57 0.00 0.00 31.44 25.98 2fwu n GLU 610 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 2fwu s GLU 611 N -2.69 1.85 -0.16 3.49 4.04 -1.26 -5.07 118.70 118.90 2fwu s GLU 611 Ca 0.00 -1.33 -0.10 0.00 0.04 0.00 0.00 54.97 53.58 2fwu s GLU 611 Cb 0.00 -2.44 -0.05 0.00 0.02 0.00 0.00 34.13 31.67 2fwu s GLU 611 CO 0.00 -1.28 0.17 0.71 -1.84 0.00 0.00 175.26 173.02 2fwu s TYR 612 N -2.99 3.48 -0.05 4.83 2.02 -1.26 -4.97 117.35 118.42 2fwu s TYR 612 Ca 0.65 0.46 -0.22 0.00 -0.37 0.00 0.00 57.07 57.60 2fwu s TYR 612 Cb -0.05 -2.14 -0.32 0.00 -0.40 0.00 0.00 41.96 39.05 2fwu s TYR 612 CO 0.43 0.42 0.90 0.22 -1.57 0.00 0.00 175.55 175.94 2fwu h ASP 613 N 6.13 0.48 -2.11 2.29 1.82 -2.01 -3.48 116.42 119.55 2fwu h ASP 613 Ca -0.45 -0.96 -0.19 0.00 -0.39 0.00 0.00 57.03 55.04 2fwu h ASP 613 Cb 1.18 -0.16 -0.06 0.00 0.68 0.00 0.00 39.33 40.97 2fwu h ASP 613 CO 0.70 1.40 -0.19 -0.90 -1.61 0.00 0.00 179.24 178.65 2fwu n ASP 614 N -4.11 -2.59 -2.24 2.28 5.68 -1.26 -2.16 116.55 112.15 2fwu n ASP 614 Ca -0.14 0.24 -0.20 0.00 -0.50 0.00 0.00 54.79 54.19 2fwu n ASP 614 Cb 0.83 -2.49 -0.01 0.00 -1.14 0.00 0.00 41.12 38.31 2fwu n ASP 614 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2fwu n LYS 615 N -1.85 -1.58 -2.06 0.11 5.02 -1.26 -4.98 118.16 111.55 2fwu n LYS 615 Ca -0.10 0.98 -0.37 0.00 -2.02 0.00 0.00 58.31 56.80 2fwu n LYS 615 Cb 0.36 -5.58 0.01 0.00 -0.02 0.00 0.00 35.03 29.81 2fwu n LYS 615 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 2fwu s GLN 616 N -4.93 3.46 0.00 1.97 -2.07 -0.92 -5.03 119.66 112.14 2fwu s GLN 616 Ca 0.00 1.95 0.00 0.00 -1.82 0.00 0.00 55.36 55.49 2fwu s GLN 616 Cb 0.00 -2.31 0.00 0.00 -1.09 0.00 0.00 33.01 29.61 2fwu s GLN 616 CO 0.00 -0.84 0.00 -0.35 -1.32 0.00 0.00 175.29 172.78 2fwu n PRO 617 N -0.78 1.43 -1.67 9.60 -0.04 -1.26 -4.85 135.00 137.43 2fwu n PRO 617 Ca 0.09 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.11 2fwu n PRO 617 Cb 0.47 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.90 2fwu n PRO 617 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2fwu n LEU 618 N 0.00 3.96 0.00 1.53 7.99 -1.26 -4.76 117.00 124.46 2fwu n LEU 618 Ca 0.00 0.92 0.00 0.00 -0.01 0.00 0.00 56.01 56.92 2fwu n LEU 618 Cb 0.00 -1.48 0.00 0.00 -0.11 0.00 0.00 43.42 41.83 2fwu n LEU 618 CO 0.00 0.13 0.00 1.07 -1.51 0.00 0.00 177.39 177.08 2fwu n THR 619 N 5.41 0.00 -0.89 -5.08 5.66 -1.26 -4.98 114.28 113.14 2fwu n THR 619 Ca 0.21 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.16 2fwu n THR 619 Cb 0.37 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.13 