#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 2.88 -3.73 1.57 0.00 -1.26 -4.93 120.51 115.03 2fwu n ALA 502 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2fwu n ALA 502 Cb 0.00 0.05 0.03 0.00 0.00 0.00 0.00 19.45 19.52 2fwu n ALA 502 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fwu n GLY 503 N 1.65 1.11 3.02 0.00 0.00 -1.26 -4.37 105.19 105.34 2fwu n GLY 503 Ca 0.00 -1.25 -0.31 0.00 0.00 0.00 0.00 46.02 44.46 2fwu n GLY 503 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fwu s ILE 504 N -2.20 1.90 -0.28 -0.61 1.09 -1.26 -4.36 121.20 115.48 2fwu s ILE 504 Ca 0.15 -1.38 0.00 0.00 -1.10 0.00 0.00 60.65 58.32 2fwu s ILE 504 Cb -0.04 -2.03 0.08 0.00 -1.06 0.00 0.00 42.46 39.41 2fwu s ILE 504 CO 0.11 0.02 0.04 -0.36 -0.10 0.00 0.00 174.94 174.65 2fwu s PHE 505 N 1.24 2.18 0.16 3.97 0.08 -1.26 -1.39 117.98 122.96 2fwu s PHE 505 Ca -0.06 -1.85 -0.14 0.00 0.12 0.00 0.00 56.93 55.00 2fwu s PHE 505 Cb -0.19 -1.79 0.02 0.00 -0.57 0.00 0.00 43.02 40.49 2fwu s PHE 505 CO -0.06 -0.83 0.39 -0.08 -0.10 0.00 0.00 175.22 174.54 2fwu s THR 506 N 1.46 0.06 0.56 0.64 -1.32 -1.26 -0.07 115.64 115.70 2fwu s THR 506 Ca 0.04 -0.92 -0.00 0.00 -1.21 0.00 0.00 61.69 59.59 2fwu s THR 506 Cb -0.18 -1.50 0.03 0.00 -1.51 0.00 0.00 72.50 69.34 2fwu s THR 506 CO -0.14 -0.28 0.80 -0.36 -2.21 0.00 0.00 174.62 172.42 2fwu s PHE 507 N -3.88 2.95 -0.23 9.09 0.08 -1.04 -3.16 117.98 121.80 2fwu s PHE 507 Ca 0.09 0.13 0.08 0.00 0.12 0.00 0.00 56.93 57.35 2fwu s PHE 507 Cb 0.02 -2.74 -0.20 0.00 -0.57 0.00 0.00 43.02 39.52 2fwu s PHE 507 CO -0.06 -0.86 -0.09 -1.91 -0.10 0.00 0.00 175.22 172.20 2fwu n GLU 508 N -2.39 0.67 -4.63 0.44 2.13 -1.26 -4.78 120.64 110.81 2fwu n GLU 508 Ca 0.07 0.09 -0.33 0.00 0.66 0.00 0.00 57.16 57.64 2fwu n GLU 508 Cb 0.59 -1.53 -0.12 0.00 0.27 0.00 0.00 31.44 30.65 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 -2.51 3.12 0.36 5.31 1.03 -1.26 -4.99 118.70 119.76 2fwu s GLU 509 Ca -0.24 -0.59 0.24 0.00 0.03 0.00 0.00 54.97 54.40 2fwu s GLU 509 Cb 0.08 -2.66 0.41 0.00 -0.80 0.00 0.00 34.13 31.15 2fwu s GLU 509 CO 0.70 0.44 1.59 -1.00 -1.33 0.00 0.00 175.26 175.66 2fwu h PRO 510 N 5.98 0.00 -4.05 -4.83 0.13 -1.92 -3.44 132.00 123.87 2fwu h PRO 510 Ca -0.38 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.48 2fwu h PRO 510 Cb 1.18 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.04 2fwu h PRO 510 CO 0.56 0.00 -0.73 0.08 -0.23 0.00 0.00 178.00 177.67 2fwu s VAL 511 N -3.20 0.22 0.00 1.56 1.01 -1.26 0.21 120.40 118.94 2fwu s VAL 511 Ca 0.07 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.82 2fwu s VAL 511 Cb 0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 36.38 36.23 2fwu s VAL 511 