#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fwu n ALA 502 N 0.00 0.00 -2.47 1.57 0.00 -1.26 -4.59 120.51 113.76 2fwu n ALA 502 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 2fwu n ALA 502 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2fwu n ALA 502 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2fwu s GLY 503 N -0.55 2.29 -0.41 0.00 0.00 -1.25 -4.56 107.32 102.84 2fwu s GLY 503 Ca 0.00 -1.65 0.04 0.00 0.00 0.00 0.00 44.72 43.10 2fwu s GLY 503 CO 0.00 -1.80 0.13 -0.42 0.00 0.00 0.00 173.10 171.01 2fwu s ILE 504 N -3.30 2.45 -0.29 0.90 1.09 -1.26 -4.37 121.20 116.41 2fwu s ILE 504 Ca 0.31 -2.68 -0.06 0.00 -1.10 0.00 0.00 60.65 57.11 2fwu s ILE 504 Cb 0.06 -2.76 0.01 0.00 -1.06 0.00 0.00 42.46 38.70 2fwu s ILE 504 CO 0.15 -0.68 0.07 -0.36 -0.10 0.00 0.00 174.94 174.02 2fwu s PHE 505 N 0.49 3.14 0.15 3.97 0.08 -1.26 -2.79 117.98 121.76 2fwu s PHE 505 Ca 0.13 -1.00 -0.09 0.00 0.12 0.00 0.00 56.93 56.09 2fwu s PHE 505 Cb -0.21 -2.24 -0.01 0.00 -0.57 0.00 0.00 43.02 39.99 2fwu s PHE 505 CO -0.05 -0.58 0.28 -0.08 -0.10 0.00 0.00 175.22 174.69 2fwu s THR 506 N 1.49 0.08 0.35 0.64 -1.32 -1.26 -0.50 115.64 115.13 2fwu s THR 506 Ca 0.03 -1.33 0.01 0.00 -1.21 0.00 0.00 61.69 59.18 2fwu s THR 506 Cb -0.17 -1.75 -0.03 0.00 -1.51 0.00 0.00 72.50 69.04 2fwu s THR 506 CO 0.02 -0.35 0.55 -0.36 -2.21 0.00 0.00 174.62 172.28 2fwu s PHE 507 N -3.95 3.49 -0.08 9.09 0.08 -1.02 -0.91 117.98 124.67 2fwu s PHE 507 Ca 0.15 0.34 0.06 0.00 0.12 0.00 0.00 56.93 57.60 2fwu s PHE 507 Cb 0.03 -1.91 -0.24 0.00 -0.57 0.00 0.00 43.02 40.33 2fwu s PHE 507 CO -0.02 0.10 0.51 -1.91 -0.10 0.00 0.00 175.22 173.80 2fwu n GLU 508 N -1.80 0.68 -4.96 0.44 2.13 -1.26 -4.78 120.64 111.08 2fwu n GLU 508 Ca -0.04 0.27 -0.28 0.00 0.66 0.00 0.00 57.16 57.76 2fwu n GLU 508 Cb 0.56 -1.74 -0.16 0.00 0.27 0.00 0.00 31.44 30.37 2fwu n GLU 508 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 2fwu s GLU 509 N -2.58 2.04 0.00 5.31 1.03 -1.26 -4.89 118.70 118.35 2fwu s GLU 509 Ca -0.11 -0.70 0.28 0.00 0.03 0.00 0.00 54.97 54.47 2fwu s GLU 509 Cb 0.07 -1.75 1.14 0.00 -0.80 0.00 0.00 34.13 32.80 2fwu s GLU 509 CO 0.80 0.27 1.80 -0.35 -1.33 0.00 0.00 175.26 176.46 2fwu n PRO 510 N 3.12 0.74 -3.78 -4.83 -0.04 -1.25 -4.70 135.00 124.26 2fwu n PRO 510 Ca -0.18 -0.30 -0.13 0.00 -0.04 0.00 0.00 63.50 62.85 2fwu n PRO 510 Cb 0.53 -1.49 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 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 -2.46 -0.03 -0.04 0.52 1.01 -1.26 0.15 120.40 118.30 2fwu s VAL 511 Ca 0.28 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2fwu s VAL 511 Cb 0.20 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.37 2fwu s VAL 511 CO 0.48 0.04 -0.06 0.28 0.00 0.00 0.00 175.10 175.84 2fwu s THR 512 N 0.66 0.58 -0.26 3.92 -1.32 -0.47 -4.83 115.64 113.91 2fwu s THR 512 Ca -0.05 -0.19 -0.11 0.00 -1.21 0.00 0.00 61.69 60.14 2fwu s THR 512 Cb -0.07 -0.57 -0.05 0.00 -1.51 0.00 0.00 72.50 70.31 2fwu s THR 512 CO -0.03 0.22 0.17 -1.00 -2.21 0.00 0.00 174.62 171.77 2fwu s HIS 513 N 0.64 3.24 0.22 9.09 3.76 -1.26 -1.36 115.29 129.62 2fwu s HIS 513 Ca -0.09 0.11 0.10 0.00 -0.15 0.00 0.00 55.06 55.03 2fwu s HIS 513 Cb -0.12 -2.33 -0.04 0.00 1.11 0.00 0.00 32.58 31.19 2fwu s HIS 513 CO 0.00 -0.10 -0.09 0.14 -0.85 0.00 0.00 174.74 173.84 2fwu s VAL 514 N 1.52 3.13 0.04 -0.90 -7.23 -0.43 -4.83 120.40 111.70 2fwu s VAL 514 Ca 0.07 -1.84 -0.27 0.00 -1.81 0.00 0.00 61.98 58.13 2fwu s VAL 514 Cb -0.15 -2.59 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 2fwu s VAL 514 CO 0.08 -0.22 0.85 -0.55 -0.31 0.00 0.00 175.10 174.95 2fwu s SER 515 N -3.14 7.29 0.00 4.85 0.15 -1.26 -1.69 113.70 119.89 2fwu s SER 515 Ca 0.27 1.54 0.12 0.00 0.70 0.00 0.00 55.95 58.59 2fwu s SER 515 Cb -0.08 -2.51 0.58 0.00 -1.71 0.00 0.00 66.02 62.31 2fwu s SER 515 CO 0.16 -0.07 1.34 1.21 1.20 0.00 0.00 173.24 177.08 2fwu n GLU 516 N 3.13 0.10 -0.26 5.44 2.13 0.95 -1.51 120.64 130.63 2fwu n GLU 516 Ca 0.01 0.22 0.10 0.00 0.66 0.00 0.00 57.16 58.15 2fwu n GLU 516 Cb 0.50 -1.50 0.24 0.00 0.27 0.00 0.00 31.44 30.95 2fwu n GLU 516 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2fwu n SER 517 N -1.38 3.49 -4.83 4.31 3.41 -1.26 -4.84 113.62 112.52 2fwu n SER 517 Ca 0.05 -1.97 -0.33 0.00 -0.26 0.00 0.00 58.87 56.36 2fwu n SER 517 Cb 0.12 -0.34 -0.05 0.00 -0.26 0.00 0.00 64.21 63.67 2fwu n SER 517 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2fwu s ILE 518 N -1.14 4.47 -0.12 -1.33 2.07 -0.57 -5.01 121.20 119.57 2fwu s ILE 518 Ca 0.39 1.35 -0.09 0.00 -1.41 0.00 0.00 60.65 60.88 2fwu s ILE 518 Cb 0.21 -3.65 -0.03 0.00 0.13 0.00 0.00 42.46 39.12 2fwu s ILE 518 CO 0.28 -0.48 -0.17 0.61 -1.91 0.00 0.00 174.94 173.27 2fwu n GLY 519 N -1.06 -0.86 3.18 1.50 0.00 -1.26 -4.31 105.19 102.38 2fwu n GLY 519 Ca 0.07 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.12 1.93 -0.07 -0.61 -1.09 -1.26 -1.80 121.20 116.18 2fwu s ILE 520 Ca -0.14 -0.93 -0.01 0.00 -2.23 0.00 0.00 60.65 57.34 2fwu s ILE 520 Cb 0.02 -1.69 -0.03 0.00 -1.58 0.00 0.00 42.46 39.17 2fwu s ILE 520 CO 0.21 0.53 -0.02 0.00 -1.23 0.00 0.00 174.94 174.43 2fwu s MET 521 N 0.54 2.89 -0.24 2.79 