2fwu n THR 619 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2fwu n SER 620 N -2.08 -3.28 -4.36 1.09 3.41 -1.26 -4.89 113.62 102.24 2fwu n SER 620 Ca 0.00 0.12 -0.46 0.00 -0.26 0.00 0.00 58.87 58.27 2fwu n SER 620 Cb 0.00 -2.52 -0.03 0.00 -0.26 0.00 0.00 64.21 61.40 2fwu n SER 620 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2fwu s LYS 621 N -1.91 3.46 0.11 4.33 2.47 -1.26 -4.22 119.74 122.73 2fwu s LYS 621 Ca 0.00 -2.08 0.00 0.00 -1.56 0.00 0.00 55.97 52.33 2fwu s LYS 621 Cb 0.00 -4.50 0.00 0.00 -1.46 0.00 0.00 37.83 31.87 2fwu s LYS 621 CO 0.00 -1.43 0.00 -1.91 0.16 0.00 0.00 175.35 172.17 2fwu n GLU 622 N 4.98 0.00 -3.60 4.03 4.07 -1.26 -5.14 120.64 123.71 2fwu n GLU 622 Ca 0.10 0.00 -0.06 0.00 -0.06 0.00 0.00 57.16 57.14 2fwu n GLU 622 Cb 0.46 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.82 2fwu n GLU 622 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2fwu s GLU 623 N -1.37 0.86 0.58 5.31 -6.30 -1.26 -5.03 118.70 111.49 2fwu s GLU 623 Ca 0.00 -0.39 0.35 0.00 -2.50 0.00 0.00 54.97 52.43 2fwu s GLU 623 Cb 0.00 0.34 1.72 0.00 0.00 0.00 0.00 34.13 36.19 2fwu s GLU 623 CO 0.00 -0.38 2.13 1.05 0.02 0.00 0.00 175.26 178.07 2fwu h GLU 624 N 2.00 0.00 0.00 4.30 4.11 -2.02 -0.97 114.58 122.00 2fwu h GLU 624 Ca -0.22 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.16 2fwu h GLU 624 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2fwu h GLU 624 CO 0.28 0.04 -0.22 0.93 0.07 0.00 0.00 179.01 180.11 2fwu h GLU 625 N 0.00 0.00 -0.13 1.06 5.08 -1.96 -2.36 114.58 116.27 2fwu h GLU 625 Ca -0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.21 2fwu h GLU 625 Cb 0.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2fwu h GLU 625 CO 0.01 0.22 -0.54 0.00 -1.00 0.00 0.00 179.01 177.70 2fwu h ARG 626 N 0.00 0.39 -1.20 2.33 3.08 -1.51 -3.02 114.38 114.45 2fwu h ARG 626 Ca -0.00 -0.24 0.34 0.00 0.07 0.00 0.00 59.98 60.15 2fwu h ARG 626 Cb 0.40 0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.40 2fwu h ARG 626 CO 0.03 0.83 0.81 0.00 -1.07 0.00 0.00 179.97 180.57 2fwu h ARG 627 N 0.30 0.17 -0.05 0.04 2.47 -1.47 0.48 114.38 116.33 2fwu h ARG 627 Ca 0.01 -0.01 -0.24 0.00 -1.26 0.00 0.00 59.98 58.48 2fwu h ARG 627 Cb 1.04 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 29.33 2fwu h ARG 627 CO 0.09 0.11 -0.91 0.82 0.56 0.00 0.00 179.97 180.64 2fwu h ILE 628 N 0.18 1.32 -0.06 2.04 2.04 -1.60 -1.35 117.51 120.07 2fwu h ILE 628 Ca 0.65 -2.22 -0.18 0.00 1.00 0.00 0.00 64.86 64.12 2fwu h ILE 628 Cb 2.10 2.26 -0.01 0.00 -0.74 0.00 0.00 36.82 