CO 0.67 -0.02 -0.04 0.28 0.00 0.00 0.00 175.10 175.99 2fwu s THR 512 N -0.26 0.29 -0.17 3.92 -1.32 -0.29 -4.90 115.64 112.91 2fwu s THR 512 Ca -0.01 -0.22 -0.06 0.00 -1.21 0.00 0.00 61.69 60.19 2fwu s THR 512 Cb -0.02 -0.26 -0.04 0.00 -1.51 0.00 0.00 72.50 70.67 2fwu s THR 512 CO -0.00 0.04 0.02 -1.00 -2.21 0.00 0.00 174.62 171.47 2fwu s HIS 513 N -0.19 3.17 0.11 9.09 3.76 -1.26 -1.10 115.29 128.87 2fwu s HIS 513 Ca 0.00 -0.07 0.04 0.00 -0.15 0.00 0.00 55.06 54.89 2fwu s HIS 513 Cb -0.02 -2.03 -0.04 0.00 1.11 0.00 0.00 32.58 31.60 2fwu s HIS 513 CO -0.00 0.09 -0.10 0.14 -0.85 0.00 0.00 174.74 174.01 2fwu s VAL 514 N 0.35 1.03 0.37 -0.90 -7.23 -0.60 -4.98 120.40 108.44 2fwu s VAL 514 Ca 0.00 -1.75 -0.19 0.00 -1.81 0.00 0.00 61.98 58.23 2fwu s VAL 514 Cb -0.13 -1.50 -0.10 0.00 0.56 0.00 0.00 36.38 35.21 2fwu s VAL 514 CO 0.01 -0.59 0.86 -0.55 -0.31 0.00 0.00 175.10 174.52 2fwu s SER 515 N -2.63 6.92 0.00 4.85 0.15 -1.26 -1.38 113.70 120.35 2fwu s SER 515 Ca 0.09 1.54 0.29 0.00 0.70 0.00 0.00 55.95 58.56 2fwu s SER 515 Cb -0.02 -2.48 1.23 0.00 -1.71 0.00 0.00 66.02 63.05 2fwu s SER 515 CO 0.00 -0.25 1.89 1.21 1.20 0.00 0.00 173.24 177.29 2fwu n GLU 516 N -0.35 0.29 -0.30 5.44 2.13 0.53 -3.09 120.64 125.28 2fwu n GLU 516 Ca 0.05 -0.06 0.09 0.00 0.66 0.00 0.00 57.16 57.91 2fwu n GLU 516 Cb 0.53 -1.50 0.26 0.00 0.27 0.00 0.00 31.44 31.00 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 -1.31 3.16 -4.91 4.31 2.88 -1.26 -4.77 113.62 111.73 2fwu n SER 517 Ca 0.11 -2.00 -0.28 0.00 -1.33 0.00 0.00 58.87 55.36 2fwu n SER 517 Cb 0.30 -0.39 -0.03 0.00 -0.75 0.00 0.00 64.21 63.33 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 -1.21 5.00 -0.10 2.46 2.07 -1.18 -5.03 121.20 123.22 2fwu s ILE 518 Ca 0.39 0.07 -0.07 0.00 -1.41 0.00 0.00 60.65 59.64 2fwu s ILE 518 Cb 0.21 -3.75 -0.02 0.00 0.13 0.00 0.00 42.46 39.02 2fwu s ILE 518 CO 0.27 -0.38 -0.13 0.61 -1.91 0.00 0.00 174.94 173.39 2fwu n GLY 519 N -1.10 -0.77 3.18 1.50 0.00 -1.26 -4.36 105.19 102.38 2fwu n GLY 519 Ca -0.01 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2fwu n GLY 519 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fwu s ILE 520 N -1.87 2.65 -0.18 -0.61 -1.09 -1.26 -0.35 121.20 118.49 2fwu s ILE 520 Ca -0.11 -0.96 -0.14 0.00 -2.23 0.00 0.00 60.65 57.21 2fwu s ILE 520 Cb 0.02 -2.28 -0.05 0.00 -1.58 0.00 0.00 42.46 38.57 2fwu s ILE 520 CO 0.16 0.32 0.29 0.00 -1.23 0.00 0.00 174.94 174.48 2fwu s MET 521 N 1.32 4.22 -0.04 2.79 0.23 -0.32 -4.89 119.30 122.61 2fwu s MET 521 Ca 0.02 0.06 0.06 0.00 -1.03 0.00 0.00 55.69 54.80 2fwu s MET 521 Cb -0.15 -3.46 -0.02 0.00 -1.53 0.00 0.00 34.83 29.67 2fwu s MET 521 CO -0.07 0.17 -0.21 -1.21 -2.03 0.00 0.00 175.02 