0.23 -0.66 -4.94 119.30 119.91 2fwu s MET 521 Ca -0.15 -0.47 0.02 0.00 -1.03 0.00 0.00 55.69 54.06 2fwu s MET 521 Cb -0.17 -2.72 0.05 0.00 -1.53 0.00 0.00 34.83 30.46 2fwu s MET 521 CO 0.05 0.68 -0.13 -1.21 -2.03 0.00 0.00 175.02 172.38 2fwu s GLU 522 N -0.97 2.48 -0.18 3.16 2.02 -1.25 -1.60 118.70 122.36 2fwu s GLU 522 Ca 0.14 -1.19 -0.17 0.00 0.02 0.00 0.00 54.97 53.77 2fwu s GLU 522 Cb -0.11 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 2fwu s GLU 522 CO 0.03 -0.46 0.45 0.08 0.02 0.00 0.00 175.26 175.38 2fwu s VAL 523 N 1.17 5.18 0.15 2.63 1.01 -0.51 -4.84 120.40 125.19 2fwu s VAL 523 Ca -0.05 0.83 -0.19 0.00 0.00 0.00 0.00 61.98 62.57 2fwu s VAL 523 Cb -0.18 -3.78 -0.07 0.00 0.00 0.00 0.00 36.38 32.35 2fwu s VAL 523 CO -0.07 0.26 0.65 -0.54 0.00 0.00 0.00 175.10 175.40 2fwu s LYS 524 N 1.18 4.23 -0.08 2.72 -0.14 -1.25 -1.45 119.74 124.95 2fwu s LYS 524 Ca 0.22 0.79 0.05 0.00 -1.36 0.00 0.00 55.97 55.68 2fwu s LYS 524 Cb -0.15 -3.05 -0.01 0.00 -1.68 0.00 0.00 37.83 32.94 2fwu s LYS 524 CO 0.09 0.51 -0.25 0.08 -0.76 0.00 0.00 175.35 175.02 2fwu s VAL 525 N -1.33 2.06 0.28 3.17 1.01 -0.74 -4.47 120.40 120.37 2fwu s VAL 525 Ca 0.37 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 61.01 2fwu s VAL 525 Cb -0.18 -1.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.35 2fwu s VAL 525 CO 0.21 0.57 1.18 -0.76 0.00 0.00 0.00 175.10 176.29 2fwu s LEU 526 N 0.07 4.50 -0.05 3.92 2.01 -0.09 -3.44 118.68 125.60 2fwu s LEU 526 Ca -0.11 2.39 -0.30 0.00 0.01 0.00 0.00 54.13 56.12 2fwu s LEU 526 Cb -0.16 -3.63 -0.02 0.00 0.01 0.00 0.00 46.19 42.39 2fwu s LEU 526 CO 0.06 -0.30 1.02 -0.60 1.01 0.00 0.00 176.35 177.54 2fwu s ARG 527 N -1.30 4.47 0.55 1.70 6.06 -1.26 -3.99 118.95 125.18 2fwu s ARG 527 Ca 0.47 1.44 -0.21 0.00 -2.50 0.00 0.00 55.73 54.93 2fwu s ARG 527 Cb -0.34 -3.50 -0.05 0.00 0.06 0.00 0.00 34.95 31.12 2fwu s ARG 527 CO 0.44 -0.22 1.35 -0.08 -2.50 0.00 0.00 175.30 174.29 2fwu s THR 528 N 1.59 2.08 0.35 4.11 -1.32 -1.12 -4.92 115.64 116.41 2fwu s THR 528 Ca 0.51 0.06 0.03 0.00 -1.21 0.00 0.00 61.69 61.07 2fwu s THR 528 Cb -0.20 -3.03 0.22 0.00 -1.51 0.00 0.00 72.50 67.98 2fwu s THR 528 CO 0.23 -0.00 1.96 -1.28 -2.21 0.00 0.00 174.62 173.31 2fwu h SER 529 N 1.39 0.63 -3.84 8.08 0.87 -1.93 -3.38 113.55 115.37 2fwu h SER 529 Ca -0.51 -0.06 -0.66 0.00 -1.23 0.00 0.00 61.79 59.33 2fwu h SER 529 Cb 1.30 -0.16 -0.37 0.00 -0.44 0.00 0.00 62.40 62.73 2fwu h SER 529 CO 0.57 0.54 -0.80 -0.83 -0.53 0.00 0.00 176.83 175.78 2fwu s GLY 530 N -3.63 1.62 -0.21 5.77 0.00 -1.26 -5.06 107.32 104.56 2fwu s GLY 530 Ca -0.09 -1.73 0.00 0.00 0.00 0.00 0.00 44.72 42.90 2fwu s GLY 530 CO 0.76 0.64 -0.05 0.00 0.00 0.00 0.00 173.10 174.45 2fwu s ALA 531 N 1.13 1.75 -0.33 3.20 0.00 -1.26 -4.31 121.76 121.94 2fwu s ALA 531 Ca -0.09 -1.12 0.03 0.00 0.00 0.00 0.00 51.96 50.78 2fwu s ALA 531 Cb -0.20 -1.30 0.09 0.00 0.00 0.00 0.00 23.12 21.72 2fwu s ALA 531 CO -0.05 -1.01 0.03 1.03 0.00 0.00 0.00 175.76 175.76 2fwu s ARG 532 N 1.50 1.74 0.85 0.00 1.81 -1.26 -4.46 118.95 119.13 2fwu s ARG 532 Ca -0.03 -1.73 0.00 0.00 -1.72 0.00 0.00 55.73 52.25 2fwu s ARG 532 Cb -0.17 -3.18 0.00 0.00 -0.45 0.00 0.00 34.95 31.15 2fwu s ARG 532 CO -0.07 -0.86 0.00 0.41 -0.68 0.00 0.00 175.30 174.10 2fwu n GLY 533 N 4.34 -0.75 3.57 -3.53 0.00 -1.26 -4.83 105.19 102.73 2fwu n GLY 533 Ca -0.01 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 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 5.49 -0.05 1.61 3.04 -1.26 -0.81 114.94 118.97 2fwu s ASN 534 Ca 0.00 -0.02 0.06 0.00 0.04 0.00 0.00 52.86 52.94 2fwu s ASN 534 Cb 0.00 -1.96 -0.01 0.00 -1.54 0.00 0.00 41.25 37.74 2fwu s ASN 534 CO 0.00 0.09 -0.24 -0.69 -3.04 0.00 0.00 177.10 173.23 2fwu s VAL 535 N 0.86 1.93 -0.20 -5.21 1.01 0.16 0.21 120.40 119.16 2fwu s VAL 535 Ca 0.04 -1.01 -0.09 0.00 0.00 0.00 0.00 61.98 60.92 2fwu s VAL 535 Cb -0.14 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.57 2fwu s VAL 535 CO 0.02 0.54 0.10 -0.63 0.00 0.00 0.00 175.10 175.14 2fwu s ILE 536 N -0.23 5.13 -0.28 2.22 -1.09 -0.09 -0.76 121.20 126.10 2fwu s ILE 536 Ca -0.01 0.09 0.02 0.00 -2.23 0.00 0.00 60.65 58.52 2fwu s ILE 536 Cb -0.12 -3.33 0.06 0.00 -1.58 0.00 0.00 42.46 37.48 2fwu s ILE 536 CO 0.02 0.44 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.41 2fwu s VAL 537 N 0.46 2.36 0.36 2.92 1.01 -0.11 -1.58 120.40 125.81 2fwu s VAL 537 Ca 0.06 -1.67 -0.26 0.00 0.00 0.00 0.00 61.98 60.11 2fwu s VAL 537 Cb -0.12 -2.42 -0.09 0.00 0.00 0.00 0.00 36.38 33.75 2fwu s VAL 537 CO -0.00 -0.11 1.13 -2.16 0.00 0.00 0.00 175.10 173.96 2fwu s PRO 538 N 1.11 4.26 0.05 2.72 0.04 -1.26 0.23 135.00 142.16 2fwu s PRO 538 Ca -0.06 1.78 -0.16 0.00 0.04 0.00 0.00 61.00 62.60 2fwu s PRO 538 Cb -0.20 -2.82 0.03 0.00 0.04 0.00 0.00 34.50 31.55 2fwu s PRO 538 CO -0.05 -0.12 0.37 1.52 0.04 0.00 0.00 177.00 178.77 2fwu s TYR 539 N -1.38 -0.20 0.05 0.56 1.13 0.45 0.22 117.35 118.18 2fwu s TYR 539 Ca 0.53 0.09 -0.18 0.00 -1.41 0.00 0.00 57.07 56.10 2fwu s TYR 539 Cb -0.30 0.18 0.04 0.00 -1.10 0.00 0.00 41.96 40.78 2fwu s TYR 539 CO 0.38 -0.57 0.42 -1.59 -2.51 0.00 0.00 175.55 171.68 2fwu s LYS 540 N -2.68 0.93 -0.43 -3.49 -2.85 -1.04 -1.05 119.74 109.13 2fwu s LYS 540 Ca -0.04 -0.37 -0.19 0.00 -1.00 0.00 0.00 55.97 54.37 2fwu s LYS 540 Cb -0.00 0.42 0.02 0.00 -2.06 0.00 0.00 37.83 36.20 2fwu s LYS 540 CO -0.04 -0.32 0.56 0.95 0.10 0.00 0.00 175.35 176.60 2fwu s THR 541 N -2.52 4.93 -0.23 3.79 -4.23 -1.05 -2.67 115.64 113.67 2fwu s THR 541 Ca -0.05 -0.04 -0.29 0.00 -1.18 0.00 0.00 61.69 60.12 2fwu s THR 541 Cb -0.01 -4.13 0.00 0.00 1.34 0.00 0.00 72.50 69.70 2fwu s THR 541 CO -0.03 -0.51 1.17 -0.63 -0.54 0.00 0.00 174.62 174.08 2fwu s ILE 542 N 2.55 4.43 0.36 2.99 1.09 0.16 -4.82 121.20 127.96 2fwu s ILE 542 Ca 0.19 1.70 0.09 0.00 -1.10 0.00 0.00 60.65 61.53 2fwu s ILE 542 Cb -0.15 -4.18 0.32 0.00 -1.06 0.00 0.00 42.46 37.39 2fwu s ILE 542 CO 0.17 -0.24 1.89 -0.33 -0.10 0.00 0.00 174.94 176.33 2fwu h GLU 543 N 8.08 0.65 0.00 2.79 5.08 -1.87 -0.79 114.58 128.52 2fwu h GLU 543 Ca -0.23 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2fwu h GLU 543 Cb 1.08 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2fwu h GLU 543 CO 0.99 0.43 0.00 0.41 -1.00 0.00 0.00 179.01 179.84 2fwu n GLY 544 N -1.45 1.20 0.00 -3.84 0.00 -1.26 -0.96 105.19 98.88 2fwu n GLY 544 Ca 0.16 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 -2.91 2.61 5.66 -1.12 -5.03 114.28 113.49 2fwu n THR 545 Ca 0.00 -0.43 -0.01 0.00 -3.05 0.00 0.00 64.05 60.57 2fwu n THR 545 Cb 0.00 1.14 0.00 0.00 -1.55 0.00 0.00 70.33 69.93 2fwu n THR 545 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2fwu n ALA 546 N -0.02 0.03 -3.71 1.79 0.00 -0.13 -4.91 120.51 113.56 2fwu n ALA 546 Ca 0.00 -0.06 -0.17 0.00 0.00 0.00 0.00 53.44 53.22 2fwu n ALA 546 Cb 0.04 0.01 -0.16 0.00 0.00 0.00 0.00 19.45 19.34 2fwu n ALA 546 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2fwu s ARG 547 N -2.12 0.25 0.00 0.00 3.00 -1.26 -4.82 118.95 114.00 2fwu s ARG 547 Ca 0.02 0.09 0.00 0.00 -1.00 0.00 0.00 55.73 54.83 2fwu s ARG 547 Cb -0.00 -0.44 0.00 0.00 0.00 0.00 0.00 34.95 34.51 2fwu s ARG 547 CO 0.01 -0.13 0.00 0.41 0.00 0.00 0.00 175.30 175.59 2fwu n GLY 548 N 4.11 0.24 2.61 8.12 0.00 -1.26 -1.07 105.19 117.94 2fwu n GLY 548 Ca -0.27 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.30 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 4.22 0.98 2.08 -0.02 0.00 -1.23 -1.29 105.19 109.93 2fwu n GLY 549 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 46.02 45.86 2fwu n GLY 549 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fwu n GLY 550 N -0.50 0.56 0.00 -0.02 0.00 -0.80 -4.96 105.19 99.47 2fwu n GLY 550 Ca -0.09 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.87 0.00 -0.12 1.61 -0.58 -0.41 -4.74 120.64 113.52 2fwu n GLU 551 Ca -0.02 0.37 -0.17 0.00 -0.42 0.00 0.00 57.16 56.92 2fwu n GLU 551 Cb 0.08 -0.86 -0.12 0.00 -0.57 0.00 0.00 31.44 29.97 2fwu n GLU 551 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2fwu n ASP 552 N -2.02 1.88 -4.05 1.62 -0.08 -0.24 -4.63 116.55 109.02 2fwu n ASP 552 Ca 0.00 -0.12 -0.10 0.00 -1.51 0.00 0.00 54.79 53.06 2fwu n ASP 552 Cb 0.00 -0.27 -0.08 0.00 2.34 0.00 0.00 41.12 43.10 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 -2.50 0.63 -0.43 -0.67 -0.71 -0.51 -1.36 117.98 112.42 2fwu s PHE 553 Ca -0.32 -0.98 -0.16 0.00 -1.04 0.00 0.00 56.93 54.44 2fwu s PHE 553 Cb 0.08 -0.23 0.03 0.00 -1.21 0.00 0.00 43.02 41.70 2fwu s PHE 553 CO 0.60 -0.67 0.38 -2.00 -1.34 0.00 0.00 175.22 172.19 2fwu s GLU 554 N -4.02 3.02 -0.12 1.99 -6.30 0.54 -1.90 118.70 111.91 2fwu s GLU 554 Ca 0.22 -0.97 -0.30 0.00 -2.50 0.00 0.00 54.97 51.43 2fwu s GLU 554 Cb 0.05 -4.00 -0.02 0.00 0.00 0.00 0.00 34.13 30.15 2fwu s GLU 554 CO 0.03 -0.85 1.21 0.16 0.02 0.00 0.00 175.26 175.83 2fwu s ASP 555 N 1.90 7.01 -0.30 -1.70 -4.77 -1.26 -4.21 116.67 113.34 2fwu s ASP 555 Ca 0.08 1.72 -0.05 0.00 -3.30 0.00 0.00 52.55 51.00 2fwu s ASP 555 Cb -0.19 -2.55 0.03 0.00 -1.09 0.00 0.00 42.92 39.12 2fwu s ASP 555 CO 0.11 -0.66 0.05 0.28 0.70 0.00 0.00 175.17 175.64 2fwu s THR 556 N 2.83 3.53 -0.17 2.11 -1.32 -1.26 -4.83 115.64 116.53 2fwu s THR 556 Ca 0.54 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.02 2fwu s THR 556 Cb -0.22 -2.90 0.04 0.00 -1.51 0.00 0.00 72.50 67.90 2fwu s THR 556 CO 0.18 -0.01 -0.10 0.00 -2.21 0.00 0.00 174.62 172.48 2fwu n GLY 558 N 4.78 1.89 2.89 0.00 0.00 -0.22 -5.00 105.19 109.54 2fwu n GLY 558 Ca -0.14 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.11 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 1.37 1.01 0.11 1.61 2.02 -1.26 -0.41 118.70 123.15 2fwu s GLU 559 Ca 0.00 -0.13 -0.27 0.00 0.02 0.00 0.00 54.97 54.59 2fwu s GLU 559 Cb 0.00 -1.05 -0.06 0.00 0.10 0.00 0.00 34.13 33.12 2fwu s GLU 559 CO 0.00 -0.13 0.86 -0.51 0.02 0.00 0.00 175.26 175.49 2fwu s LEU 560 N 1.19 4.52 -0.52 1.80 1.43 0.14 -4.86 118.68 122.37 2fwu s LEU 560 Ca -0.06 1.66 -0.17 0.00 -1.03 0.00 0.00 54.13 54.53 2fwu s LEU 560 Cb -0.14 -3.41 0.10 0.00 0.03 0.00 0.00 46.19 42.77 2fwu s LEU 560 CO -0.02 0.04 0.52 -0.70 0.23 0.00 0.00 176.35 176.43 2fwu s GLU 561 N -0.38 3.01 0.07 1.70 2.12 -1.26 -0.94 118.70 123.02 2fwu s GLU 561 Ca 0.41 -1.42 0.05 0.00 0.36 0.00 0.00 54.97 54.37 2fwu s GLU 561 Cb -0.23 -4.22 -0.04 0.00 0.26 0.00 0.00 34.13 29.91 2fwu s GLU 