#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 2.77 -2.88 1.59 0.00 -1.17 -4.82 120.51 116.00 2fwu n ALA 502 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2fwu n ALA 502 Cb 0.00 0.32 -0.05 0.00 0.00 0.00 0.00 19.45 19.72 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 -4.69 2.15 -0.43 0.00 0.00 -1.26 -1.00 107.32 102.08 2fwu s GLY 503 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 44.72 43.92 2fwu s GLY 503 CO 0.00 -0.74 0.23 -0.42 0.00 0.00 0.00 173.10 172.17 2fwu s ILE 504 N -1.36 1.43 -0.31 0.90 1.09 -1.23 -3.24 121.20 118.47 2fwu s ILE 504 Ca 0.29 -2.52 -0.04 0.00 -1.10 0.00 0.00 60.65 57.28 2fwu s ILE 504 Cb -0.13 -2.01 0.04 0.00 -1.06 0.00 0.00 42.46 39.31 2fwu s ILE 504 CO 0.21 -0.88 0.05 -0.36 -0.10 0.00 0.00 174.94 173.86 2fwu s PHE 505 N 0.40 3.24 0.20 3.97 0.08 -1.16 -3.77 117.98 120.95 2fwu s PHE 505 Ca 0.17 -1.61 -0.10 0.00 0.12 0.00 0.00 56.93 55.51 2fwu s PHE 505 Cb -0.24 -2.19 -0.01 0.00 -0.57 0.00 0.00 43.02 40.02 2fwu s PHE 505 CO -0.01 -0.75 0.37 -0.08 -0.10 0.00 0.00 175.22 174.65 2fwu s THR 506 N 1.34 0.03 0.25 0.64 -1.32 -1.26 0.21 115.64 115.52 2fwu s THR 506 Ca -0.03 -1.40 -0.02 0.00 -1.21 0.00 0.00 61.69 59.02 2fwu s THR 506 Cb -0.19 -2.03 -0.05 0.00 -1.51 0.00 0.00 72.50 68.72 2fwu s THR 506 CO 0.01 -0.13 0.47 -0.36 -2.21 0.00 0.00 174.62 172.40 2fwu s PHE 507 N -4.00 3.48 -0.06 9.09 0.08 -1.13 -2.61 117.98 122.83 2fwu s PHE 507 Ca 0.21 0.47 0.13 0.00 0.12 0.00 0.00 56.93 57.86 2fwu s PHE 507 Cb 0.02 -1.96 -0.23 0.00 -0.57 0.00 0.00 43.02 40.28 2fwu s PHE 507 CO 0.05 0.28 0.63 -1.91 -0.10 0.00 0.00 175.22 174.16 2fwu n GLU 508 N -0.86 0.63 -4.67 0.44 2.13 -1.26 -4.78 120.64 112.27 2fwu n GLU 508 Ca -0.03 0.27 -0.33 0.00 0.66 0.00 0.00 57.16 57.73 2fwu n GLU 508 Cb 0.54 -1.78 -0.14 0.00 0.27 0.00 0.00 31.44 30.34 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 -2.61 3.40 0.01 5.31 1.03 -1.26 -4.80 118.70 119.77 2fwu s GLU 509 Ca -0.05 -0.63 0.27 0.00 0.03 0.00 0.00 54.97 54.59 2fwu s GLU 509 Cb 0.08 -2.70 0.89 0.00 -0.80 0.00 0.00 34.13 31.60 2fwu s GLU 509 CO 0.82 0.26 1.69 -0.35 -1.33 0.00 0.00 175.26 176.36 2fwu n PRO 510 N 3.41 0.01 -3.81 -4.83 -0.04 -1.26 -4.76 135.00 123.71 2fwu n PRO 510 Ca -0.18 0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.15 2fwu n PRO 510 Cb 0.53 -1.51 -0.14 0.00 -0.04 0.00 0.00 33.50 32.33 2fwu n PRO 510 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2fwu s VAL 511 N -3.00 -0.03 -0.00 0.52 1.01 -1.23 0.01 120.40 117.68 2fwu s VAL 511 Ca 0.12 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2fwu s VAL 511 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 36.46 2fwu s VAL 511 CO 0.61 0.04 -0.01 0.28 0.00 0.00 0.00 175.10 176.02 2fwu s THR 512 N 0.51 0.07 -0.14 3.92 -1.32 -0.26 -3.13 115.64 115.30 2fwu s THR 512 Ca -0.04 -0.01 -0.04 0.00 -1.21 0.00 0.00 61.69 60.39 2fwu s THR 512 Cb -0.06 -0.09 -0.03 0.00 -1.51 0.00 0.00 72.50 70.81 2fwu s THR 512 CO -0.02 0.04 -0.01 -1.00 -2.21 0.00 0.00 174.62 171.42 2fwu s HIS 513 N 0.15 3.09 0.26 9.09 3.76 0.51 -0.61 115.29 131.55 2fwu s HIS 513 Ca -0.01 -0.09 0.12 0.00 -0.15 0.00 0.00 55.06 54.92 2fwu s HIS 513 Cb -0.03 -1.93 -0.05 0.00 1.11 0.00 0.00 32.58 31.69 2fwu s HIS 513 CO -0.00 0.14 -0.20 0.14 -0.85 0.00 0.00 174.74 173.96 2fwu s VAL 514 N 0.00 2.43 0.24 -0.90 -7.23 -0.48 -3.99 120.40 110.48 2fwu s VAL 514 Ca 0.02 -2.34 -0.26 0.00 -1.81 0.00 0.00 61.98 57.59 2fwu s VAL 514 Cb -0.13 -2.26 -0.09 0.00 0.56 0.00 0.00 36.38 34.46 2fwu s VAL 514 CO 0.02 -0.36 0.86 -0.44 -0.31 0.00 0.00 175.10 174.87 2fwu s SER 515 N -3.36 7.39 0.41 4.85 0.01 -1.26 -3.61 113.70 118.12 2fwu s SER 515 Ca 0.28 1.75 0.22 0.00 1.31 0.00 0.00 55.95 59.51 2fwu s SER 515 Cb -0.05 -2.54 0.29 0.00 0.21 0.00 0.00 66.02 63.93 2fwu s SER 515 CO 0.14 0.08 1.58 -0.08 0.41 0.00 0.00 173.24 175.37 2fwu h GLU 516 N 3.77 0.00 -0.77 12.44 4.81 -1.86 -3.25 114.58 129.73 2fwu h GLU 516 Ca -0.47 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.66 2fwu h GLU 516 Cb 1.20 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.52 2fwu h GLU 516 CO 0.66 0.08 0.13 0.43 -0.73 0.00 0.00 179.01 179.59 2fwu n SER 517 N -3.12 4.27 -4.90 1.04 7.64 -1.26 -4.86 113.62 112.43 2fwu n SER 517 Ca 0.04 -2.83 -0.31 0.00 1.01 0.00 0.00 58.87 56.78 2fwu n SER 517 Cb 0.56 -0.67 -0.04 0.00 -1.01 0.00 0.00 64.21 63.05 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 -2.34 5.25 -0.14 0.44 2.07 -1.23 -5.02 121.20 120.22 2fwu s ILE 518 Ca 0.41 -0.10 -0.16 0.00 -1.41 0.00 0.00 60.65 59.39 2fwu s ILE 518 Cb 0.32 -3.62 -0.13 0.00 0.13 0.00 0.00 42.46 39.16 2fwu s ILE 518 CO 0.11 0.09 0.28 1.23 -1.91 0.00 0.00 174.94 174.74 2fwu h GLY 519 N 2.97 0.00 -6.44 1.50 0.00 -1.89 -3.39 103.07 95.81 2fwu h GLY 519 Ca -0.46 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.41 2fwu h GLY 519 CO 0.73 0.00 -0.78 -0.42 0.00 0.00 0.00 176.54 176.07 2fwu s ILE 520 N -2.05 0.70 -0.04 2.60 -1.09 -1.26 -2.33 121.20 117.73 2fwu s ILE 520 Ca -0.15 -0.16 -0.14 0.00 -2.23 0.00 0.00 60.65 57.98 2fwu s ILE 520 Cb 0.00 -0.73 -0.05 0.00 -1.58 0.00 0.00 42.46 40.10 2fwu s ILE 520 CO 0.39 0.28 0.37 0.00 -1.23 0.00 0.00 174.94 174.76 2fwu s MET 521 N 1.29 3.95 -0.01 2.79 