171.68 2fwu s GLU 522 N 0.68 2.40 -0.06 3.16 2.02 -1.25 -0.71 118.70 124.94 2fwu s GLU 522 Ca 0.16 -0.82 0.05 0.00 0.02 0.00 0.00 54.97 54.38 2fwu s GLU 522 Cb -0.13 -2.22 -0.01 0.00 0.10 0.00 0.00 34.13 31.87 2fwu s GLU 522 CO 0.04 0.54 -0.23 0.08 0.02 0.00 0.00 175.26 175.71 2fwu s VAL 523 N -0.54 1.94 0.45 2.63 1.01 -1.06 -4.92 120.40 119.91 2fwu s VAL 523 Ca 0.07 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 2fwu s VAL 523 Cb -0.11 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 2fwu s VAL 523 CO 0.01 0.54 0.69 -0.54 0.00 0.00 0.00 175.10 175.79 2fwu s LYS 524 N -0.04 3.19 0.01 2.72 1.02 -1.26 -1.03 119.74 124.35 2fwu s LYS 524 Ca -0.06 -0.32 0.05 0.00 0.02 0.00 0.00 55.97 55.66 2fwu s LYS 524 Cb -0.14 -2.52 -0.02 0.00 -0.52 0.00 0.00 37.83 34.63 2fwu s LYS 524 CO 0.04 -0.23 -0.15 0.08 -0.92 0.00 0.00 175.35 174.17 2fwu s VAL 525 N -2.58 1.21 0.23 3.17 1.01 -0.54 -4.66 120.40 118.24 2fwu s VAL 525 Ca 0.47 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 2fwu s VAL 525 Cb -0.10 -1.04 -0.09 0.00 0.00 0.00 0.00 36.38 35.16 2fwu s VAL 525 CO 0.39 0.24 0.99 -0.76 0.00 0.00 0.00 175.10 175.96 2fwu s LEU 526 N -0.64 4.60 0.02 3.92 2.01 -1.19 -3.88 118.68 123.52 2fwu s LEU 526 Ca 0.05 2.02 -0.15 0.00 0.01 0.00 0.00 54.13 56.06 2fwu s LEU 526 Cb -0.07 -3.61 -0.06 0.00 0.01 0.00 0.00 46.19 42.46 2fwu s LEU 526 CO 0.00 0.03 0.43 -0.60 1.01 0.00 0.00 176.35 177.22 2fwu s ARG 527 N -1.05 3.94 0.59 1.70 3.52 -1.26 -4.33 118.95 122.05 2fwu s ARG 527 Ca 0.43 0.44 -0.19 0.00 -0.13 0.00 0.00 55.73 56.28 2fwu s ARG 527 Cb -0.27 -3.20 -0.05 0.00 -1.56 0.00 0.00 34.95 29.87 2fwu s ARG 527 CO 0.34 0.67 0.99 -2.37 -0.81 0.00 0.00 175.30 174.12 2fwu n THR 528 N 1.71 3.62 0.54 4.11 5.66 -0.48 -4.80 114.28 124.63 2fwu n THR 528 Ca -0.13 -0.50 0.13 0.00 -3.05 0.00 0.00 64.05 60.50 2fwu n THR 528 Cb 0.52 -1.17 0.34 0.00 -1.55 0.00 0.00 70.33 68.47 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 0.61 0.00 -3.52 1.09 0.87 -1.90 -3.42 113.55 107.27 2fwu h SER 529 Ca -0.48 -0.01 -0.59 0.00 -1.23 0.00 0.00 61.79 59.48 2fwu h SER 529 Cb 1.36 0.00 -0.38 0.00 -0.44 0.00 0.00 62.40 62.94 2fwu h SER 529 CO 0.52 0.01 -0.78 -0.83 -0.53 0.00 0.00 176.83 175.21 2fwu s GLY 530 N -3.72 1.15 -0.46 5.77 0.00 -1.26 -5.00 107.32 103.81 2fwu s GLY 530 Ca 0.10 -1.17 0.03 0.00 0.00 0.00 0.00 44.72 43.68 2fwu s GLY 530 CO 0.62 1.00 0.90 0.00 0.00 0.00 0.00 173.10 175.63 2fwu n ALA 531 N 4.76 -2.32 -2.97 3.20 0.00 -1.26 -4.67 120.51 117.25 2fwu n ALA 531 Ca -0.12 -0.83 -0.44 0.00 0.00 0.00 0.00 53.44 52.05 2fwu n ALA 531 Cb 0.45 -2.00 -0.00 0.00 0.00 0.00 0.00 19.45 17.90 2fwu n ALA 531 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2fwu