561 CO 0.27 -1.26 -0.07 0.12 -0.54 0.00 0.00 175.26 173.78 2fwu s PHE 562 N 1.94 2.84 0.33 5.30 5.36 0.06 -4.98 117.98 128.84 2fwu s PHE 562 Ca 0.06 -0.09 0.05 0.00 -0.96 0.00 0.00 56.93 56.00 2fwu s PHE 562 Cb -0.26 -1.52 -0.02 0.00 -0.34 0.00 0.00 43.02 40.88 2fwu s PHE 562 CO 0.06 0.42 0.32 -0.65 -1.46 0.00 0.00 175.22 173.90 2fwu s GLN 563 N -1.96 1.79 0.11 10.12 -0.21 -1.26 0.37 119.66 128.62 2fwu s GLN 563 Ca 0.21 -1.97 -0.04 0.00 0.02 0.00 0.00 55.36 53.58 2fwu s GLN 563 Cb -0.11 0.35 -0.17 0.00 1.00 0.00 0.00 33.01 34.08 2fwu s GLN 563 CO 0.13 -0.68 1.23 -2.95 -2.12 0.00 0.00 175.29 170.90 2fwu h ASN 564 N 2.13 0.49 -0.08 5.90 -1.07 -1.19 -3.09 115.58 118.67 2fwu h ASN 564 Ca -0.26 -0.45 0.00 0.00 0.07 0.00 0.00 56.30 55.67 2fwu h ASN 564 Cb 1.23 -0.15 0.00 0.00 -2.07 0.00 0.00 38.32 37.33 2fwu h ASN 564 CO 0.37 1.28 0.00 0.47 0.07 0.00 0.00 177.43 179.62 2fwu n ASP 565 N -3.66 0.72 -4.33 6.14 8.00 -1.26 -4.74 116.55 117.42 2fwu n ASP 565 Ca -0.08 -1.61 -0.28 0.00 0.71 0.00 0.00 54.79 53.54 2fwu n ASP 565 Cb 0.92 -0.05 -0.14 0.00 -0.02 0.00 0.00 41.12 41.83 2fwu n ASP 565 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2fwu s GLU 566 N -1.90 1.54 0.08 -1.24 2.56 -1.17 -5.13 118.70 113.44 2fwu s GLU 566 Ca 0.27 -1.14 0.02 0.00 0.00 0.00 0.00 54.97 54.12 2fwu s GLU 566 Cb 0.13 -1.79 -0.04 0.00 2.00 0.00 0.00 34.13 34.44 2fwu s GLU 566 CO 0.21 0.45 -0.08 0.96 -0.56 0.00 0.00 175.26 176.24 2fwu s ILE 567 N -0.91 0.70 0.27 -3.70 -4.36 -1.26 -4.42 121.20 107.52 2fwu s ILE 567 Ca 0.11 -1.61 0.00 0.00 -0.26 0.00 0.00 60.65 58.89 2fwu s ILE 567 Cb -0.10 -1.28 0.00 0.00 1.25 0.00 0.00 42.46 42.33 2fwu s ILE 567 CO 0.03 -0.66 0.00 0.55 0.24 0.00 0.00 174.94 175.11 2fwu n VAL 568 N 0.55 0.00 -3.54 8.37 3.14 -1.26 -5.02 118.33 120.57 2fwu n VAL 568 Ca -0.16 0.27 -0.18 0.00 -2.96 0.00 0.00 64.34 61.31 2fwu n VAL 568 Cb 0.58 -0.55 -0.06 0.00 -1.06 0.00 0.00 33.84 32.75 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 -3.15 1.02 -0.12 1.45 2.47 -1.22 -4.91 119.74 115.28 2fwu s LYS 569 Ca 0.00 0.26 0.01 0.00 -1.56 0.00 0.00 55.97 54.68 2fwu s LYS 569 Cb 0.00 0.48 0.02 0.00 -1.46 0.00 0.00 37.83 36.87 2fwu s LYS 569 CO 0.00 -0.31 -0.16 0.95 0.16 0.00 0.00 175.35 175.99 2fwu s THR 570 N -1.13 1.59 -0.37 3.43 -4.23 -1.24 -1.80 115.64 111.89 2fwu s THR 570 Ca -0.11 -0.68 -0.24 0.00 -1.18 0.00 0.00 61.69 59.48 2fwu s THR 570 Cb -0.01 -1.45 0.01 0.00 1.34 0.00 0.00 72.50 72.39 2fwu s THR 570 CO 0.09 0.46 0.85 -0.63 -0.54 0.00 0.00 174.62 174.85 2fwu s ILE 571 N 1.11 4.66 -0.40 2.99 1.09 -0.53 -4.81 121.20 125.31 2fwu s ILE 571 Ca -0.03 1.02 -0.13 0.00 -1.10 0.00 0.00 60.65 60.41 2fwu s ILE 571 Cb -0.14 -4.27 0.03 0.00 -1.06 0.00 0.00 42.46 37.02 2fwu s ILE 571 CO -0.04 -0.49 0.26 -0.44 -0.10 0.00 0.00 174.94 174.13 2fwu s SER 572 N 1.86 5.91 -0.09 3.58 0.01 -1.25 -1.42 113.70 122.30 2fwu s SER 572 Ca 0.35 -1.03 0.01 0.00 1.31 0.00 0.00 55.95 56.58 2fwu s SER 572 Cb -0.13 -2.09 -0.03 0.00 0.21 0.00 0.00 66.02 63.99 2fwu s SER 572 CO 0.18 -0.45 -0.09 -0.69 0.41 0.00 0.00 173.24 172.60 2fwu s VAL 573 N 1.60 3.50 -0.22 3.43 1.01 -0.63 -4.92 120.40 124.17 2fwu s VAL 573 Ca 0.03 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 2fwu s VAL 573 Cb -0.20 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 2fwu s VAL 573 CO 0.08 0.57 0.38 -0.75 0.00 0.00 0.00 175.10 175.37 2fwu s LYS 574 N -0.45 4.13 -0.10 2.72 2.47 -1.26 -1.65 119.74 125.60 2fwu s LYS 574 Ca 0.06 0.13 -0.15 0.00 -1.56 0.00 0.00 55.97 54.46 2fwu s LYS 574 Cb -0.12 -3.57 -0.05 0.00 -1.46 0.00 0.00 37.83 32.63 2fwu s LYS 574 CO 0.02 -0.10 0.37 0.08 0.16 0.00 0.00 175.35 175.88 2fwu s VAL 575 N 1.50 5.20 0.27 4.02 1.01 -0.74 -0.34 120.40 131.32 2fwu s VAL 575 Ca 0.17 0.73 0.04 0.00 0.00 0.00 0.00 61.98 62.92 2fwu s VAL 575 Cb -0.15 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2fwu s VAL 575 CO 0.08 0.44 0.41 -0.63 0.00 0.00 0.00 175.10 175.40 2fwu s ILE 576 N -0.02 5.15 -0.29 2.22 -1.09 -0.46 -4.73 121.20 121.97 2fwu s ILE 576 Ca 0.21 -0.86 -0.28 0.00 -2.23 0.00 0.00 60.65 57.49 2fwu s ILE 576 Cb -0.15 -3.84 -0.03 0.00 -1.58 0.00 0.00 42.46 36.87 2fwu s ILE 576 CO 0.08 -0.38 1.98 -0.62 -1.23 0.00 0.00 174.94 174.78 2fwu s ASP 577 N -4.01 5.67 0.11 3.58 2.15 -1.26 -4.77 116.67 118.14 2fwu s ASP 577 Ca 0.36 1.51 -0.34 0.00 0.43 0.00 0.00 52.55 54.52 2fwu s ASP 577 Cb -0.09 -2.52 -0.13 0.00 -0.30 0.00 0.00 42.92 39.88 2fwu s ASP 577 CO 0.31 -1.85 1.67 -0.67 -0.17 0.00 0.00 175.17 174.45 2fwu n ASP 578 N 11.04 3.29 -0.05 -0.34 -0.08 -1.26 -4.91 116.55 124.24 2fwu n ASP 578 Ca 0.26 1.05 -0.05 0.00 -1.51 0.00 0.00 54.79 54.54 2fwu n ASP 578 Cb 0.46 -1.43 -0.08 0.00 2.34 0.00 0.00 41.12 42.41 2fwu n ASP 578 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 2fwu n GLU 579 N 4.25 2.29 0.00 -0.67 0.00 -1.26 -4.97 120.64 120.29 2fwu n GLU 579 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.34 2fwu n GLU 579 Cb 0.30 -1.25 0.00 0.00 0.00 0.00 0.00 31.44 30.49 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 -2.39 0.00 -3.98 3.44 0.00 -1.26 -5.07 120.64 111.38 2fwu n GLU 580 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 57.16 56.91 