40.43 2fwu h ILE 628 CO -0.21 0.68 -0.73 0.00 0.00 0.00 0.00 178.15 177.90 2fwu h ALA 629 N 0.59 0.64 0.00 1.87 0.00 -0.51 -2.47 119.26 119.38 2fwu h ALA 629 Ca -0.09 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.16 2fwu h ALA 629 Cb 1.55 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2fwu h ALA 629 CO 0.17 0.78 -0.24 0.93 0.00 0.00 0.00 179.25 180.90 2fwu h GLU 630 N 0.23 0.00 -0.01 0.00 4.39 -0.18 -0.30 114.58 118.71 2fwu h GLU 630 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2fwu h GLU 630 Cb 1.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 2fwu h GLU 630 CO 0.12 0.24 -0.18 0.00 -1.16 0.00 0.00 179.01 178.03 2fwu n MET 631 N -3.78 1.07 0.19 2.33 0.00 -0.52 -3.03 117.12 113.38 2fwu n MET 631 Ca -0.01 -0.62 0.11 0.00 0.00 0.00 0.00 57.70 57.17 2fwu n MET 631 Cb 0.34 -1.49 0.12 0.00 0.00 0.00 0.00 33.22 32.19 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 4.91 0.00 -4.27 3.17 0.00 -0.59 -3.42 103.07 102.86 2fwu h GLY 632 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 2fwu h GLY 632 CO 0.00 0.00 -0.32 0.50 0.00 0.00 0.00 176.54 176.72 2fwu s ARG 633 N -3.22 3.60 0.41 4.80 0.52 -1.08 -4.88 118.95 119.09 2fwu s ARG 633 Ca 0.05 -0.13 -0.23 0.00 -0.52 0.00 0.00 55.73 54.90 2fwu s ARG 633 Cb 0.06 -2.86 -0.09 0.00 0.52 0.00 0.00 34.95 32.58 2fwu s ARG 633 CO 0.70 0.47 1.03 -1.25 0.02 0.00 0.00 175.30 176.27 2fwu s PRO 634 N -2.70 4.16 0.15 3.54 0.04 -1.26 -4.65 135.00 134.28 2fwu s PRO 634 Ca 0.41 1.44 0.01 0.00 0.04 0.00 0.00 61.00 62.89 2fwu s PRO 634 Cb -0.12 -2.47 -0.00 0.00 0.04 0.00 0.00 34.50 31.95 2fwu s PRO 634 CO 0.25 -0.13 0.03 0.44 0.04 0.00 0.00 177.00 177.63 2fwu n ILE 635 N -0.19 0.00 -2.46 0.56 -6.64 -1.22 -4.03 119.36 105.38 2fwu n ILE 635 Ca 0.05 -0.82 -0.34 0.00 -1.77 0.00 0.00 62.75 59.88 2fwu n ILE 635 Cb 0.50 0.24 -0.03 0.00 -1.44 0.00 0.00 39.64 38.92 2fwu n ILE 635 CO 0.00 0.00 0.00 -1.48 -1.77 0.00 0.00 176.55 173.30 2fwu s LEU 636 N 0.00 3.79 0.00 7.28 -0.00 -1.26 -3.85 118.68 124.64 2fwu s LEU 636 Ca 0.04 1.93 0.00 0.00 -0.00 0.00 0.00 54.13 56.11 2fwu s LEU 636 Cb 0.00 -4.56 0.00 0.00 -0.00 0.00 0.00 46.19 41.63 2fwu s LEU 636 CO 0.03 -0.86 0.16 0.61 -0.00 0.00 0.00 176.35 176.28 2fwu n GLY 637 N -0.31 -0.68 2.13 -3.48 0.00 0.47 -4.54 105.19 98.78 2fwu n GLY 637 Ca 0.09 0.00 0.00 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 -1.83 0.00 -4.01 1.61 2.13 -1.26 -4.86 120.64 112.42 2fwu n GLU 638 Ca 0.00 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.51 2fwu n GLU 638 Cb 0.00 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 