s ARG 532 N 0.76 4.03 0.00 0.00 1.81 -1.26 -4.12 118.95 120.17 2fwu s ARG 532 Ca 0.29 -2.52 0.00 0.00 -1.72 0.00 0.00 55.73 51.78 2fwu s ARG 532 Cb 0.11 -5.01 0.00 0.00 -0.45 0.00 0.00 34.95 29.60 2fwu s ARG 532 CO -0.12 -1.73 0.00 0.41 -0.68 0.00 0.00 175.30 173.18 2fwu n GLY 533 N 4.20 0.09 3.00 -3.53 0.00 -1.26 -4.96 105.19 102.73 2fwu n GLY 533 Ca 0.34 -0.25 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.19 -0.05 1.61 3.04 -1.26 -0.35 114.94 113.75 2fwu s ASN 534 Ca 0.00 0.41 0.03 0.00 0.04 0.00 0.00 52.86 53.34 2fwu s ASN 534 Cb 0.00 0.31 0.00 0.00 -1.54 0.00 0.00 41.25 40.02 2fwu s ASN 534 CO 0.00 -0.15 -0.14 -0.69 -3.04 0.00 0.00 177.10 173.09 2fwu s VAL 535 N 1.08 1.18 -0.22 -5.21 1.01 0.88 -0.11 120.40 119.01 2fwu s VAL 535 Ca -0.08 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 2fwu s VAL 535 Cb -0.10 -1.04 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 2fwu s VAL 535 CO -0.06 0.35 0.22 -0.63 0.00 0.00 0.00 175.10 174.98 2fwu s ILE 536 N 0.26 5.33 -0.34 2.22 -1.09 0.58 -0.37 121.20 127.79 2fwu s ILE 536 Ca -0.07 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.70 2fwu s ILE 536 Cb -0.12 -3.56 0.09 0.00 -1.58 0.00 0.00 42.46 37.29 2fwu s ILE 536 CO 0.02 0.34 0.07 -0.69 -1.23 0.00 0.00 174.94 173.46 2fwu s VAL 537 N 0.93 2.74 0.45 2.92 1.01 0.11 -0.54 120.40 128.02 2fwu s VAL 537 Ca 0.11 -1.96 -0.23 0.00 0.00 0.00 0.00 61.98 59.91 2fwu s VAL 537 Cb -0.13 -2.83 -0.08 0.00 0.00 0.00 0.00 36.38 33.34 2fwu s VAL 537 CO 0.04 -0.45 1.12 -2.16 0.00 0.00 0.00 175.10 173.65 2fwu s PRO 538 N 1.08 3.83 0.13 2.72 0.04 -1.26 0.22 135.00 141.75 2fwu s PRO 538 Ca 0.04 1.66 -0.13 0.00 0.04 0.00 0.00 61.00 62.61 2fwu s PRO 538 Cb -0.20 -2.38 0.02 0.00 0.04 0.00 0.00 34.50 31.98 2fwu s PRO 538 CO -0.05 -0.47 0.34 1.52 0.04 0.00 0.00 177.00 178.39 2fwu s TYR 539 N -1.63 0.01 -0.06 0.56 1.13 0.36 0.25 117.35 117.96 2fwu s TYR 539 Ca 0.63 -0.36 -0.24 0.00 -1.41 0.00 0.00 57.07 55.69 2fwu s TYR 539 Cb -0.25 0.14 0.05 0.00 -1.10 0.00 0.00 41.96 40.80 2fwu s TYR 539 CO 0.31 -0.69 0.53 -1.59 -2.51 0.00 0.00 175.55 171.60 2fwu s LYS 540 N -3.86 0.86 -0.22 -3.49 0.00 -0.74 -1.33 119.74 110.97 2fwu s LYS 540 Ca 0.07 0.17 -0.24 0.00 0.00 0.00 0.00 55.97 55.97 2fwu s LYS 540 Cb 0.02 0.40 -0.01 0.00 0.00 0.00 0.00 37.83 38.25 2fwu s LYS 540 CO -0.08 -0.24 0.79 0.95 0.00 0.00 0.00 175.35 176.76 2fwu s THR 541 N -1.03 4.88 -0.31 3.79 -4.23 -1.11 -2.72 115.64 114.91 2fwu s THR 541 Ca -0.10 1.49 -0.23 0.00 -1.18 0.00 0.00 61.69 61.67 2fwu s THR 541 Cb -0.02 -4.08 0.00 0.00 1.34 0.00 0.00 72.50 69.73 2fwu s THR 541 CO 0.07 -0.02 0.78 -0.63 -0.54 0.00 0.00 174.62 174.27 2fwu s ILE 542 N 2.57 4.80 0.23 2.99 1.09 0.13 -4.88 