2fwu n GLU 580 Cb 0.82 -0.31 -0.10 0.00 0.00 0.00 0.00 31.44 31.84 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 -0.77 0.29 -0.36 -1.84 -0.85 -1.26 -5.11 117.35 107.45 2fwu s TYR 581 Ca 0.00 -0.63 -0.06 0.00 -0.52 0.00 0.00 57.07 55.86 2fwu s TYR 581 Cb 0.00 -0.22 0.05 0.00 0.38 0.00 0.00 41.96 42.18 2fwu s TYR 581 CO 0.00 -0.30 0.13 -2.00 -1.52 0.00 0.00 175.55 171.86 2fwu s GLU 582 N -2.43 2.54 0.20 -3.49 2.56 -1.26 -5.02 118.70 111.80 2fwu s GLU 582 Ca -0.07 -1.30 -0.01 0.00 0.00 0.00 0.00 54.97 53.60 2fwu s GLU 582 Cb -0.03 -3.50 -0.04 0.00 2.00 0.00 0.00 34.13 32.56 2fwu s GLU 582 CO -0.04 -0.75 0.11 0.15 -0.56 0.00 0.00 175.26 174.17 2fwu s LYS 583 N 1.37 1.20 -0.71 4.30 -0.14 -1.26 -5.07 119.74 119.42 2fwu s LYS 583 Ca -0.00 -1.63 -0.26 0.00 -1.36 0.00 0.00 55.97 52.72 2fwu s LYS 583 Cb -0.20 0.17 0.00 0.00 -1.68 0.00 0.00 37.83 36.12 2fwu s LYS 583 CO 0.02 -0.36 1.58 1.21 -0.76 0.00 0.00 175.35 177.05 2fwu s ASN 584 N -3.17 5.73 0.04 2.83 3.84 -1.26 -4.96 114.94 117.99 2fwu s ASN 584 Ca 0.37 -0.19 0.02 0.00 0.21 0.00 0.00 52.86 53.27 2fwu s ASN 584 Cb 0.07 -2.55 -0.04 0.00 -0.55 0.00 0.00 41.25 38.19 2fwu s ASN 584 CO 0.11 -2.11 0.03 -1.59 -2.79 0.00 0.00 177.10 170.75 2fwu s LYS 585 N 6.34 2.79 0.01 0.43 0.00 -1.26 -5.05 119.74 122.99 2fwu s LYS 585 Ca 0.52 -0.67 -0.18 0.00 0.00 0.00 0.00 55.97 55.64 2fwu s LYS 585 Cb -0.09 -2.68 0.03 0.00 0.00 0.00 0.00 37.83 35.09 2fwu s LYS 585 CO 0.15 0.59 0.40 -0.08 0.00 0.00 0.00 175.35 176.41 2fwu s THR 586 N -1.22 0.05 0.12 3.79 -1.32 -1.26 -2.49 115.64 113.32 2fwu s THR 586 Ca 0.24 -0.42 0.03 0.00 -1.21 0.00 0.00 61.69 60.33 2fwu s THR 586 Cb -0.12 -0.82 -0.04 0.00 -1.51 0.00 0.00 72.50 70.01 2fwu s THR 586 CO 0.15 -0.23 -0.08 0.72 -2.21 0.00 0.00 174.62 172.97 2fwu s PHE 587 N -1.83 1.07 -0.05 9.09 -0.12 -0.97 -2.78 117.98 122.38 2fwu s PHE 587 Ca -0.09 -0.84 0.05 0.00 -0.05 0.00 0.00 56.93 55.99 2fwu s PHE 587 Cb -0.02 -0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 41.77 2fwu s PHE 587 CO 0.02 -0.04 -0.18 -0.06 -0.05 0.00 0.00 175.22 174.91 2fwu s PHE 588 N -3.49 2.59 -0.23 3.49 0.08 -0.30 -0.57 117.98 119.55 2fwu s PHE 588 Ca 0.14 -0.35 -0.07 0.00 0.12 0.00 0.00 56.93 56.77 2fwu s PHE 588 Cb 0.04 -1.61 -0.03 0.00 -0.57 0.00 0.00 43.02 40.85 2fwu s PHE 588 CO -0.02 0.04 0.06 -1.17 -0.10 0.00 0.00 175.22 174.02 2fwu s LEU 589 N -0.52 3.45 -0.06 -0.37 1.98 0.74 0.36 118.68 124.26 2fwu s LEU 589 Ca 0.07 -0.17 0.02 0.00 -2.89 0.00 0.00 54.13 51.16 2fwu s LEU 589 Cb -0.11 -1.91 0.01 0.00 0.66 0.00 0.00 46.19 44.84 2fwu s LEU 589 CO 0.01 0.01 -0.11 -0.70 -1.89 0.00 0.00 176.35 173.67 2fwu s GLU 590 N 1.33 1.53 0.04 1.98 2.12 -1.09 -1.64 118.70 122.97 2fwu s GLU 590 Ca 0.05 -0.38 0.01 0.00 0.36 0.00 0.00 54.97 55.01 2fwu s GLU 590 Cb -0.15 -1.30 -0.04 0.00 0.26 0.00 0.00 34.13 32.91 2fwu s GLU 590 CO 0.03 0.03 0.11 0.96 -0.54 0.00 0.00 175.26 175.85 2fwu s ILE 591 N 0.62 4.82 0.00 -3.70 -4.36 -1.26 -2.49 121.20 114.82 2fwu s ILE 591 Ca -0.13 -0.51 0.00 0.00 -0.26 0.00 0.00 60.65 59.75 2fwu s ILE 591 Cb -0.15 -3.27 0.00 0.00 1.25 0.00 0.00 42.46 40.29 2fwu s ILE 591 CO 0.03 0.24 0.00 0.61 0.24 0.00 0.00 174.94 176.05 2fwu n GLY 592 N 0.77 1.07 3.70 6.27 0.00 0.13 -4.97 105.19 112.16 2fwu n GLY 592 Ca -0.10 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 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 -1.60 4.43 1.00 1.61 2.56 -1.22 -4.57 118.70 120.92 2fwu s GLU 593 Ca 0.00 1.55 -0.13 0.00 0.00 0.00 0.00 54.97 56.38 2fwu s GLU 593 Cb 0.00 -3.50 0.19 0.00 2.00 0.00 0.00 34.13 32.82 2fwu s GLU 593 CO 0.00 -0.28 1.12 -1.25 -0.56 0.00 0.00 175.26 174.28 2fwu s PRO 594 N 1.68 0.40 0.00 4.30 0.04 -1.26 -4.35 135.00 135.82 2fwu s PRO 594 Ca 0.53 0.33 -0.15 0.00 0.04 0.00 0.00 61.00 61.74 2fwu s PRO 594 Cb -0.23 -1.75 0.02 0.00 0.04 0.00 0.00 34.50 32.59 2fwu s PRO 594 CO 0.23 -2.71 0.33 -0.98 0.04 0.00 0.00 177.00 173.91 2fwu s ARG 595 N -5.15 0.73 0.02 4.56 1.70 -0.62 -4.56 118.95 115.64 2fwu s ARG 595 Ca 0.66 -0.26 -0.29 0.00 -0.47 0.00 0.00 55.73 55.37 2fwu s ARG 595 Cb -0.16 0.32 -0.04 0.00 -0.57 0.00 0.00 34.95 34.50 2fwu s ARG 595 CO 0.56 -0.21 0.93 -1.17 -1.08 0.00 0.00 175.30 174.33 2fwu s LEU 596 N -1.54 4.40 0.41 -1.89 1.98 -1.26 -0.91 118.68 119.87 2fwu s LEU 596 Ca -0.11 1.63 0.16 0.00 -2.89 0.00 0.00 54.13 52.92 2fwu s LEU 596 Cb -0.04 -3.50 0.87 0.00 0.66 0.00 0.00 46.19 44.19 2fwu s LEU 596 CO 0.02 -0.18 1.88 0.58 -1.89 0.00 0.00 176.35 176.77 2fwu h VAL 597 N 4.55 1.10 -3.56 1.68 2.07 -0.59 -3.28 116.25 118.22 2fwu h VAL 597 Ca -0.42 -1.09 -0.73 0.00 0.82 0.00 0.00 66.70 65.28 2fwu h VAL 597 Cb 1.21 1.61 -0.32 0.00 -1.52 0.00 0.00 31.29 32.27 2fwu h VAL 597 CO 0.74 0.30 -0.08 -1.61 0.02 0.00 0.00 177.57 176.94 2fwu s GLU 598 N -4.19 3.22 -1.00 1.57 2.02 -1.26 -4.99 118.70 114.07 2fwu s GLU 598 Ca -0.03 -2.81 -0.20 0.00 0.02 0.00 0.00 54.97 51.95 2fwu s GLU 598 Cb 0.14 -4.07 0.10 0.00 0.10 0.00 0.00 34.13 30.40 2fwu s GLU 598 CO 0.69 -1.24 1.31 -1.64 0.02 0.00 0.00 175.26 174.40 2fwu s MET 599 N -0.52 3.65 -0.21 1.61 -1.94 -1.24 -4.97 119.30 115.67 2fwu s MET 599 Ca 0.22 -1.57 -0.20 0.00 -1.71 0.00 0.00 55.69 52.43 2fwu s MET 599 