0.23 -0.58 -4.90 119.30 122.08 2fwu s MET 521 Ca -0.05 0.32 0.06 0.00 -1.03 0.00 0.00 55.69 54.99 2fwu s MET 521 Cb -0.14 -3.26 -0.02 0.00 -1.53 0.00 0.00 34.83 29.88 2fwu s MET 521 CO -0.02 0.59 -0.19 -1.21 -2.03 0.00 0.00 175.02 172.16 2fwu s GLU 522 N -0.71 1.53 -0.11 3.16 2.02 -1.26 -1.75 118.70 121.58 2fwu s GLU 522 Ca 0.22 -0.70 0.02 0.00 0.02 0.00 0.00 54.97 54.53 2fwu s GLU 522 Cb -0.16 -1.49 0.01 0.00 0.10 0.00 0.00 34.13 32.60 2fwu s GLU 522 CO 0.11 0.41 -0.17 0.08 0.02 0.00 0.00 175.26 175.71 2fwu s VAL 523 N -0.48 1.60 -0.26 2.63 1.01 -1.24 -4.92 120.40 118.74 2fwu s VAL 523 Ca 0.07 -0.71 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 2fwu s VAL 523 Cb -0.07 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.87 2fwu s VAL 523 CO -0.01 0.46 1.18 -0.54 0.00 0.00 0.00 175.10 176.19 2fwu s LYS 524 N 0.88 4.09 -0.10 2.72 -0.14 -1.26 -3.00 119.74 122.94 2fwu s LYS 524 Ca -0.08 1.30 -0.08 0.00 -1.36 0.00 0.00 55.97 55.75 2fwu s LYS 524 Cb -0.15 -3.77 -0.04 0.00 -1.68 0.00 0.00 37.83 32.19 2fwu s LYS 524 CO -0.00 -0.88 0.19 0.08 -0.76 0.00 0.00 175.35 173.98 2fwu s VAL 525 N 3.75 5.42 0.43 3.17 1.01 -0.22 -4.51 120.40 129.45 2fwu s VAL 525 Ca 0.50 0.31 -0.24 0.00 0.00 0.00 0.00 61.98 62.55 2fwu s VAL 525 Cb -0.16 -3.46 -0.08 0.00 0.00 0.00 0.00 36.38 32.68 2fwu s VAL 525 CO 0.16 0.60 1.21 -0.76 0.00 0.00 0.00 175.10 176.31 2fwu s LEU 526 N -1.06 4.12 0.22 3.92 2.01 -1.07 -3.88 118.68 122.93 2fwu s LEU 526 Ca 0.17 2.42 0.03 0.00 0.01 0.00 0.00 54.13 56.76 2fwu s LEU 526 Cb -0.13 -4.08 -0.03 0.00 0.01 0.00 0.00 46.19 41.96 2fwu s LEU 526 CO 0.06 -0.84 0.36 -0.60 1.01 0.00 0.00 176.35 176.34 2fwu s ARG 527 N -2.44 3.45 0.24 1.70 3.52 -1.25 -4.32 118.95 119.85 2fwu s ARG 527 Ca 0.60 -0.63 -0.30 0.00 -0.13 0.00 0.00 55.73 55.27 2fwu s ARG 527 Cb -0.32 -2.89 -0.10 0.00 -1.56 0.00 0.00 34.95 30.08 2fwu s ARG 527 CO 0.40 0.43 1.42 -0.08 -0.81 0.00 0.00 175.30 176.66 2fwu s THR 528 N -1.92 2.73 0.03 4.11 -1.32 -1.25 -4.35 115.64 113.67 2fwu s THR 528 Ca 0.35 0.61 -0.08 0.00 -1.21 0.00 0.00 61.69 61.36 2fwu s THR 528 Cb -0.10 -3.39 -0.31 0.00 -1.51 0.00 0.00 72.50 67.19 2fwu s THR 528 CO 0.29 0.10 0.96 -1.28 -2.21 0.00 0.00 174.62 172.48 2fwu h SER 529 N 5.05 0.57 -2.53 8.08 0.87 -1.85 -3.40 113.55 120.34 2fwu h SER 529 Ca -0.46 -0.68 -0.63 0.00 -1.23 0.00 0.00 61.79 58.79 2fwu h SER 529 Cb 1.22 -0.19 -0.14 0.00 -0.44 0.00 0.00 62.40 62.85 2fwu h SER 529 CO 0.77 1.55 0.67 -0.83 -0.53 0.00 0.00 176.83 178.46 2fwu s GLY 530 N -4.78 1.41 -0.29 5.77 0.00 -0.17 -4.90 107.32 104.36 2fwu s GLY 530 Ca -0.08 -1.97 0.00 0.00 0.00 0.00 0.00 44.72 42.67 2fwu s GLY 530 CO 0.89 2.13 0.34 0.00 0.00 0.00 0.00 173.10 176.46 2fwu s ALA 531 N 4.02 -0.80 -0.05 3.20 0.00 -1.26 -4.51 121.76 122.36 2fwu s ALA 531 Ca 0.26 -0.03 0.05 0.00 0.00 0.00 0.00 51.96 52.24 2fwu s ALA 531 Cb -0.14 -1.91 0.09 0.00 0.00 0.00 0.00 23.12 21.16 2fwu s ALA 531 CO 0.07 -1.70 1.05 0.54 0.00 0.00 0.00 175.76 175.71 2fwu n ARG 532 N 5.33 2.53 -0.76 0.00 3.00 -1.26 -4.28 116.66 121.21 2fwu n ARG 532 Ca -0.01 -1.81 0.00 0.00 -0.01 0.00 0.00 57.85 56.02 2fwu n ARG 532 Cb 0.48 -1.15 0.00 0.00 0.00 0.00 0.00 32.46 31.79 2fwu n ARG 532 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2fwu n GLY 533 N -0.74 2.88 3.79 -0.13 0.00 -1.26 -4.80 105.19 104.93 2fwu n GLY 533 Ca 0.05 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.63 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 0.06 6.42 -0.04 1.61 3.04 -1.26 -1.40 114.94 123.37 2fwu s ASN 534 Ca 0.00 0.50 0.02 0.00 0.04 0.00 0.00 52.86 53.41 2fwu s ASN 534 Cb 0.00 -2.14 0.02 0.00 -1.54 0.00 0.00 41.25 37.59 2fwu s ASN 534 CO 0.00 0.25 -0.07 -0.69 -3.04 0.00 0.00 177.10 173.55 2fwu s VAL 535 N -0.24 0.68 -0.12 -5.21 1.01 0.12 -0.77 120.40 115.88 2fwu s VAL 535 Ca 0.15 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 61.85 2fwu s VAL 535 Cb -0.13 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 2fwu s VAL 535 CO 0.04 0.25 0.06 -0.63 0.00 0.00 0.00 175.10 174.82 2fwu s ILE 536 N 0.67 4.83 -0.23 2.22 -1.09 -0.06 -0.13 121.20 127.42 2fwu s ILE 536 Ca -0.10 -0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.28 2fwu s ILE 536 Cb -0.13 -3.09 0.06 0.00 -1.58 0.00 0.00 42.46 37.72 2fwu s ILE 536 CO 0.01 0.59 -0.05 -0.69 -1.23 0.00 0.00 174.94 173.57 2fwu s VAL 537 N -0.71 1.46 0.56 2.92 1.01 0.42 0.30 120.40 126.36 2fwu s VAL 537 Ca 0.12 -1.16 -0.16 0.00 0.00 0.00 0.00 61.98 60.78 2fwu s VAL 537 Cb -0.12 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 2fwu s VAL 537 CO 0.03 -0.10 1.03 -2.16 0.00 0.00 0.00 175.10 173.90 2fwu s PRO 538 N 1.43 3.53 0.11 2.72 0.04 -1.26 0.40 135.00 141.98 2fwu s PRO 538 Ca -0.05 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 62.03 2fwu s PRO 538 Cb -0.19 -2.07 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 2fwu s PRO 538 CO -0.06 -0.63 0.22 1.52 0.04 0.00 0.00 177.00 178.09 2fwu s TYR 539 N -2.49 0.23 0.08 0.56 -0.85 0.55 0.25 117.35 115.68 2fwu s TYR 539 Ca 0.62 -0.63 -0.16 0.00 -0.52 0.00 0.00 57.07 56.38 2fwu s TYR 539 Cb -0.14 -0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.17 2fwu s TYR 539 CO 0.34 -0.60 0.38 -1.59 -1.52 0.00 0.00 175.55 172.56 2fwu s