121.20 128.12 2fwu s ILE 542 Ca 0.34 1.14 -0.06 0.00 -1.10 0.00 0.00 60.65 60.96 2fwu s ILE 542 Cb -0.16 -4.14 0.18 0.00 -1.06 0.00 0.00 42.46 37.29 2fwu s ILE 542 CO 0.09 -0.25 1.79 -0.33 -0.10 0.00 0.00 174.94 176.14 2fwu h GLU 543 N 8.15 0.66 0.00 2.79 5.08 -1.86 -0.38 114.58 129.02 2fwu h GLU 543 Ca -0.25 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2fwu h GLU 543 Cb 1.10 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2fwu h GLU 543 CO 0.88 0.44 0.00 0.41 -1.00 0.00 0.00 179.01 179.74 2fwu n GLY 544 N -1.31 1.01 0.00 -3.84 0.00 -1.26 -0.91 105.19 98.88 2fwu n GLY 544 Ca 0.11 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -3.22 2.61 5.66 -1.17 -5.04 114.28 113.12 2fwu n THR 545 Ca 0.00 -0.39 -0.28 0.00 -3.05 0.00 0.00 64.05 60.33 2fwu n THR 545 Cb 0.00 1.17 -0.03 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 s ALA 546 N -0.16 3.57 -0.46 1.79 0.00 -0.09 -4.81 121.76 121.61 2fwu s ALA 546 Ca 0.00 -0.53 -0.19 0.00 0.00 0.00 0.00 51.96 51.24 2fwu s ALA 546 Cb 0.00 -2.36 0.04 0.00 0.00 0.00 0.00 23.12 20.79 2fwu s ALA 546 CO 0.00 0.14 0.56 0.50 0.00 0.00 0.00 175.76 176.96 2fwu s ARG 547 N -3.75 3.15 0.00 0.00 6.06 -1.26 -4.79 118.95 118.37 2fwu s ARG 547 Ca 0.45 -0.71 0.00 0.00 -2.50 0.00 0.00 55.73 52.97 2fwu s ARG 547 Cb -0.10 -4.01 0.00 0.00 0.06 0.00 0.00 34.95 30.89 2fwu s ARG 547 CO 0.32 -1.03 0.00 0.41 -2.50 0.00 0.00 175.30 172.50 2fwu n GLY 548 N 5.11 0.47 2.10 8.12 0.00 -1.26 -1.22 105.19 118.52 2fwu n GLY 548 Ca -0.06 -1.85 -0.01 0.00 0.00 0.00 0.00 46.02 44.11 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 0.47 0.54 -0.02 0.00 -1.17 -2.73 105.19 107.27 2fwu n GLY 549 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.59 0.74 0.00 -0.02 0.00 0.19 -4.81 105.19 98.70 2fwu n GLY 550 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 2fwu n GLY 550 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fwu h GLU 551 N 4.03 -0.01 0.00 1.61 4.57 -1.67 -3.43 114.58 119.69 2fwu h GLU 551 Ca 0.00 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 57.95 2fwu h GLU 551 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 2fwu h GLU 551 CO 0.00 -0.00 -1.87 -3.47 -1.18 0.00 0.00 179.01 172.49 2fwu n ASP 552 N -2.04 2.29 -4.14 1.04 -0.08 -0.35 -4.83 116.55 108.44 2fwu n ASP 552 Ca -0.00 -0.04 -0.11 0.00 -1.51 0.00 0.00 54.79 53.13 2fwu n ASP 552 Cb 0.00 0.37 -0.10 0.00 2.34 0.00 0.00 41.12 43.73 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 -2.31 0.82 -0.23 -0.67 -0.71 -0.83 -1.39 117.98 112.67 2fwu s PHE 553 Ca -0.12 -0.81 -0.22 0.00 -1.04 0.00 0.00 56.93 54.74 2fwu s PHE 553 Cb 0.04 -0.48 -0.02 0.00 -1.21 0.00 0.00 43.02 41.36 2fwu s PHE 553 CO 0.45 -0.14 0.69 -2.00 -1.34 0.00 0.00 175.22 172.88 2fwu s GLU 554 N -3.22 4.16 -0.70 1.99 -6.30 0.24 -0.64 118.70 114.23 2fwu s GLU 554 Ca 0.06 0.68 -0.27 0.00 -2.50 0.00 0.00 54.97 52.94 2fwu s GLU 554 Cb 0.01 -3.63 0.02 0.00 0.00 0.00 0.00 34.13 30.54 2fwu s GLU 554 CO -0.03 -0.39 1.34 0.34 0.02 0.00 0.00 175.26 176.54 2fwu s ASP 555 N 1.36 6.09 -0.60 -1.70 2.15 -1.26 -4.50 116.67 118.21 2fwu s ASP 555 Ca 0.29 -0.26 -0.16 0.00 0.43 0.00 0.00 52.55 52.85 2fwu s ASP 555 Cb -0.16 -2.56 0.14 0.00 -0.30 0.00 0.00 42.92 40.04 2fwu s ASP 555 CO 0.09 -1.85 0.60 0.28 -0.17 0.00 0.00 175.17 174.11 2fwu s THR 556 N 6.04 5.16 -0.15 1.71 -1.32 -1.26 -4.84 115.64 120.98 2fwu s THR 556 Ca 0.40 -1.51 -0.03 0.00 -1.21 0.00 0.00 61.69 59.35 2fwu s THR 556 Cb -0.09 -4.40 -0.02 0.00 -1.51 0.00 0.00 72.50 66.48 2fwu s THR 556 CO 0.17 -0.97 -0.06 0.00 -2.21 0.00 0.00 174.62 171.56 2fwu n GLY 558 N 3.54 -0.64 2.90 0.00 0.00 -0.44 -5.00 105.19 105.55 2fwu n GLY 558 Ca -0.18 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.14 0.52 -0.03 1.61 2.02 -1.26 -0.49 118.70 120.94 2fwu s GLU 559 Ca 0.00 -0.09 -0.22 0.00 0.02 0.00 0.00 54.97 54.68 2fwu s GLU 559 Cb 0.00 -0.56 -0.05 0.00 0.10 0.00 0.00 34.13 33.62 2fwu s GLU 559 CO 0.00 -0.02 0.64 -0.51 0.02 0.00 0.00 175.26 175.40 2fwu s LEU 560 N 0.52 4.37 -0.40 1.80 1.43 0.13 -4.89 118.68 121.65 2fwu s LEU 560 Ca -0.06 1.17 -0.10 0.00 -1.03 0.00 0.00 54.13 54.12 2fwu s LEU 560 Cb -0.09 -2.99 0.06 0.00 0.03 0.00 0.00 46.19 43.19 2fwu s LEU 560 CO -0.00 0.01 0.23 -0.70 0.23 0.00 0.00 176.35 176.11 2fwu s GLU 561 N 0.23 2.70 -0.18 1.70 2.12 -1.26 0.06 118.70 124.08 2fwu s GLU 561 Ca 0.34 -1.29 -0.09 0.00 0.36 0.00 0.00 54.97 54.29 2fwu s GLU 561 Cb -0.18 -3.75 -0.05 0.00 0.26 0.00 0.00 34.13 30.42 2fwu s GLU 561 CO 0.18 -0.83 0.12 0.12 -0.54 0.00 0.00 175.26 174.30 2fwu s PHE 562 N 1.48 3.43 0.35 5.30 2.19 0.50 -4.96 117.98 126.26 2fwu s PHE 562 Ca 0.02 0.34 0.09 0.00 0.33 0.00 0.00 56.93 57.72 2fwu s PHE 562 Cb -0.21 -2.09 -0.06 0.00 -1.31 0.00 0.00 43.02 39.34 2fwu s PHE 562 CO 0.04 0.38 -0.09 -0.65 1.83 0.00 0.00 175.22 176.73 2fwu s GLN 563 N 0.03 1.83 0.38 10.12 -0.21 -1.26 -0.08 119.66 130.47 2fwu s GLN 563 Ca 0.09 -1.93 0.07 0.00 0.02 0.00 0.00 55.36 53.61 2fwu s GLN 563 Cb -0.11 -1.72 0.77 0.00 1.00 0.00 0.00 33.01 32.95 2fwu s GLN 563 CO -0.00 0.14 1.96 -0.97 -2.12 0.00 0.00 175.29 174.29 2fwu h ASN 564 N 2.01 0.39 -0.00 5.90 -1.24 -0.84 -2.56 115.58 119.22 2fwu h ASN 564 Ca -0.42 -0.05 0.00 0.00 0.71 0.00 0.00 56.30 56.54 2fwu h ASN 564 Cb 1.25 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.20 2fwu h ASN 564 CO 0.70 0.41 -0.35 -0.67 -1.29 0.00 0.00 177.43 176.24 2fwu n ASP 565 N -4.36 2.18 -4.66 1.15 