Cb -0.13 -5.14 -0.03 0.00 2.01 0.00 0.00 34.83 31.55 2fwu s MET 599 CO -0.08 -1.97 0.60 -1.12 -0.01 0.00 0.00 175.02 172.44 2fwu s SER 600 N 4.15 6.62 0.56 3.03 0.01 -1.26 -5.03 113.70 121.78 2fwu s SER 600 Ca 0.40 0.76 -0.17 0.00 1.31 0.00 0.00 55.95 58.24 2fwu s SER 600 Cb -0.02 -2.33 -0.05 0.00 0.21 0.00 0.00 66.02 63.83 2fwu s SER 600 CO -0.08 -0.28 1.05 -1.83 0.41 0.00 0.00 173.24 172.51 2fwu s GLU 601 N 2.00 3.48 -1.21 12.44 -1.05 -1.26 -4.90 118.70 128.19 2fwu s GLU 601 Ca 0.27 1.23 -0.20 0.00 -0.15 0.00 0.00 54.97 56.11 2fwu s GLU 601 Cb -0.16 -2.05 0.01 0.00 -0.44 0.00 0.00 34.13 31.49 2fwu s GLU 601 CO 0.10 -0.68 1.78 0.21 0.95 0.00 0.00 175.26 177.62 2fwu s LYS 602 N -3.87 3.40 0.06 -4.83 2.36 -1.26 -4.92 119.74 110.68 2fwu s LYS 602 Ca 0.64 -1.55 -0.30 0.00 -2.55 0.00 0.00 55.97 52.21 2fwu s LYS 602 Cb -0.16 -5.40 -0.05 0.00 -1.05 0.00 0.00 37.83 31.17 2fwu s LYS 602 CO 0.32 -2.86 1.13 0.21 1.55 0.00 0.00 175.35 175.70 2fwu s LYS 603 N 5.17 4.49 0.00 4.03 2.20 -1.26 -3.03 119.74 131.33 2fwu s LYS 603 Ca 0.59 1.67 0.00 0.00 -0.36 0.00 0.00 55.97 57.87 2fwu s LYS 603 Cb 0.01 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 2fwu s LYS 603 CO 0.07 -0.16 0.00 0.41 -0.36 0.00 0.00 175.35 175.32 2fwu n GLY 604 N 2.98 0.94 0.00 5.54 0.00 -1.26 -5.04 105.19 108.35 2fwu n GLY 604 Ca 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.08 5.60 0.09 -0.02 0.00 -1.17 -5.05 105.19 102.56 2fwu n GLY 605 Ca 0.00 -0.97 -0.06 0.00 0.00 0.00 0.00 46.02 44.98 2fwu n GLY 605 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2fwu n PHE 606 N 0.00 0.78 -3.03 1.61 7.35 -1.26 -4.91 117.46 117.99 2fwu n PHE 606 Ca 0.00 0.27 -0.40 0.00 -0.76 0.00 0.00 57.45 56.57 2fwu n PHE 606 Cb 0.00 -1.11 -0.05 0.00 0.35 0.00 0.00 39.48 38.68 2fwu n PHE 606 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2fwu s THR 607 N -2.68 5.03 -0.05 -2.13 -4.23 -1.26 -5.03 115.64 105.29 2fwu s THR 607 Ca -0.05 1.48 0.03 0.00 -1.18 0.00 0.00 61.69 61.96 2fwu s THR 607 Cb 0.08 -4.05 0.01 0.00 1.34 0.00 0.00 72.50 69.87 2fwu s THR 607 CO 0.83 0.25 -0.13 -0.63 -0.54 0.00 0.00 174.62 174.39 2fwu s ILE 608 N 0.79 1.17 -0.39 2.99 1.01 -1.26 -4.42 121.20 121.08 2fwu s ILE 608 Ca 0.38 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 2fwu s ILE 608 Cb -0.18 -1.05 0.00 0.00 0.01 0.00 0.00 42.46 41.25 2fwu s ILE 608 CO 0.19 0.36 0.41 0.41 0.00 0.00 0.00 174.94 176.30 2fwu n THR 609 N 3.55 -6.89 -3.40 2.92 -1.04 -1.26 -4.97 114.28 103.19 2fwu n THR 609 Ca -0.21 0.07 -0.45 0.00 -2.04 0.00 0.00 64.05 61.43 2fwu n THR 609 Cb 0.52 -5.72 -0.05 0.00 -1.82 0.00 0.00 70.33 63.26 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 -2.68 3.10 0.00 -2.82 2.02 -1.26 -4.99 118.70 112.07 2fwu s GLU 610 Ca 0.05 -2.09 0.00 0.00 0.02 0.00 0.00 54.97 52.95 2fwu s GLU 610 Cb -0.01 -4.23 0.00 0.00 0.10 0.00 0.00 34.13 29.98 2fwu s GLU 610 CO 0.46 -1.28 0.00 0.39 0.02 0.00 0.00 175.26 174.85 2fwu n GLU 611 N 4.53 2.61 -2.27 1.61 1.02 -1.26 -4.69 120.64 122.19 2fwu n GLU 611 Ca -0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 2fwu n GLU 611 Cb 0.43 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.87 2fwu n GLU 611 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2fwu n TYR 612 N 0.00 -0.75 -3.47 -0.32 4.01 -1.26 -5.04 117.16 110.33 2fwu n TYR 612 Ca 0.00 0.29 -0.37 0.00 -0.16 0.00 0.00 57.90 57.66 2fwu n TYR 612 Cb 0.00 -3.01 -0.07 0.00 -0.31 0.00 0.00 39.34 35.95 2fwu n TYR 612 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2fwu s ASP 613 N -3.29 6.52 0.00 7.72 2.15 -1.26 -5.02 116.67 123.49 2fwu s ASP 613 Ca 0.07 0.61 0.00 0.00 0.43 0.00 0.00 52.55 53.67 2fwu s ASP 613 Cb -0.01 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 2fwu s ASP 613 CO 0.24 0.08 0.00 -0.67 -0.17 0.00 0.00 175.17 174.64 2fwu n ASP 614 N 3.55 0.00 -4.55 -0.34 -0.08 -1.26 -5.07 116.55 108.80 2fwu n ASP 614 Ca -0.10 -0.61 -0.40 0.00 -1.51 0.00 0.00 54.79 52.17 2fwu n ASP 614 Cb 0.52 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.95 2fwu n ASP 614 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2fwu s LYS 615 N -0.82 3.21 0.34 -0.67 3.01 -1.26 -4.92 119.74 118.62 2fwu s LYS 615 Ca 0.00 -0.39 -0.19 0.00 -1.01 0.00 0.00 55.97 54.39 2fwu s LYS 615 Cb 0.00 -4.55 -0.10 0.00 -1.01 0.00 0.00 37.83 32.17 2fwu s LYS 615 CO 0.00 -2.28 0.83 -0.65 0.51 0.00 0.00 175.35 173.76 2fwu s GLN 616 N 5.74 4.18 0.87 1.68 -1.52 -1.26 -5.05 119.66 124.30 2fwu s GLN 616 Ca 0.43 0.93 -0.13 0.00 -1.95 0.00 0.00 55.36 54.64 2fwu s GLN 616 Cb -0.06 -2.45 0.14 0.00 -0.22 0.00 0.00 33.01 30.41 2fwu s GLN 616 CO 0.08 0.14 1.23 -1.25 -0.25 0.00 0.00 175.29 175.24 2fwu s PRO 617 N -2.80 1.33 -0.58 2.91 0.04 -1.26 -3.38 135.00 131.25 2fwu s PRO 617 Ca 0.55 -0.22 -0.27 0.00 0.04 0.00 0.00 61.00 61.10 2fwu s PRO 617 Cb -0.12 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 2fwu s PRO 617 CO 0.17 -1.96 1.89 -0.51 0.04 0.00 0.00 177.00 176.63 2fwu s LEU 618 N -5.69 3.31 0.00 -3.56 2.01 -1.26 -4.65 118.68 108.84 2fwu s LEU 618 Ca 0.68 0.45 0.00 0.00 0.01 0.00 0.00 54.13 55.27 2fwu s LEU 618 Cb -0.07 -2.60 0.00 0.00 0.01 0.00 0.00 46.19 43.52 2fwu s LEU 618 CO 0.50 -2.36 0.00 0.35 1.01 