31.56 2fwu n GLU 638 CO 0.00 0.00 0.00 -3.38 -0.41 0.00 0.00 177.13 173.34 2fwu s HIS 639 N -2.00 3.67 -0.81 4.31 -3.43 -1.26 -5.03 115.29 110.75 2fwu s HIS 639 Ca 0.00 -2.97 -0.15 0.00 -0.80 0.00 0.00 55.06 51.14 2fwu s HIS 639 Cb 0.00 -2.88 0.20 0.00 -1.43 0.00 0.00 32.58 28.47 2fwu s HIS 639 CO 0.00 -0.94 0.78 0.95 -2.00 0.00 0.00 174.74 173.53 2fwu s THR 640 N 0.88 5.45 -0.30 -5.38 -4.23 -1.26 -3.81 115.64 106.99 2fwu s THR 640 Ca 0.11 -2.24 -0.19 0.00 -1.18 0.00 0.00 61.69 58.20 2fwu s THR 640 Cb -0.19 -4.49 0.19 0.00 1.34 0.00 0.00 72.50 69.35 2fwu s THR 640 CO -0.08 -1.07 1.27 -0.75 -0.54 0.00 0.00 174.62 173.45 2fwu s LYS 641 N 0.66 0.10 -0.11 3.99 2.36 -1.26 -4.74 119.74 120.75 2fwu s LYS 641 Ca 0.18 0.16 -0.01 0.00 -2.55 0.00 0.00 55.97 53.75 2fwu s LYS 641 Cb -0.12 0.03 0.03 0.00 -1.05 0.00 0.00 37.83 36.73 2fwu s LYS 641 CO -0.07 -0.02 -0.01 -1.17 1.55 0.00 0.00 175.35 175.63 2fwu s LEU 642 N 0.76 0.86 -0.45 5.43 2.96 -0.05 -4.21 118.68 123.99 2fwu s LEU 642 Ca -0.04 -0.28 -0.16 0.00 -0.22 0.00 0.00 54.13 53.43 2fwu s LEU 642 Cb -0.03 -0.57 0.05 0.00 0.50 0.00 0.00 46.19 46.13 2fwu s LEU 642 CO -0.12 -0.20 0.38 -0.70 -1.32 0.00 0.00 176.35 174.40 2fwu s GLU 643 N 1.88 3.00 -0.43 1.98 2.12 0.11 -0.38 118.70 126.98 2fwu s GLU 643 Ca 0.04 -1.14 -0.18 0.00 0.36 0.00 0.00 54.97 54.05 2fwu s GLU 643 Cb -0.13 -4.06 0.02 0.00 0.26 0.00 0.00 34.13 30.22 2fwu s GLU 643 CO -0.06 -0.92 0.50 0.08 -0.54 0.00 0.00 175.26 174.31 2fwu s VAL 644 N 1.78 5.01 -0.27 3.70 1.01 -0.23 -1.08 120.40 130.32 2fwu s VAL 644 Ca 0.06 -0.24 -0.16 0.00 0.00 0.00 0.00 61.98 61.64 2fwu s VAL 644 Cb -0.21 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 2fwu s VAL 644 CO 0.09 -0.48 0.41 -0.63 0.00 0.00 0.00 175.10 174.48 2fwu s ILE 645 N 2.33 5.15 -0.12 2.22 1.09 0.08 -2.45 121.20 129.50 2fwu s ILE 645 Ca 0.15 0.64 -0.03 0.00 -1.10 0.00 0.00 60.65 60.31 2fwu s ILE 645 Cb -0.16 -3.73 -0.03 0.00 -1.06 0.00 0.00 42.46 37.47 2fwu s ILE 645 CO 0.15 0.13 -0.02 -0.63 -0.10 0.00 0.00 174.94 174.48 2fwu s ILE 646 N 2.13 4.12 0.11 2.92 1.09 -0.83 -1.48 121.20 129.26 2fwu s ILE 646 Ca 0.17 -0.30 0.01 0.00 -1.10 0.00 0.00 60.65 59.43 2fwu s ILE 646 Cb -0.16 -2.77 -0.04 0.00 -1.06 0.00 0.00 42.46 38.43 2fwu s ILE 646 CO 0.10 0.54 -0.03 -1.83 -0.10 0.00 0.00 174.94 173.61 2fwu s GLU 647 N -0.20 0.88 -0.49 2.79 4.04 -1.19 -4.28 118.70 120.25 2fwu s GLU 647 Ca 0.04 -1.38 -0.26 0.00 0.04 0.00 0.00 54.97 53.42 2fwu s GLU 647 Cb -0.13 -0.13 -0.06 0.00 0.02 0.00 0.00 34.13 33.83 2fwu s GLU 647 