LYS 540 N -3.89 0.97 -0.26 -3.49 -2.85 -0.65 -1.79 119.74 107.78 2fwu s LYS 540 Ca 0.09 -0.59 -0.11 0.00 -1.00 0.00 0.00 55.97 54.37 2fwu s LYS 540 Cb 0.04 0.42 -0.05 0.00 -2.06 0.00 0.00 37.83 36.19 2fwu s LYS 540 CO -0.08 -0.35 0.18 0.95 0.10 0.00 0.00 175.35 176.15 2fwu s THR 541 N -3.20 5.33 -0.39 3.79 -4.23 -0.75 -2.11 115.64 114.08 2fwu s THR 541 Ca -0.01 0.18 -0.21 0.00 -1.18 0.00 0.00 61.69 60.48 2fwu s THR 541 Cb 0.01 -3.52 0.01 0.00 1.34 0.00 0.00 72.50 70.34 2fwu s THR 541 CO -0.08 0.30 0.65 -0.63 -0.54 0.00 0.00 174.62 174.32 2fwu s ILE 542 N 1.39 4.85 0.16 2.99 1.09 0.10 -4.88 121.20 126.90 2fwu s ILE 542 Ca 0.07 0.39 -0.18 0.00 -1.10 0.00 0.00 60.65 59.83 2fwu s ILE 542 Cb -0.15 -4.14 0.07 0.00 -1.06 0.00 0.00 42.46 37.18 2fwu s ILE 542 CO 0.08 -0.45 1.66 -0.33 -0.10 0.00 0.00 174.94 175.79 2fwu h GLU 543 N 8.66 -0.05 0.00 2.79 5.08 -1.90 -0.91 114.58 128.25 2fwu h GLU 543 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2fwu h GLU 543 Cb 1.10 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2fwu h GLU 543 CO 0.87 -0.04 0.00 0.41 -1.00 0.00 0.00 179.01 179.25 2fwu n GLY 544 N -1.32 0.93 0.05 -3.84 0.00 -1.26 -1.02 105.19 98.74 2fwu n GLY 544 Ca 0.01 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 0.94 -3.27 2.61 5.66 -1.22 -5.02 114.28 113.97 2fwu n THR 545 Ca 0.00 -0.97 -0.19 0.00 -3.05 0.00 0.00 64.05 59.84 2fwu n THR 545 Cb 0.00 0.53 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 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 -0.94 4.22 0.84 1.79 0.00 -0.19 -4.83 121.76 122.65 2fwu s ALA 546 Ca 0.02 -1.44 -0.12 0.00 0.00 0.00 0.00 51.96 50.42 2fwu s ALA 546 Cb 0.01 -1.75 0.10 0.00 0.00 0.00 0.00 23.12 21.48 2fwu s ALA 546 CO 0.01 -0.16 1.12 0.50 0.00 0.00 0.00 175.76 177.23 2fwu s ARG 547 N -4.29 1.71 1.30 0.00 6.06 -1.26 -4.89 118.95 117.58 2fwu s ARG 547 Ca 0.48 0.45 -0.20 0.00 -2.50 0.00 0.00 55.73 53.96 2fwu s ARG 547 Cb -0.10 -1.89 0.32 0.00 0.06 0.00 0.00 34.95 33.34 2fwu s ARG 547 CO 0.33 -1.84 1.01 0.20 -2.50 0.00 0.00 175.30 172.50 2fwu s GLY 548 N -4.02 1.50 0.13 8.12 0.00 -1.26 -4.52 107.32 107.25 2fwu s GLY 548 Ca 0.62 -0.80 -0.33 0.00 0.00 0.00 0.00 44.72 44.21 2fwu s GLY 548 CO 0.53 0.13 1.70 0.61 0.00 0.00 0.00 173.10 176.07 2fwu n GLY 549 N 0.32 1.36 0.76 0.20 0.00 -1.26 -1.82 105.19 104.76 2fwu n GLY 549 Ca 0.12 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.83 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 3.83 0.82 0.00 -0.02 0.00 0.17 -4.79 105.19 105.19 2fwu n GLY 550 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.00 0.00 -0.07 1.61 -0.58 -0.75 -4.77 120.64 114.07 2fwu n GLU 551 Ca 0.00 0.20 -0.17 0.00 -0.42 0.00 0.00 57.16 56.77 2fwu n GLU 551 Cb 0.00 -0.68 -0.13 0.00 -0.57 0.00 0.00 31.44 30.06 2fwu n GLU 551 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2fwu n ASP 552 N -2.17 1.69 -3.98 1.62 8.00 -1.25 -4.63 116.55 115.83 2fwu n ASP 552 Ca 0.00 0.04 -0.08 0.00 0.71 0.00 0.00 54.79 55.45 2fwu n ASP 552 Cb 0.00 -0.35 -0.09 0.00 -0.02 0.00 0.00 41.12 40.65 2fwu n ASP 552 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2fwu s PHE 553 N -2.54 0.31 -0.30 1.24 -0.71 -1.26 -1.44 117.98 113.28 2fwu s PHE 553 Ca -0.25 -0.72 -0.23 0.00 -1.04 0.00 0.00 56.93 54.70 2fwu s PHE 553 Cb 0.08 -0.22 -0.00 0.00 -1.21 0.00 0.00 43.02 41.66 2fwu s PHE 553 CO 0.70 -0.38 0.75 -2.00 -1.34 0.00 0.00 175.22 172.96 2fwu s GLU 554 N -3.11 3.96 -0.46 1.99 -6.30 0.35 0.41 118.70 115.55 2fwu s GLU 554 Ca -0.01 0.54 -0.28 0.00 -2.50 0.00 0.00 54.97 52.72 2fwu s GLU 554 Cb 0.02 -3.72 -0.00 0.00 0.00 0.00 0.00 34.13 30.42 2fwu s GLU 554 CO -0.07 -0.64 1.60 0.34 0.02 0.00 0.00 175.26 176.51 2fwu s ASP 555 N 1.61 5.98 -0.19 -1.70 2.15 -1.26 -4.47 116.67 118.78 2fwu s ASP 555 Ca 0.31 0.76 -0.06 0.00 0.43 0.00 0.00 52.55 53.99 2fwu s ASP 555 Cb -0.14 -2.54 -0.03 0.00 -0.30 0.00 0.00 42.92 39.91 2fwu s ASP 555 CO 0.12 -1.74 0.03 0.28 -0.17 0.00 0.00 175.17 173.69 2fwu s THR 556 N 6.61 4.29 -0.19 1.71 -1.32 -1.26 -4.97 115.64 120.51 2fwu s THR 556 Ca 0.66 -0.20 -0.04 0.00 -1.21 0.00 0.00 61.69 60.89 2fwu s THR 556 Cb -0.15 -2.94 0.06 0.00 -1.51 0.00 0.00 72.50 67.96 2fwu s THR 556 CO 0.29 0.43 0.06 0.00 -2.21 0.00 0.00 174.62 173.20 2fwu n GLY 558 N 5.15 3.60 2.80 0.00 0.00 -0.74 -4.98 105.19 111.03 2fwu n GLY 558 Ca -0.08 -1.04 -0.15 0.00 0.00 0.00 0.00 46.02 44.75 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 0.49 0.09 0.07 1.61 2.02 -1.26 -0.33 118.70 121.39 2fwu s GLU 559 Ca 0.00 0.12 -0.12 0.00 0.02 0.00 0.00 54.97 54.99 2fwu s GLU 559 Cb 0.00 -0.30 -0.06 0.00 0.10 0.00 0.00 34.13 33.87 2fwu s GLU 559 CO 0.00 -0.13 0.44 -0.51 0.02 0.00 0.00 175.26 175.08 2fwu s LEU 560 N 0.92 4.38 -0.24 1.80 1.43 0.16 -4.88 118.68 122.26 2fwu s LEU 560 Ca -0.08 0.91 -0.09 0.00 -1.03 0.00 0.00 54.13 53.83 2fwu s LEU 560 Cb -0.12 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 2fwu s LEU 560 CO -0.02 0.20 0.12 -0.70 0.23 0.00 0.00 176.35 176.17 2fwu s GLU 561 N -1.70 3.90 0.23 1.70 2.12 -1.26 -0.44 118.70 123.25 2fwu s GLU 561 Ca 0.32 -0.36 0.11 0.00 0.36 0.00 0.00 54.97 55.40 2fwu s GLU 561 Cb -0.15 -3.43 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 2fwu s GLU 561 