0.00 0.00 176.35 175.86 2fwu n THR 619 N 7.27 0.00 -3.65 5.49 -2.24 -1.26 -3.88 114.28 116.01 2fwu n THR 619 Ca 0.22 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.97 2fwu n THR 619 Cb 0.52 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 2fwu n THR 619 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2fwu s SER 620 N -1.06 -0.97 0.00 3.42 0.15 -1.26 -4.56 113.70 109.41 2fwu s SER 620 Ca 0.00 1.46 0.00 0.00 0.70 0.00 0.00 55.95 58.11 2fwu s SER 620 Cb 0.00 2.06 0.00 0.00 -1.71 0.00 0.00 66.02 66.37 2fwu s SER 620 CO 0.00 -0.22 0.60 0.29 1.20 0.00 0.00 173.24 175.11 2fwu n LYS 621 N 5.35 0.00 0.01 5.44 5.02 -1.25 -4.30 118.16 128.43 2fwu n LYS 621 Ca -0.12 0.38 0.01 0.00 -2.02 0.00 0.00 58.31 56.56 2fwu n LYS 621 Cb 0.50 -1.22 -0.11 0.00 -0.02 0.00 0.00 35.03 34.18 2fwu n LYS 621 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2fwu n GLU 622 N -1.64 0.64 -2.83 1.97 1.02 -1.26 -4.91 120.64 113.63 2fwu n GLU 622 Ca 0.00 0.09 -0.35 0.00 -0.02 0.00 0.00 57.16 56.88 2fwu n GLU 622 Cb 0.00 -1.70 -0.07 0.00 -0.02 0.00 0.00 31.44 29.65 2fwu n GLU 622 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2fwu s GLU 623 N -3.00 4.37 -0.13 3.49 -6.30 -1.26 -5.00 118.70 110.86 2fwu s GLU 623 Ca -0.05 1.18 0.14 0.00 -2.50 0.00 0.00 54.97 53.74 2fwu s GLU 623 Cb 0.09 -2.49 -0.20 0.00 0.00 0.00 0.00 34.13 31.54 2fwu s GLU 623 CO 0.83 0.13 0.09 -0.85 0.02 0.00 0.00 175.26 175.48 2fwu n GLU 624 N -0.06 1.38 0.08 4.30 0.28 -1.26 -4.50 120.64 120.85 2fwu n GLU 624 Ca 0.04 -0.03 -0.04 0.00 -0.16 0.00 0.00 57.16 56.97 2fwu n GLU 624 Cb 0.52 -1.39 0.15 0.00 1.43 0.00 0.00 31.44 32.15 2fwu n GLU 624 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2fwu h GLU 625 N 0.00 0.27 0.00 3.44 5.08 -1.95 -0.44 114.58 120.98 2fwu h GLU 625 Ca -0.36 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 57.78 2fwu h GLU 625 Cb 1.79 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.05 2fwu h GLU 625 CO 0.02 0.73 -0.28 0.00 -1.00 0.00 0.00 179.01 178.48 2fwu h ARG 626 N 0.21 0.00 -0.22 2.33 2.47 -1.88 -0.17 114.38 117.13 2fwu h ARG 626 Ca 0.01 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.67 2fwu h ARG 626 Cb 0.99 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.31 2fwu h ARG 626 CO 0.08 0.28 -0.07 0.00 0.56 0.00 0.00 179.97 180.83 2fwu h ARG 627 N 0.00 0.44 -0.66 0.04 3.08 -1.36 0.28 114.38 116.21 2fwu h ARG 627 Ca -0.00 -0.18 0.05 0.00 0.07 0.00 0.00 59.98 59.92 2fwu h ARG 627 Cb 0.60 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.58 2fwu h ARG 627 CO 0.04 0.69 0.38 0.82 -1.07 0.00 0.00 179.97 180.83 2fwu h ILE 628 N 0.16 1.00 -0.25 2.04 2.04 -0.96 0.15 117.51 121.69 2fwu h ILE 628 Ca 0.05 -0.24 -0.18 0.00 1.00 0.00 0.00 64.86 65.50 2fwu h ILE 628 Cb 0.54 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2fwu h ILE 628 CO 0.03 0.13 -0.55 0.00 0.00 0.00 0.00 178.15 177.76 2fwu h ALA 629 N 1.33 0.56 -0.01 1.87 0.00 -0.82 -3.19 119.26 119.00 2fwu h ALA 629 Ca 0.29 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2fwu h ALA 629 Cb 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2fwu h ALA 629 CO -0.16 0.68 -0.10 0.39 0.00 0.00 0.00 179.25 180.06 2fwu n GLU 630 N -3.99 1.07 0.00 0.00 -0.58 0.98 -3.81 120.64 114.31 2fwu n GLU 630 Ca -0.04 -0.51 0.09 0.00 -0.42 0.00 0.00 57.16 56.28 2fwu n GLU 630 Cb 0.62 -1.49 0.43 0.00 -0.57 0.00 0.00 31.44 30.43 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 -0.52 0.13 0.24 3.49 0.00 0.47 -0.98 117.12 119.96 2fwu n MET 631 Ca 0.16 0.15 0.13 0.00 0.00 0.00 0.00 57.70 58.14 2fwu n MET 631 Cb 0.30 -1.50 0.51 0.00 0.00 0.00 0.00 33.22 32.53 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 3.11 0.00 -3.23 3.17 0.00 -1.79 -3.42 103.07 100.92 2fwu h GLY 632 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 2fwu h GLY 632 CO 0.00 0.00 -0.10 0.50 0.00 0.00 0.00 176.54 176.94 2fwu s ARG 633 N -3.58 3.70 0.21 4.80 3.00 -0.15 -4.96 118.95 121.97 2fwu s ARG 633 Ca 0.02 0.13 -0.31 0.00 0.00 0.00 0.00 55.73 55.57 2fwu s ARG 633 Cb 0.09 -2.62 -0.10 0.00 0.00 0.00 0.00 34.95 32.32 2fwu s ARG 633 CO 0.60 0.21 1.50 -1.25 0.00 0.00 0.00 175.30 176.36 2fwu s PRO 634 N -3.38 4.24 0.28 3.54 0.04 -1.26 -4.72 135.00 133.75 2fwu s PRO 634 Ca 0.46 2.32 0.09 0.00 0.04 0.00 0.00 61.00 63.91 2fwu s PRO 634 Cb -0.11 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 2fwu s PRO 634 CO 0.28 -0.51 0.03 0.96 0.04 0.00 0.00 177.00 177.80 2fwu s ILE 635 N 0.52 3.35 0.73 0.56 -5.25 -1.26 -4.13 121.20 115.73 2fwu s ILE 635 Ca 0.64 -1.86 -0.15 0.00 -0.99 0.00 0.00 60.65 58.30 2fwu s ILE 635 Cb -0.43 -2.89 0.04 0.00 2.95 0.00 0.00 42.46 42.14 2fwu s ILE 635 CO 0.38 -0.33 1.19 -0.22 -1.79 0.00 0.00 174.94 174.17 2fwu s LEU 636 N -3.72 3.29 0.00 0.37 0.20 -1.26 -3.86 118.68 113.71 2fwu s LEU 636 Ca 0.33 2.31 0.00 0.00 0.69 0.00 0.00 54.13 57.46 2fwu s LEU 636 Cb -0.05 -4.58 0.00 0.00 -0.43 0.00 0.00 46.19 41.12 2fwu s LEU 636 CO 0.21 -2.24 0.00 0.61 -0.29 0.00 0.00 176.35 174.63 2fwu n GLY 637 N 0.28 0.83 0.00 7.98 0.00 0.35 -4.66 105.19 109.97 2fwu n GLY 637 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 -4.32 1.61 2.13 -1.26 -4.87 120.64 113.94 2fwu n GLU 638 Ca 0.00 