CO 0.02 -0.08 2.35 -1.21 -1.84 0.00 0.00 175.26 174.50 2fwu s GLU 648 N -3.88 2.18 -0.24 -4.83 0.41 -1.26 -2.85 118.70 108.24 2fwu s GLU 648 Ca 0.15 1.35 -0.04 0.00 -0.41 0.00 0.00 54.97 56.02 2fwu s GLU 648 Cb 0.06 -4.56 -0.07 0.00 -1.78 0.00 0.00 34.13 27.78 2fwu s GLU 648 CO -0.03 -3.19 0.54 0.43 -0.49 0.00 0.00 175.26 172.53 2fwu n SER 649 N 15.47 -0.23 0.02 -0.19 7.64 -1.26 -4.69 113.62 130.38 2fwu n SER 649 Ca 0.35 -0.08 0.00 0.00 1.01 0.00 0.00 58.87 60.15 2fwu n SER 649 Cb 0.54 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 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 1.63 -0.39 -2.22 1.43 9.36 -1.26 -5.04 117.16 120.67 2fwu n TYR 650 Ca 0.16 0.07 -0.38 0.00 3.32 0.00 0.00 57.90 61.07 2fwu n TYR 650 Cb 0.03 0.39 -0.01 0.00 -0.63 0.00 0.00 39.34 39.11 2fwu n TYR 650 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2fwu s GLU 651 N -2.00 3.95 -0.03 2.98 2.02 -1.26 -5.02 118.70 119.33 2fwu s GLU 651 Ca 0.00 1.91 -0.01 0.00 0.02 0.00 0.00 54.97 56.89 2fwu s GLU 651 Cb 0.00 -2.63 0.03 0.00 0.10 0.00 0.00 34.13 31.63 2fwu s GLU 651 CO 0.00 -0.43 0.05 0.12 0.02 0.00 0.00 175.26 175.02 2fwu s PHE 652 N -1.40 0.04 0.00 1.61 5.36 -1.26 -4.73 117.98 117.60 2fwu s PHE 652 Ca 0.59 0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.76 2fwu s PHE 652 Cb -0.32 -0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.00 2fwu s PHE 652 CO 0.40 -0.14 0.00 1.63 -1.46 0.00 0.00 175.22 175.65 2fwu n LYS 653 N 4.77 -0.62 -1.92 10.12 4.76 -1.26 -4.94 118.16 129.08 2fwu n LYS 653 Ca -0.15 0.15 -0.40 0.00 -2.87 0.00 0.00 58.31 55.05 2fwu n LYS 653 Cb 0.50 -3.65 -0.03 0.00 -1.84 0.00 0.00 35.03 30.02 2fwu n LYS 653 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2fwu s SER 654 N -2.08 5.33 0.05 4.39 0.01 -1.26 -4.90 113.70 115.23 2fwu s SER 654 Ca 0.00 0.87 -0.04 0.00 1.31 0.00 0.00 55.95 58.09 2fwu s SER 654 Cb 0.00 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 2fwu s SER 654 CO 0.00 -2.23 0.05 0.42 0.41 0.00 0.00 173.24 171.89 2fwu s THR 655 N 8.89 0.16 0.40 1.44 -4.23 -1.26 -1.37 115.64 119.67 2fwu s THR 655 Ca 0.78 -1.33 0.05 0.00 -1.18 0.00 0.00 61.69 60.01 2fwu s THR 655 Cb -0.18 -1.09 0.05 0.00 1.34 0.00 0.00 72.50 72.62 2fwu s THR 655 CO 0.27 -0.74 0.44 1.33 -0.54 0.00 0.00 174.62 175.38 2fwu n VAL 656 N 0.53 0.00 1.77 2.29 0.24 -1.20 -5.02 118.33 116.94 2fwu n VAL 656 Ca -0.17 -1.46 0.15 0.00 -2.04 0.00 0.00 64.34 60.82 2fwu n VAL 656 Cb 0.59 -0.42 0.75 0.00 -1.47 0.00 0.00 33.84 33.30 2fwu n VAL 656 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16