CO 0.17 -0.02 -0.20 -0.06 -0.54 0.00 0.00 175.26 174.61 2fwu s PHE 562 N 1.22 2.17 0.29 5.30 0.08 0.82 -4.94 117.98 122.92 2fwu s PHE 562 Ca 0.06 -0.38 -0.15 0.00 0.12 0.00 0.00 56.93 56.57 2fwu s PHE 562 Cb -0.14 -1.01 0.06 0.00 -0.57 0.00 0.00 43.02 41.36 2fwu s PHE 562 CO 0.05 0.56 0.79 0.00 -0.10 0.00 0.00 175.22 176.52 2fwu n GLN 563 N -0.19 0.88 -0.10 0.44 10.64 -1.25 0.11 117.38 127.91 2fwu n GLN 563 Ca -0.09 -1.78 -0.02 0.00 -1.83 0.00 0.00 57.00 53.28 2fwu n GLN 563 Cb 0.58 2.27 0.22 0.00 -0.86 0.00 0.00 30.24 32.46 2fwu n GLN 563 CO 0.00 0.00 0.00 -2.95 -1.83 0.00 0.00 177.06 172.28 2fwu h ASN 564 N 1.79 0.70 0.85 2.61 -1.07 -1.42 -3.00 115.58 116.04 2fwu h ASN 564 Ca -0.28 -0.12 0.00 0.00 0.07 0.00 0.00 56.30 55.96 2fwu h ASN 564 Cb 1.11 -0.18 0.00 0.00 -2.07 0.00 0.00 38.32 37.17 2fwu h ASN 564 CO 0.37 0.71 -0.87 -0.67 0.07 0.00 0.00 177.43 177.03 2fwu n ASP 565 N -4.28 0.75 -4.47 6.14 2.03 -1.26 -4.86 116.55 110.61 2fwu n ASP 565 Ca 0.03 0.17 -0.34 0.00 0.52 0.00 0.00 54.79 55.17 2fwu n ASP 565 Cb 0.23 0.40 -0.12 0.00 -0.72 0.00 0.00 41.12 40.91 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 -3.27 3.62 0.25 -0.67 2.56 -1.14 -5.09 118.70 114.97 2fwu s GLU 566 Ca 0.03 -0.54 0.08 0.00 0.00 0.00 0.00 54.97 54.54 2fwu s GLU 566 Cb 0.12 -2.92 -0.04 0.00 2.00 0.00 0.00 34.13 33.29 2fwu s GLU 566 CO 0.77 0.18 0.09 0.96 -0.56 0.00 0.00 175.26 176.70 2fwu s ILE 567 N 0.51 3.95 0.29 -3.70 -4.36 -1.26 -3.76 121.20 112.87 2fwu s ILE 567 Ca -0.03 -1.63 0.00 0.00 -0.26 0.00 0.00 60.65 58.73 2fwu s ILE 567 Cb -0.14 -3.11 0.00 0.00 1.25 0.00 0.00 42.46 40.46 2fwu s ILE 567 CO 0.03 -0.34 0.00 0.55 0.24 0.00 0.00 174.94 175.42 2fwu n VAL 568 N -0.95 -0.42 -3.73 8.37 3.14 -1.26 -5.07 118.33 118.41 2fwu n VAL 568 Ca -0.07 0.44 -0.10 0.00 -2.96 0.00 0.00 64.34 61.65 2fwu n VAL 568 Cb 0.58 -0.67 -0.05 0.00 -1.06 0.00 0.00 33.84 32.64 2fwu n VAL 568 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2fwu s LYS 569 N -4.57 1.19 -0.04 1.45 -0.14 -1.25 -4.98 119.74 111.40 2fwu s LYS 569 Ca 0.00 -0.85 0.00 0.00 -1.36 0.00 0.00 55.97 53.77 2fwu s LYS 569 Cb 0.00 0.47 0.03 0.00 -1.68 0.00 0.00 37.83 36.65 2fwu s LYS 569 CO 0.00 -0.48 -0.01 0.95 -0.76 0.00 0.00 175.35 175.06 2fwu s THR 570 N -3.86 0.26 -0.55 2.17 -4.23 -1.25 -1.05 115.64 107.13 2fwu s THR 570 Ca 0.07 0.06 -0.28 0.00 -1.18 0.00 0.00 61.69 60.37 2fwu s THR 570 Cb 0.01 -0.36 0.03 0.00 1.34 0.00 0.00 72.50 73.52 2fwu s THR 570 CO -0.07 0.18 1.22 -0.63 -0.54 0.00 0.00 174.62 174.78 2fwu s ILE 571 N 1.18 4.02 -0.42 2.99 1.09 -1.16 -4.80 121.20 124.10 2fwu s ILE 571 Ca -0.07 0.94 -0.24 0.00 -1.10 0.00 0.00 60.65 60.18 2fwu s ILE 571 Cb -0.13 -4.65 0.02 0.00 -1.06 0.00 0.00 42.46 36.63 2fwu s ILE 571 CO -0.02 -1.24 0.85 -0.94 -0.10 0.00 0.00 174.94 173.49 2fwu s SER 572 N 3.07 6.52 -0.12 3.58 1.04 -1.26 -3.59 113.70 122.94 2fwu s SER 572 Ca 0.46 0.20 0.00 0.00 0.48 0.00 0.00 55.95 57.09 2fwu s SER 572 Cb -0.08 -2.42 -0.01 0.00 0.10 0.00 0.00 66.02 63.60 2fwu s SER 572 CO 0.27 -0.90 -0.14 -0.69 0.98 0.00 0.00 173.24 172.77 2fwu s VAL 573 N 3.41 3.00 -0.21 5.02 1.01 -0.72 -4.95 120.40 126.96 2fwu s VAL 573 Ca 0.34 -0.68 -0.23 0.00 0.00 0.00 0.00 61.98 61.40 2fwu s VAL 573 Cb -0.12 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 2fwu s VAL 573 CO 0.22 0.53 0.74 -0.75 0.00 0.00 0.00 175.10 175.83 2fwu s LYS 574 N 0.27 4.21 0.05 2.72 2.20 -1.26 -1.52 119.74 126.40 2fwu s LYS 574 Ca -0.10 0.80 -0.19 0.00 -0.36 0.00 0.00 55.97 56.12 2fwu s LYS 574 Cb -0.16 -3.61 -0.06 0.00 -1.51 0.00 0.00 37.83 32.49 2fwu s LYS 574 CO 0.06 -0.37 0.54 0.08 -0.36 0.00 0.00 175.35 175.29 2fwu s VAL 575 N 2.34 4.82 0.22 4.02 1.01 -0.98 -0.49 120.40 131.33 2fwu s VAL 575 Ca 0.32 1.14 0.06 0.00 0.00 0.00 0.00 61.98 63.50 2fwu s VAL 575 Cb -0.16 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 2fwu s VAL 575 CO 0.10 0.54 0.24 -0.63 0.00 0.00 0.00 175.10 175.35 2fwu s ILE 576 N -0.99 4.78 0.07 2.22 -1.09 -0.52 -4.86 121.20 120.80 2fwu s ILE 576 Ca 0.28 -1.14 -0.31 0.00 -2.23 0.00 0.00 60.65 57.26 2fwu s ILE 576 Cb -0.19 -3.54 -0.08 0.00 -1.58 0.00 0.00 42.46 37.07 2fwu s ILE 576 CO 0.18 -0.26 1.52 1.51 -1.23 0.00 0.00 174.94 176.65 2fwu s ASP 577 N -3.65 6.72 0.05 3.58 -4.77 -1.26 -4.80 116.67 112.54 2fwu s ASP 577 Ca 0.33 2.36 -0.30 0.00 -3.30 0.00 0.00 52.55 51.63 2fwu s ASP 577 Cb -0.09 -2.57 -0.05 0.00 -1.09 0.00 0.00 42.92 39.12 2fwu s ASP 577 CO 0.26 -0.79 1.12 -0.62 0.70 0.00 0.00 175.17 175.84 2fwu s ASP 578 N 1.86 7.19 -0.11 2.11 2.15 -1.26 -4.86 116.67 123.75 2fwu s ASP 578 Ca 0.69 1.90 0.04 0.00 0.43 0.00 0.00 52.55 55.61 2fwu s ASP 578 Cb -0.37 -2.58 -0.24 0.00 -0.30 0.00 0.00 42.92 39.43 2fwu s ASP 578 CO 0.30 -0.38 0.38 -1.84 -0.17 0.00 0.00 175.17 173.46 2fwu n GLU 579 N 3.81 0.69 -4.31 4.34 0.00 -1.26 -5.02 120.64 118.90 2fwu n GLU 579 Ca 0.07 0.24 -0.29 0.00 0.00 0.00 0.00 57.16 57.18 2fwu n GLU 579 Cb 0.48 -1.70 -0.05 0.00 0.00 0.00 0.00 31.44 30.17 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 -3.22 0.82 -2.11 3.44 0.00 -1.26 -5.11 120.64 113.19 2fwu n GLU 580 Ca -0.28 -3.40 -0.34 0.00 0.00 0.00 0.00 57.16 53.14 2fwu n GLU 580 Cb 1.05 0.79 0.01 0.00 0.00 0.00 0.00 31.44 33.29 