2.03 -1.26 -4.87 116.55 106.77 2fwu n ASP 565 Ca 0.01 -1.59 -0.35 0.00 0.52 0.00 0.00 54.79 53.38 2fwu n ASP 565 Cb 0.18 0.35 -0.09 0.00 -0.72 0.00 0.00 41.12 40.84 2fwu n ASP 565 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2fwu s GLU 566 N -2.37 3.99 0.03 -0.67 2.12 -0.97 -5.08 118.70 115.76 2fwu s GLU 566 Ca 0.21 -0.32 0.04 0.00 0.36 0.00 0.00 54.97 55.27 2fwu s GLU 566 Cb 0.19 -3.25 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 2fwu s GLU 566 CO 0.51 0.30 -0.09 0.96 -0.54 0.00 0.00 175.26 176.39 2fwu s ILE 567 N 0.31 3.47 0.44 -3.70 -5.25 -1.26 -4.24 121.20 110.97 2fwu s ILE 567 Ca 0.04 -0.92 0.00 0.00 -0.99 0.00 0.00 60.65 58.79 2fwu s ILE 567 Cb -0.12 -2.52 0.00 0.00 2.95 0.00 0.00 42.46 42.77 2fwu s ILE 567 CO -0.00 0.34 0.00 0.55 -1.79 0.00 0.00 174.94 174.04 2fwu n VAL 568 N 1.42 -5.57 -4.43 8.37 3.14 -1.26 -5.04 118.33 114.95 2fwu n VAL 568 Ca -0.15 2.58 -0.25 0.00 -2.96 0.00 0.00 64.34 63.56 2fwu n VAL 568 Cb 0.52 -3.40 -0.09 0.00 -1.06 0.00 0.00 33.84 29.81 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 -2.58 1.95 -0.03 1.45 -0.14 -1.25 -4.93 119.74 114.20 2fwu s LYS 569 Ca 0.00 -1.80 0.02 0.00 -1.36 0.00 0.00 55.97 52.83 2fwu s LYS 569 Cb 0.00 -1.84 0.01 0.00 -1.68 0.00 0.00 37.83 34.32 2fwu s LYS 569 CO 0.00 0.17 -0.08 0.95 -0.76 0.00 0.00 175.35 175.63 2fwu s THR 570 N -2.54 0.73 -0.55 2.17 -4.23 -1.25 -1.47 115.64 108.49 2fwu s THR 570 Ca 0.33 -0.31 -0.21 0.00 -1.18 0.00 0.00 61.69 60.33 2fwu s THR 570 Cb -0.00 -0.67 0.06 0.00 1.34 0.00 0.00 72.50 73.23 2fwu s THR 570 CO 0.18 0.24 0.78 -0.63 -0.54 0.00 0.00 174.62 174.64 2fwu s ILE 571 N 0.37 4.65 -0.39 2.99 1.09 -0.20 -4.88 121.20 124.82 2fwu s ILE 571 Ca -0.06 -0.33 -0.20 0.00 -1.10 0.00 0.00 60.65 58.96 2fwu s ILE 571 Cb -0.10 -4.45 0.01 0.00 -1.06 0.00 0.00 42.46 36.86 2fwu s ILE 571 CO 0.01 -1.04 0.61 -0.44 -0.10 0.00 0.00 174.94 173.98 2fwu s SER 572 N 3.02 6.36 -0.18 3.58 0.01 -1.26 -2.57 113.70 122.66 2fwu s SER 572 Ca 0.20 -0.11 -0.01 0.00 1.31 0.00 0.00 55.95 57.34 2fwu s SER 572 Cb -0.18 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.75 2fwu s SER 572 CO 0.13 -0.65 -0.13 -0.69 0.41 0.00 0.00 173.24 172.31 2fwu s VAL 573 N 2.68 2.71 -0.21 3.43 1.01 0.11 -4.94 120.40 125.20 2fwu s VAL 573 Ca 0.22 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 61.18 2fwu s VAL 573 Cb -0.15 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.06 2fwu s VAL 573 CO 0.16 0.49 1.03 -0.75 0.00 0.00 0.00 175.10 176.04 2fwu s LYS 574 N 1.19 4.28 -0.11 2.72 2.47 -1.26 -1.18 119.74 127.85 2fwu s LYS 574 Ca 0.02 1.36 -0.15 0.00 -1.56 0.00 0.00 55.97 55.63 2fwu s LYS 574 Cb -0.14 -3.63 -0.05 0.00 -1.46 0.00 0.00 37.83 32.55 2fwu s LYS 574 