0.16 -0.23 0.00 0.66 0.00 0.00 57.16 57.75 2fwu n GLU 638 Cb 0.00 -0.58 -0.17 0.00 0.27 0.00 0.00 31.44 30.96 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 -0.70 1.21 -0.40 4.31 -3.43 -1.26 -5.08 115.29 109.93 2fwu s HIS 639 Ca 0.00 -0.45 0.02 0.00 -0.80 0.00 0.00 55.06 53.82 2fwu s HIS 639 Cb 0.00 -0.96 0.13 0.00 -1.43 0.00 0.00 32.58 30.32 2fwu s HIS 639 CO 0.00 -0.29 0.20 0.95 -2.00 0.00 0.00 174.74 173.60 2fwu s THR 640 N 0.95 1.35 -0.22 -5.38 -4.23 -1.26 -2.44 115.64 104.41 2fwu s THR 640 Ca -0.10 -2.29 -0.20 0.00 -1.18 0.00 0.00 61.69 57.93 2fwu s THR 640 Cb -0.15 -1.96 0.06 0.00 1.34 0.00 0.00 72.50 71.79 2fwu s THR 640 CO 0.00 -0.83 0.58 -0.75 -0.54 0.00 0.00 174.62 173.09 2fwu s LYS 641 N 0.67 0.67 -0.25 3.99 2.47 -1.26 -4.69 119.74 121.33 2fwu s LYS 641 Ca 0.15 0.82 -0.04 0.00 -1.56 0.00 0.00 55.97 55.35 2fwu s LYS 641 Cb -0.23 0.31 0.09 0.00 -1.46 0.00 0.00 37.83 36.54 2fwu s LYS 641 CO -0.06 -0.09 0.10 -1.17 0.16 0.00 0.00 175.35 174.30 2fwu s LEU 642 N 0.41 0.81 -0.48 5.43 2.96 -0.65 -3.93 118.68 123.23 2fwu s LEU 642 Ca -0.01 -1.12 -0.20 0.00 -0.22 0.00 0.00 54.13 52.59 2fwu s LEU 642 Cb -0.04 -0.43 0.04 0.00 0.50 0.00 0.00 46.19 46.26 2fwu s LEU 642 CO -0.01 -0.40 0.63 -0.70 -1.32 0.00 0.00 176.35 174.56 2fwu s GLU 643 N 2.01 3.19 -0.52 1.98 2.12 0.12 -0.19 118.70 127.41 2fwu s GLU 643 Ca 0.06 -0.65 -0.20 0.00 0.36 0.00 0.00 54.97 54.55 2fwu s GLU 643 Cb -0.16 -4.03 0.06 0.00 0.26 0.00 0.00 34.13 30.26 2fwu s GLU 643 CO -0.25 -1.12 0.68 0.08 -0.54 0.00 0.00 175.26 174.10 2fwu s VAL 644 N 2.73 4.80 -0.28 3.70 1.01 0.27 -1.37 120.40 131.26 2fwu s VAL 644 Ca 0.18 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.52 2fwu s VAL 644 Cb -0.17 -4.35 -0.02 0.00 0.00 0.00 0.00 36.38 31.84 2fwu s VAL 644 CO 0.15 -0.88 0.57 -0.63 0.00 0.00 0.00 175.10 174.31 2fwu s ILE 645 N 2.81 5.01 -0.43 2.22 1.09 -0.46 -2.29 121.20 129.15 2fwu s ILE 645 Ca 0.17 0.90 -0.15 0.00 -1.10 0.00 0.00 60.65 60.47 2fwu s ILE 645 Cb -0.19 -3.91 0.04 0.00 -1.06 0.00 0.00 42.46 37.35 2fwu s ILE 645 CO 0.12 -0.01 0.34 -0.63 -0.10 0.00 0.00 174.94 174.66 2fwu s ILE 646 N 2.44 5.23 0.15 2.92 1.09 -1.04 -1.31 121.20 130.68 2fwu s ILE 646 Ca 0.23 -0.84 0.08 0.00 -1.10 0.00 0.00 60.65 59.03 2fwu s ILE 646 Cb -0.15 -4.00 -0.04 0.00 -1.06 0.00 0.00 42.46 37.21 2fwu s ILE 646 CO 0.10 -0.42 -0.11 -1.83 -0.10 0.00 0.00 174.94 172.58 2fwu s GLU 647 N 1.66 2.04 0.25 2.79 -1.05 -0.68 -4.41 118.70 119.29 2fwu s GLU 647 Ca 0.05 -1.18 -0.31 0.00 -0.15 0.00 0.00 54.97 53.37 2fwu s GLU 647 Cb -0.21 -2.20 -0.12 0.00 -0.44 0.00 0.00 34.13 31.16 2fwu s GLU 647 CO 0.08 0.46 1.57 0.39 0.95 0.00 0.00 175.26 178.72 2fwu n GLU 648 N 0.35 2.51 -1.57 -4.83 4.71 -1.26 -0.03 120.64 120.52 2fwu n GLU 648 Ca -0.12 0.89 -0.43 0.00 -0.01 0.00 0.00 57.16 57.49 2fwu n GLU 648 Cb 0.54 -2.66 -0.04 0.00 -1.01 0.00 0.00 31.44 28.27 2fwu n GLU 648 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2fwu n SER 649 N 2.63 2.93 0.02 1.62 2.88 -1.26 -4.66 113.62 117.77 2fwu n SER 649 Ca 0.11 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 2fwu n SER 649 Cb 0.34 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.29 2fwu n SER 649 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fwu n TYR 650 N 12.05 -0.30 -3.31 0.66 4.19 -1.26 -5.05 117.16 124.14 2fwu n TYR 650 Ca 0.33 0.05 0.00 0.00 3.31 0.00 0.00 57.90 61.59 2fwu n TYR 650 Cb 0.43 0.37 0.00 0.00 0.49 0.00 0.00 39.34 40.62 2fwu n TYR 650 CO 0.00 0.00 0.00 -0.85 0.91 0.00 0.00 176.86 176.92 2fwu n GLU 651 N -2.66 0.66 -3.59 2.98 0.28 -1.26 -5.12 120.64 111.93 2fwu n GLU 651 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.71 2fwu n GLU 651 Cb 0.00 0.00 -0.13 0.00 1.43 0.00 0.00 31.44 32.74 2fwu n GLU 651 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2fwu s PHE 652 N -0.98 1.38 -0.38 -1.84 0.08 -1.26 -4.93 117.98 110.05 2fwu s PHE 652 Ca 0.00 -2.04 -0.01 0.00 0.12 0.00 0.00 56.93 55.00 2fwu s PHE 652 Cb 0.00 -1.42 0.10 0.00 -0.57 0.00 0.00 43.02 41.13 2fwu s PHE 652 CO 0.00 -0.81 0.14 0.15 -0.10 0.00 0.00 175.22 174.60 2fwu s LYS 653 N 0.70 1.94 -0.35 0.44 -0.14 -1.26 -5.00 119.74 116.07 2fwu s LYS 653 Ca 0.18 -1.75 0.00 0.00 -1.36 0.00 0.00 55.97 53.04 2fwu s LYS 653 Cb -0.24 -3.44 0.14 0.00 -1.68 0.00 0.00 37.83 32.61 2fwu s LYS 653 CO 0.01 -0.98 0.23 0.45 -0.76 0.00 0.00 175.35 174.30 2fwu s SER 654 N 1.53 2.73 -0.14 2.83 0.15 -1.26 -4.75 113.70 114.79 2fwu s SER 654 Ca 0.07 -2.08 -0.04 0.00 0.70 0.00 0.00 55.95 54.60 2fwu s SER 654 Cb -0.21 -0.26 0.05 0.00 -1.71 0.00 0.00 66.02 63.88 2fwu s SER 654 CO -0.05 -0.31 0.07 0.28 1.20 0.00 0.00 173.24 174.44 2fwu s THR 655 N 1.15 0.06 0.29 6.45 -1.32 -1.26 -4.94 115.64 116.07 2fwu s THR 655 Ca 0.18 -0.10 0.05 0.00 -1.21 0.00 0.00 61.69 60.61 2fwu s THR 655 Cb -0.22 -0.58 -0.02 0.00 -1.51 0.00 0.00 72.50 70.18 2fwu s THR 655 CO -0.00 -0.14 0.19 1.33 -2.21 0.00 0.00 174.62 173.78 2fwu n VAL 656 N 5.23 0.00 0.90 5.08 0.24 -1.26 -5.14 118.33 123.38 2fwu n VAL 656 Ca -0.07 -1.95 0.11 0.00 -2.04 0.00 0.00 64.34 60.39 2fwu n VAL 656 Cb 0.49 0.87 0.09 0.00 -1.47 0.00 0.00 33.84 33.82 2fwu n VAL 656 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79