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 -2.67 2.77 -0.06 -1.84 1.13 -1.26 -5.04 117.35 110.39 2fwu s TYR 581 Ca 0.07 1.54 -0.07 0.00 -1.41 0.00 0.00 57.07 57.21 2fwu s TYR 581 Cb -0.01 -3.16 0.02 0.00 -1.10 0.00 0.00 41.96 37.71 2fwu s TYR 581 CO 0.04 -1.40 0.18 -2.00 -2.51 0.00 0.00 175.55 169.87 2fwu s GLU 582 N -3.68 0.27 0.66 -3.49 2.12 -1.26 -5.14 118.70 108.18 2fwu s GLU 582 Ca 0.68 0.14 0.02 0.00 0.36 0.00 0.00 54.97 56.18 2fwu s GLU 582 Cb -0.20 0.12 0.13 0.00 0.26 0.00 0.00 34.13 34.44 2fwu s GLU 582 CO 0.32 -0.04 0.90 1.63 -0.54 0.00 0.00 175.26 177.53 2fwu n LYS 583 N 2.70 0.12 -2.29 4.30 5.02 -1.26 -4.89 118.16 121.85 2fwu n LYS 583 Ca -0.14 -2.72 -0.36 0.00 -2.02 0.00 0.00 58.31 53.07 2fwu n LYS 583 Cb 0.58 -0.52 -0.04 0.00 -0.02 0.00 0.00 35.03 35.03 2fwu n LYS 583 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2fwu s ASN 584 N -4.77 5.76 0.43 4.39 0.02 -1.26 -4.86 114.94 114.65 2fwu s ASN 584 Ca 0.62 -0.60 0.08 0.00 -1.02 0.00 0.00 52.86 51.94 2fwu s ASN 584 Cb -0.04 -2.56 0.00 0.00 0.02 0.00 0.00 41.25 38.68 2fwu s ASN 584 CO 0.41 -2.13 0.50 -1.59 0.02 0.00 0.00 177.10 174.31 2fwu s LYS 585 N 6.19 2.69 -0.04 -0.60 0.00 -1.22 -4.93 119.74 121.83 2fwu s LYS 585 Ca 0.55 -1.38 -0.18 0.00 0.00 0.00 0.00 55.97 54.96 2fwu s LYS 585 Cb -0.07 -2.60 0.03 0.00 0.00 0.00 0.00 37.83 35.20 2fwu s LYS 585 CO 0.05 -0.27 0.39 -0.08 0.00 0.00 0.00 175.35 175.45 2fwu s THR 586 N -2.41 0.04 0.08 3.79 -1.32 -1.26 -1.48 115.64 113.08 2fwu s THR 586 Ca 0.52 -0.33 0.06 0.00 -1.21 0.00 0.00 61.69 60.73 2fwu s THR 586 Cb -0.07 -0.69 -0.03 0.00 -1.51 0.00 0.00 72.50 70.20 2fwu s THR 586 CO 0.31 -0.18 -0.16 0.72 -2.21 0.00 0.00 174.62 173.09 2fwu s PHE 587 N -1.14 1.40 -0.11 9.09 -0.12 -1.07 -3.40 117.98 122.63 2fwu s PHE 587 Ca -0.12 -0.45 -0.02 0.00 -0.05 0.00 0.00 56.93 56.29 2fwu s PHE 587 Cb -0.04 -0.78 -0.03 0.00 -0.63 0.00 0.00 43.02 41.54 2fwu s PHE 587 CO 0.05 0.11 -0.03 -0.06 -0.05 0.00 0.00 175.22 175.24 2fwu s PHE 588 N -1.25 3.06 -0.19 3.49 0.08 -0.35 -1.87 117.98 120.94 2fwu s PHE 588 Ca 0.01 -0.03 -0.08 0.00 0.12 0.00 0.00 56.93 56.95 2fwu s PHE 588 Cb -0.10 -1.84 -0.04 0.00 -0.57 0.00 0.00 43.02 40.47 2fwu s PHE 588 CO 0.03 0.24 0.08 -1.17 -0.10 0.00 0.00 175.22 174.30 2fwu s LEU 589 N -0.37 3.90 -0.06 -0.37 1.98 0.19 0.01 118.68 123.97 2fwu s LEU 589 Ca 0.06 0.11 0.01 0.00 -2.89 0.00 0.00 54.13 51.42 2fwu s LEU 589 Cb -0.12 -1.99 0.02 0.00 0.66 0.00 0.00 46.19 44.75 2fwu s LEU 589 CO 0.02 0.17 -0.06 -0.70 -1.89 0.00 0.00 176.35 173.89 2fwu s GLU 590 N 0.41 1.03 -0.03 1.98 2.12 -0.90 -0.84 118.70 122.47 2fwu s GLU 590 Ca 0.04 -0.14 -0.14 0.00 0.36 0.00 0.00 54.97 55.09 2fwu s GLU 590 Cb -0.12 -1.05 -0.05 0.00 0.26 0.00 0.00 34.13 33.17 2fwu s GLU 590 CO -0.00 -0.12 0.37 0.96 -0.54 0.00 0.00 175.26 175.94 2fwu s ILE 591 N 1.12 5.12 0.00 -3.70 -4.36 -1.26 -1.64 121.20 116.48 2fwu s ILE 591 Ca -0.07 0.75 0.00 0.00 -0.26 0.00 0.00 60.65 61.07 2fwu s ILE 591 Cb -0.14 -3.68 0.00 0.00 1.25 0.00 0.00 42.46 39.89 2fwu s ILE 591 CO -0.01 0.55 0.00 0.61 0.24 0.00 0.00 174.94 176.33 2fwu n GLY 592 N 2.07 1.79 3.64 6.27 0.00 0.14 -4.92 105.19 114.18 2fwu n GLY 592 Ca -0.14 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 2fwu n GLY 592 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fwu s GLU 593 N 3.94 4.16 0.64 1.61 2.12 -1.26 -4.74 118.70 125.18 2fwu s GLU 593 Ca 0.00 0.92 -0.14 0.00 0.36 0.00 0.00 54.97 56.10 2fwu s GLU 593 Cb 0.00 -3.65 -0.01 0.00 0.26 0.00 0.00 34.13 30.73 2fwu s GLU 593 CO 0.00 -0.54 1.08 -1.25 -0.54 0.00 0.00 175.26 174.01 2fwu s PRO 594 N 2.87 3.00 -0.22 4.30 0.04 -1.26 -4.41 135.00 139.33 2fwu s PRO 594 Ca 0.35 1.23 -0.02 0.00 0.04 0.00 0.00 61.00 62.60 2fwu s PRO 594 Cb -0.15 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.41 2fwu s PRO 594 CO 0.08 -1.07 -0.09 1.03 0.04 0.00 0.00 177.00 176.99 2fwu s ARG 595 N -4.29 3.06 -0.28 4.56 1.81 0.15 -4.72 118.95 119.24 2fwu s ARG 595 Ca 0.64 -0.82 -0.27 0.00 -1.72 0.00 0.00 55.73 53.56 2fwu s ARG 595 Cb -0.17 -2.88 0.01 0.00 -0.45 0.00 0.00 34.95 31.45 2fwu s ARG 595 CO 0.43 -0.28 0.95 -1.17 -0.68 0.00 0.00 175.30 174.55 2fwu s LEU 596 N 1.37 4.03 -1.47 2.53 1.98 -1.26 -0.88 118.68 124.98 2fwu s LEU 596 Ca 0.03 1.02 -0.08 0.00 -2.89 0.00 0.00 54.13 52.21 2fwu s LEU 596 Cb -0.15 -3.37 -0.02 0.00 0.66 0.00 0.00 46.19 43.32 2fwu s LEU 596 CO -0.06 -0.71 2.78 0.52 -1.89 0.00 0.00 176.35 176.99 2fwu n VAL 597 N 5.56 4.60 0.00 1.68 0.31 0.05 -4.79 118.33 125.75 2fwu n VAL 597 Ca 0.09 -3.16 0.00 0.00 -0.01 0.00 0.00 64.34 61.26 2fwu n VAL 597 Cb 0.47 -2.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.00 2fwu n VAL 597 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2fwu n GLU 598 N 2.87 0.00 -0.03 5.55 1.02 -1.26 -4.70 120.64 124.09 2fwu n GLU 598 Ca 0.72 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.78 2fwu n GLU 598 Cb 0.26 -1.32 -0.05 0.00 -0.02 0.00 0.00 31.44 30.30 2fwu n GLU 598 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 2fwu h MET 599 N 0.00 -0.28 -4.79 3.49 4.05 -1.91 -3.45 114.93 112.05 2fwu h MET 599 Ca 0.00 0.02 -0.36 0.00 -0.28 0.00 0.00 59.70 59.08 2fwu h MET 599 Cb 0.00 0.06 -0.14 0.00 -0.80 0.00 0.00 31.60 30.72 2fwu h MET 599 CO 0.00 -0.18 -0.58 -1.54 0.23 0.00 0.00 176.91 174.84 2fwu s SER 600 N -3.85 1.05 -1.84 1.39 1.04 -1.26 -4.87 113.70 105.36 2fwu s SER 600 Ca -0.08 -1.51 0.00 0.00 0.48 0.00 0.00 55.95 54.84 2fwu s SER 600 Cb 0.04 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.54 2fwu s SER 600 CO 0.33 -0.88 0.00 -0.62 0.98 0.00 0.00 173.24 173.05 2fwu n GLU 601 N -0.47 -1.53 -0.89 4.02 1.02 -1.26 -4.85 120.64 116.68 2fwu n GLU 601 Ca 0.02 1.04 -0.18 0.00 -0.02 0.00 0.00 57.16 58.03 2fwu n GLU 601 Cb 0.65 -5.57 0.10 0.00 -0.02 0.00 0.00 31.44 26.61 2fwu n GLU 601 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2fwu n LYS 602 N -2.76 1.92 -2.92 3.49 -0.00 -1.26 -4.67 118.16 111.97 2fwu n LYS 602 Ca -0.22 -2.08 -0.44 0.00 -0.00 0.00 0.00 58.31 55.57 2fwu n LYS 602 Cb 0.67 -1.82 -0.00 0.00 -0.00 0.00 0.00 35.03 33.88 2fwu n LYS 602 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2fwu s LYS 603 N -2.32 4.01 0.07 -1.58 1.02 -1.26 -4.13 119.74 115.55 2fwu s LYS 603 Ca 0.40 -2.41 0.00 0.00 0.02 0.00 0.00 55.97 53.97 2fwu s LYS 603 Cb 0.33 -5.07 0.00 0.00 -0.52 0.00 0.00 37.83 32.57 2fwu s LYS 603 CO 0.05 -1.80 0.00 0.41 -0.92 0.00 0.00 175.35 173.09 2fwu n GLY 604 N 4.41 -0.55 2.81 -3.33 0.00 -1.26 -3.83 105.19 103.44 2fwu n GLY 604 Ca 0.36 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.17 4.31 0.19 -0.02 0.00 -1.26 -4.90 105.19 103.35 2fwu n GLY 605 Ca 0.00 -2.65 0.06 0.00 0.00 0.00 0.00 46.02 43.43 2fwu n GLY 605 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2fwu h PHE 606 N 5.15 0.00 -2.92 1.61 3.57 -1.94 -3.44 116.94 118.98 2fwu h PHE 606 Ca 0.17 0.00 -0.53 0.00 3.53 0.00 0.00 57.97 61.14 2fwu h PHE 606 Cb 0.73 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.50 2fwu h PHE 606 CO 0.72 0.35 0.80 0.95 -2.23 0.00 0.00 178.31 178.89 2fwu s THR 607 N -3.69 3.13 -1.27 4.41 -4.23 -1.26 -4.91 115.64 107.83 2fwu s THR 607 Ca -0.00 0.78 -0.19 0.00 -1.18 0.00 0.00 61.69 61.10 2fwu s THR 607 Cb 0.11 -3.50 0.02 0.00 1.34 0.00 0.00 72.50 70.47 2fwu s THR 607 CO 0.68 0.05 1.88 -0.38 -0.54 0.00 0.00 174.62 176.30 2fwu n ILE 608 N 4.08 3.29 -1.43 2.99 2.08 -1.26 -3.83 119.36 125.27 2fwu n ILE 608 Ca 0.13 -3.30 0.00 0.00 0.56 0.00 0.00 62.75 60.13 2fwu n ILE 608 Cb 0.41 -2.35 0.00 0.00 -0.75 0.00 0.00 39.64 36.95 2fwu n ILE 608 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 2fwu n THR 609 N 6.45 0.00 -3.51 1.39 5.66 -1.26 -5.04 114.28 117.97 2fwu n THR 609 Ca 0.49 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 61.18 2fwu n THR 609 Cb 0.45 0.62 0.02 0.00 -1.55 0.00 0.00 70.33 69.87 2fwu n THR 609 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2fwu n GLU 610 N 0.00 -1.84 -0.85 1.09 0.28 -1.25 -4.88 120.64 113.19 2fwu n GLU 610 Ca 0.00 1.30 -0.10 0.00 -0.16 0.00 0.00 57.16 58.20 2fwu n GLU 610 Cb 0.52 -2.60 0.20 0.00 1.43 0.00 0.00 31.44 30.99 2fwu n GLU 610 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2fwu n GLU 611 N -0.97 2.67 -2.88 3.44 0.28 -1.26 -4.61 120.64 117.32 2fwu n GLU 611 Ca -0.13 -2.34 -0.44 0.00 -0.16 0.00 0.00 57.16 54.09 2fwu n GLU 611 Cb 0.66 -1.97 -0.01 0.00 1.43 0.00 0.00 31.44 31.56 2fwu n GLU 611 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2fwu s TYR 612 N -2.46 3.30 -2.36 -1.84 2.02 -1.26 -4.70 117.35 110.04 2fwu s TYR 612 Ca 0.43 -1.90 0.23 0.00 -0.37 0.00 0.00 57.07 55.46 2fwu s TYR 612 Cb 0.35 -4.39 0.81 0.00 -0.40 0.00 0.00 41.96 38.33 2fwu s TYR 612 CO 0.10 -1.49 1.59 -0.40 -1.57 0.00 0.00 175.55 173.78 2fwu n ASP 613 N 6.31 1.72 -4.55 2.29 5.75 -1.26 -4.86 116.55 121.95 2fwu n ASP 613 Ca 0.36 -1.67 -0.39 0.00 -0.01 0.00 0.00 54.79 53.09 2fwu n ASP 613 Cb 0.45 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.43 2fwu n ASP 613 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 2fwu s ASP 614 N -1.70 5.61 0.00 -1.12 -4.77 -1.26 -4.51 116.67 108.92 2fwu s ASP 614 Ca 0.34 -0.08 0.00 0.00 -3.30 0.00 0.00 52.55 49.51 2fwu s ASP 614 Cb 0.19 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.47 2fwu s ASP 614 CO 0.29 -2.19 0.75 0.29 0.70 0.00 0.00 175.17 175.01 2fwu n LYS 615 N 9.22 0.00 -3.78 2.11 5.02 -1.26 -5.07 118.16 124.39 2fwu n LYS 615 Ca 0.17 -0.57 -0.24 0.00 -2.02 0.00 0.00 58.31 55.65 2fwu n LYS 615 Cb 0.51 -0.30 -0.03 0.00 -0.02 0.00 0.00 35.03 35.19 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 0.00 2.36 0.99 1.97 1.11 -1.26 -5.13 119.66 119.70 2fwu s GLN 616 Ca 0.00 -1.78 -0.12 0.00 0.01 0.00 0.00 55.36 53.47 2fwu s GLN 616 Cb 0.00 -2.20 0.18 0.00 -1.01 0.00 0.00 33.01 29.98 2fwu s GLN 616 CO 0.00 -0.36 1.09 -1.25 0.01 0.00 0.00 175.29 174.78 2fwu s PRO 617 N -4.16 0.49 -0.57 2.91 0.04 -1.26 -4.67 135.00 127.78 2fwu s PRO 617 Ca 0.42 0.56 -0.28 0.00 0.04 0.00 0.00 61.00 61.74 2fwu s PRO 617 Cb -0.02 -1.74 0.02 0.00 0.04 0.00 0.00 34.50 32.80 2fwu s PRO 617 CO 0.25 -2.70 1.32 -0.51 0.04 0.00 0.00 177.00 175.39 2fwu s LEU 618 N -6.45 3.42 0.05 -3.56 2.01 -1.26 -4.92 118.68 107.98 2fwu s LEU 618 Ca 0.65 0.21 -0.27 0.00 0.01 0.00 0.00 54.13 54.73 2fwu s LEU 618 Cb -0.19 -3.11 0.09 0.00 0.01 0.00 0.00 46.19 43.00 2fwu s LEU 618 CO 0.58 -1.61 0.76 0.28 1.01 0.00 0.00 176.35 177.38 2fwu s THR 619 N 5.55 0.00 0.00 5.49 -1.32 -1.26 -5.04 115.64 119.06 2fwu s THR 619 Ca 0.48 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.96 2fwu s THR 619 Cb -0.09 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.90 2fwu s THR 619 CO 0.25 0.00 0.00 -1.54 -2.21 0.00 0.00 174.62 171.12 2fwu n SER 620 N -0.19 0.00 -1.35 8.08 3.41 -1.26 -4.96 113.62 117.35 2fwu n SER 620 Ca -0.13 -0.10 -0.16 0.00 -0.26 0.00 0.00 58.87 58.21 2fwu n SER 620 Cb 0.63 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.52 2fwu n SER 620 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2fwu n LYS 621 N 0.00 -1.17 -1.60 4.33 5.02 -1.26 -1.11 118.16 122.37 2fwu n LYS 621 Ca 0.00 1.04 -0.15 0.00 -2.02 0.00 0.00 58.31 57.17 2fwu n LYS 621 Cb 0.03 -5.26 -0.05 0.00 -0.02 0.00 0.00 35.03 29.72 2fwu n LYS 621 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2fwu n GLU 622 N -2.53 -1.09 -2.24 1.97 2.13 -1.26 -4.98 120.64 112.64 2fwu n GLU 622 Ca -0.17 0.98 -0.42 0.00 0.66 0.00 0.00 57.16 58.21 2fwu n GLU 622 Cb 0.55 -5.17 -0.03 0.00 0.27 0.00 0.00 31.44 27.07 2fwu n GLU 622 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2fwu s GLU 623 N -3.57 4.27 0.25 5.31 2.56 -0.27 -4.92 118.70 122.33 2fwu s GLU 623 Ca 0.00 1.93 -0.05 0.00 0.00 0.00 0.00 54.97 56.85 2fwu s GLU 623 Cb 0.00 -3.64 0.26 0.00 2.00 0.00 0.00 34.13 32.76 2fwu s GLU 623 CO 0.00 -0.61 1.86 1.49 -0.56 0.00 0.00 175.26 177.44 2fwu h GLU 624 N 8.03 1.18 0.00 4.30 4.81 -1.93 -2.54 114.58 128.42 2fwu h GLU 624 Ca -0.36 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 58.68 2fwu h GLU 624 Cb 1.17 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 2fwu h GLU 624 CO 0.91 0.88 -0.19 1.05 -0.73 0.00 0.00 179.01 180.93 2fwu h GLU 625 N 1.18 0.00 -0.24 1.92 -0.00 -1.96 0.26 114.58 115.73 2fwu h GLU 625 Ca 0.29 0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 59.52 2fwu h GLU 625 Cb 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.81 2fwu h GLU 625 CO -0.04 0.19 -0.36 -0.09 -0.00 0.00 0.00 179.01 178.71 2fwu h ARG 626 N 0.00 0.67 -0.36 1.06 1.12 -1.82 -2.48 114.38 112.57 2fwu h ARG 626 Ca -0.00 -0.40 -0.05 0.00 -1.11 0.00 0.00 59.98 58.42 2fwu h ARG 626 Cb 0.38 0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.36 2fwu h ARG 626 CO 0.03 1.02 0.03 0.00 -3.11 0.00 0.00 179.97 177.93 2fwu h ARG 627 N 0.39 0.55 -0.54 0.20 3.08 -0.67 -0.97 114.38 116.43 2fwu h ARG 627 Ca 0.02 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 2fwu h ARG 627 Cb 0.95 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 2fwu h ARG 627 CO 0.08 0.56 0.06 0.82 -1.07 0.00 0.00 179.97 180.42 2fwu h ILE 628 N 0.53 1.24 -0.06 2.04 2.04 -0.50 -2.42 117.51 120.39 2fwu h ILE 628 Ca 0.12 -0.96 -0.10 0.00 1.00 0.00 0.00 64.86 64.92 2fwu h ILE 628 Cb 0.30 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2fwu h ILE 628 CO 0.01 0.35 -0.43 0.00 0.00 0.00 0.00 178.15 178.07 2fwu h ALA 629 N 1.25 1.18 -0.01 1.87 0.00 -0.74 -2.18 119.26 120.62 2fwu h ALA 629 Ca 0.17 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2fwu h ALA 629 Cb 0.40 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2fwu h ALA 629 CO 0.01 0.58 0.00 0.39 0.00 0.00 0.00 179.25 180.23 2fwu n GLU 630 N -4.01 1.07 0.12 0.00 -0.58 -0.60 -1.92 120.64 114.72 2fwu n GLU 630 Ca -0.02 -0.11 -0.01 0.00 -0.42 0.00 0.00 57.16 56.61 2fwu n GLU 630 Cb 0.48 -1.36 0.03 0.00 -0.57 0.00 0.00 31.44 30.01 2fwu n GLU 630 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 2fwu h MET 631 N 0.23 0.00 0.02 3.49 4.05 -1.07 -3.21 114.93 118.44 2fwu h MET 631 Ca 0.00 0.00 -0.39 0.00 -0.28 0.00 0.00 59.70 59.03 2fwu h MET 631 Cb 0.05 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 30.79 2fwu h MET 631 CO 0.00 0.68 -2.24 0.41 0.23 0.00 0.00 176.91 175.99 2fwu n GLY 632 N 1.05 -0.50 3.78 1.39 0.00 -0.95 -2.46 105.19 107.50 2fwu n GLY 632 Ca 0.01 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 2fwu n GLY 632 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fwu s ARG 633 N -2.50 3.12 0.44 1.61 0.52 -0.81 -4.50 118.95 116.83 2fwu s ARG 633 Ca -0.33 1.46 -0.22 0.00 -0.52 0.00 0.00 55.73 56.12 2fwu s ARG 633 Cb 0.10 -1.99 -0.10 0.00 0.52 0.00 0.00 34.95 33.49 2fwu s ARG 633 CO 0.59 -1.01 1.00 -1.25 0.02 0.00 0.00 175.30 174.65 2fwu s PRO 634 N -3.72 4.08 0.06 3.54 0.04 -1.26 -3.06 135.00 134.68 2fwu s PRO 634 Ca 0.69 1.30 0.01 0.00 0.04 0.00 0.00 61.00 63.05 2fwu s PRO 634 Cb -0.21 -2.26 -0.00 0.00 0.04 0.00 0.00 34.50 32.06 2fwu s PRO 634 CO 0.34 -0.18 0.04 0.44 0.04 0.00 0.00 177.00 177.68 2fwu n ILE 635 N -0.57 0.00 -2.67 0.56 -5.35 -1.20 -4.45 119.36 105.68 2fwu n ILE 635 Ca 0.07 -0.44 -0.25 0.00 -0.27 0.00 0.00 62.75 61.87 2fwu n ILE 635 Cb 0.52 0.20 0.02 0.00 -1.74 0.00 0.00 39.64 38.64 2fwu n ILE 635 CO 0.00 0.00 0.00 -1.48 -1.76 0.00 0.00 176.55 173.31 2fwu s LEU 636 N 0.00 3.44 0.00 7.28 -0.00 -1.26 -2.99 118.68 125.15 2fwu s LEU 636 Ca 0.06 0.53 0.00 0.00 -0.00 0.00 0.00 54.13 54.72 2fwu s LEU 636 Cb 0.00 -3.39 0.00 0.00 -0.00 0.00 0.00 46.19 42.81 2fwu s LEU 636 CO 0.04 -0.88 0.00 0.61 -0.00 0.00 0.00 176.35 176.13 2fwu n GLY 637 N -2.34 1.72 0.48 -3.48 0.00 0.13 -4.45 105.19 97.25 2fwu n GLY 637 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 0.34 -3.79 1.61 4.07 -1.26 -4.94 120.64 116.67 2fwu n GLU 638 Ca 0.00 0.14 -0.25 0.00 -0.06 0.00 0.00 57.16 56.99 2fwu n GLU 638 Cb 0.00 -1.08 -0.17 0.00 -0.06 0.00 0.00 31.44 30.13 2fwu n GLU 638 CO 0.00 0.00 0.00 -3.38 -0.06 0.00 0.00 177.13 173.69 2fwu s HIS 639 N -2.41 0.99 -0.73 4.31 -3.43 -1.26 -5.06 115.29 107.71 2fwu s HIS 639 Ca -0.21 -0.56 -0.10 0.00 -0.80 0.00 0.00 55.06 53.39 2fwu s HIS 639 Cb 0.06 -0.98 0.19 0.00 -1.43 0.00 0.00 32.58 30.42 2fwu s HIS 639 CO 0.28 -0.47 0.63 0.95 -2.00 0.00 0.00 174.74 174.12 2fwu s THR 640 N 1.87 4.92 -0.29 -5.38 -4.23 -1.26 -2.85 115.64 108.41 2fwu s THR 640 Ca 0.03 -2.54 -0.16 0.00 -1.18 0.00 0.00 61.69 57.83 2fwu s THR 640 Cb -0.14 -4.10 0.17 0.00 1.34 0.00 0.00 72.50 69.77 2fwu s THR 640 CO -0.07 -0.96 1.05 -0.75 -0.54 0.00 0.00 174.62 173.35 2fwu s LYS 641 N 0.23 0.28 -0.22 3.99 2.36 -1.26 -4.69 119.74 120.42 2fwu s LYS 641 Ca 0.16 0.55 0.00 0.00 -2.55 0.00 0.00 55.97 54.14 2fwu s LYS 641 Cb -0.15 0.17 0.06 0.00 -1.05 0.00 0.00 37.83 36.86 2fwu s LYS 641 CO -0.06 -0.07 -0.05 -1.17 1.55 0.00 0.00 175.35 175.54 2fwu s LEU 642 N 1.68 2.38 -0.57 5.43 2.96 -0.02 -4.44 118.68 126.10 2fwu s LEU 642 Ca -0.06 -1.08 -0.21 0.00 -0.22 0.00 0.00 54.13 52.56 2fwu s LEU 642 Cb -0.04 -1.13 0.07 0.00 0.50 0.00 0.00 46.19 45.59 2fwu s LEU 642 CO -0.15 -0.22 0.80 -0.70 -1.32 0.00 0.00 176.35 174.76 2fwu s GLU 643 N 1.44 3.15 -0.42 1.98 2.12 0.10 -0.64 118.70 126.44 2fwu s GLU 643 Ca -0.05 -0.82 -0.20 0.00 0.36 0.00 0.00 54.97 54.27 2fwu s GLU 643 Cb -0.18 -4.16 0.02 0.00 0.26 0.00 0.00 34.13 30.07 2fwu s GLU 643 CO -0.07 -1.51 0.58 0.08 -0.54 0.00 0.00 175.26 173.80 2fwu s VAL 644 N 3.33 4.92 -0.19 3.70 1.01 -0.78 -1.10 120.40 131.28 2fwu s VAL 644 Ca 0.20 0.05 -0.17 0.00 0.00 0.00 0.00 61.98 62.06 2fwu s VAL 644 Cb -0.18 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2fwu s VAL 644 CO 0.12 -0.49 0.45 -0.63 0.00 0.00 0.00 175.10 174.55 2fwu s ILE 645 N 2.59 5.16 -0.14 2.22 1.09 0.22 -2.60 121.20 129.75 2fwu s ILE 645 Ca 0.20 0.83 -0.02 0.00 -1.10 0.00 0.00 60.65 60.55 2fwu s ILE 645 Cb -0.15 -3.78 -0.02 0.00 -1.06 0.00 0.00 42.46 37.45 2fwu s ILE 645 CO 0.17 0.24 -0.07 -0.63 -0.10 0.00 0.00 174.94 174.54 2fwu s ILE 646 N 1.32 3.62 0.13 2.92 1.09 -0.55 -1.38 121.20 128.36 2fwu s ILE 646 Ca 0.22 -0.46 0.05 0.00 -1.10 0.00 0.00 60.65 59.35 2fwu s ILE 646 Cb -0.15 -2.56 -0.04 0.00 -1.06 0.00 0.00 42.46 38.65 2fwu s ILE 646 CO 0.09 0.52 -0.11 -1.83 -0.10 0.00 0.00 174.94 173.50 2fwu s GLU 647 N 0.22 1.00 -0.10 2.79 -1.05 -1.24 -3.45 118.70 116.87 2fwu s GLU 647 Ca -0.04 -1.32 -0.33 0.00 -0.15 0.00 0.00 54.97 53.13 2fwu s GLU 647 Cb -0.14 -0.69 -0.10 0.00 -0.44 0.00 0.00 34.13 32.76 2fwu s GLU 647 CO 0.04 0.11 1.97 0.39 0.95 0.00 0.00 175.26 178.72 2fwu n GLU 648 N 0.19 2.23 -1.52 -4.83 4.71 -1.26 -2.94 120.64 117.23 2fwu n GLU 648 Ca -0.13 0.79 -0.35 0.00 -0.01 0.00 0.00 57.16 57.46 2fwu n GLU 648 Cb 0.59 -2.79 -0.13 0.00 -1.01 0.00 0.00 31.44 28.10 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 7.77 0.58 0.14 1.62 2.88 -1.26 -4.58 113.62 120.77 2fwu n SER 649 Ca 0.24 -0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2fwu n SER 649 Cb 0.34 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 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 11.53 -2.40 -4.00 0.66 9.36 -1.26 -4.90 117.16 126.15 2fwu n TYR 650 Ca 0.58 0.42 -0.21 0.00 3.32 0.00 0.00 57.90 62.02 2fwu n TYR 650 Cb 0.19 0.56 -0.03 0.00 -0.63 0.00 0.00 39.34 39.43 2fwu n TYR 650 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2fwu s GLU 651 N -1.97 3.20 -0.07 2.98 2.56 -1.26 -5.10 118.70 119.04 2fwu s GLU 651 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.97 54.07 2fwu s GLU 651 Cb 0.00 -2.74 0.02 0.00 2.00 0.00 0.00 34.13 33.41 2fwu s GLU 651 CO 0.00 0.39 -0.04 0.12 -0.56 0.00 0.00 175.26 175.17 2fwu s PHE 652 N -2.06 0.92 0.19 5.30 5.36 -1.26 -4.64 117.98 121.79 2fwu s PHE 652 Ca 0.34 -0.32 -0.10 0.00 -0.96 0.00 0.00 56.93 55.89 2fwu s PHE 652 Cb -0.08 -0.84 -0.01 0.00 -0.34 0.00 0.00 43.02 41.74 2fwu s PHE 652 CO 0.27 -0.30 0.34 0.15 -1.46 0.00 0.00 175.22 174.22 2fwu s LYS 653 N 1.34 1.26 -0.41 10.12 -0.14 -1.26 -5.04 119.74 125.61 2fwu s LYS 653 Ca -0.04 -1.19 0.02 0.00 -1.36 0.00 0.00 55.97 53.41 2fwu s LYS 653 Cb -0.14 0.40 0.19 0.00 -1.68 0.00 0.00 37.83 36.61 2fwu s LYS 653 CO -0.03 -0.48 0.80 0.45 -0.76 0.00 0.00 175.35 175.34 2fwu s SER 654 N -2.98 -1.10 0.03 2.83 0.15 -1.26 -0.36 113.70 111.01 2fwu s SER 654 Ca 0.19 -0.83 -0.30 0.00 0.70 0.00 0.00 55.95 55.70 2fwu s SER 654 Cb 0.02 1.42 -0.04 0.00 -1.71 0.00 0.00 66.02 65.72 2fwu s SER 654 CO 0.02 -0.09 0.97 0.28 1.20 0.00 0.00 173.24 175.62 2fwu s THR 655 N 1.52 4.76 0.35 6.45 -1.32 -1.18 -4.92 115.64 121.29 2fwu s THR 655 Ca 0.20 2.04 0.01 0.00 -1.21 0.00 0.00 61.69 62.73 2fwu s THR 655 Cb 0.01 -4.31 -0.03 0.00 -1.51 0.00 0.00 72.50 66.65 2fwu s THR 655 CO -0.09 0.21 0.55 0.68 -2.21 0.00 0.00 174.62 173.77 2fwu s VAL 656 N 0.69 5.02 0.00 5.08 -7.23 -1.26 -3.51 120.40 119.19 2fwu s VAL 656 Ca 0.50 -0.48 0.00 0.00 -1.81 0.00 0.00 61.98 60.19 2fwu s VAL 656 Cb -0.22 -3.83 0.00 0.00 0.56 0.00 0.00 36.38 32.89 2fwu s VAL 656 CO 0.28 -0.54 0.00 -0.67 -0.31 0.00 0.00 175.10 173.87