CO -0.05 -0.59 0.37 0.08 0.16 0.00 0.00 175.35 175.32 2fwu s VAL 575 N 3.03 5.22 0.45 4.02 1.01 0.53 -0.60 120.40 134.07 2fwu s VAL 575 Ca 0.44 0.73 -0.04 0.00 0.00 0.00 0.00 61.98 63.11 2fwu s VAL 575 Cb -0.15 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2fwu s VAL 575 CO 0.08 0.41 0.73 -0.63 0.00 0.00 0.00 175.10 175.69 2fwu s ILE 576 N 0.16 4.95 -0.23 2.22 -1.09 -0.48 -4.67 121.20 122.06 2fwu s ILE 576 Ca 0.21 0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.39 2fwu s ILE 576 Cb -0.14 -3.87 -0.02 0.00 -1.58 0.00 0.00 42.46 36.85 2fwu s ILE 576 CO 0.08 -0.79 1.51 -1.81 -1.23 0.00 0.00 174.94 172.71 2fwu s ASP 577 N -4.09 6.50 0.49 3.58 1.01 -1.26 -4.82 116.67 118.07 2fwu s ASP 577 Ca 0.46 1.53 -0.24 0.00 0.71 0.00 0.00 52.55 55.01 2fwu s ASP 577 Cb -0.10 -2.53 -0.07 0.00 1.01 0.00 0.00 42.92 41.23 2fwu s ASP 577 CO 0.43 -1.17 1.38 -0.62 0.21 0.00 0.00 175.17 175.40 2fwu s ASP 578 N 3.70 5.65 -0.22 0.27 2.15 -1.26 -4.96 116.67 122.00 2fwu s ASP 578 Ca 0.66 2.82 -0.18 0.00 0.43 0.00 0.00 52.55 56.28 2fwu s ASP 578 Cb -0.23 -2.64 -0.18 0.00 -0.30 0.00 0.00 42.92 39.57 2fwu s ASP 578 CO 0.27 -1.32 0.10 -0.62 -0.17 0.00 0.00 175.17 173.43 2fwu n GLU 579 N -0.54 0.59 0.00 4.34 4.71 -1.26 -5.04 120.64 123.44 2fwu n GLU 579 Ca 0.07 0.48 0.00 0.00 -0.01 0.00 0.00 57.16 57.70 2fwu n GLU 579 Cb 0.43 -1.69 0.00 0.00 -1.01 0.00 0.00 31.44 29.18 2fwu n GLU 579 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 2fwu n GLU 580 N -4.30 2.58 -4.21 3.49 0.00 -1.26 -5.15 120.64 111.79 2fwu n GLU 580 Ca -0.37 0.00 -0.28 0.00 0.00 0.00 0.00 57.16 56.50 2fwu n GLU 580 Cb 0.76 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 32.11 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 1.29 2.81 0.24 -1.84 1.13 -1.26 -5.14 117.35 114.58 2fwu s TYR 581 Ca 0.00 -0.14 0.05 0.00 -1.41 0.00 0.00 57.07 55.57 2fwu s TYR 581 Cb 0.00 -1.41 -0.05 0.00 -1.10 0.00 0.00 41.96 39.39 2fwu s TYR 581 CO 0.00 0.48 -0.03 -1.21 -2.51 0.00 0.00 175.55 172.27 2fwu s GLU 582 N -2.56 1.40 0.00 -3.49 8.01 -1.26 -5.15 118.70 115.65 2fwu s GLU 582 Ca 0.25 -1.70 0.00 0.00 0.01 0.00 0.00 54.97 53.52 2fwu s GLU 582 Cb -0.10 -0.83 0.00 0.00 -4.31 0.00 0.00 34.13 28.88 2fwu s GLU 582 CO 0.16 -0.03 0.00 1.63 0.01 0.00 0.00 175.26 177.03 2fwu n LYS 583 N -0.47 3.05 -1.59 1.61 4.01 -1.26 -4.90 118.16 118.61 2fwu n LYS 583 Ca -0.06 0.00 -0.45 0.00 -0.51 0.00 0.00 58.31 57.30 2fwu n LYS 583 Cb 0.63 0.00 -0.04 0.00 -0.51 0.00 0.00 35.03 35.11 2fwu n LYS 583 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2fwu n ASN 584 N 0.00 3.26 -3.93 4.39 2.85 -1.26 -4.91 115.26 115.66 2fwu n ASN 584 Ca 0.00 0.45 -0.28 0.00 -0.11 0.00 0.00 54.58 54.64 2fwu n ASN 584 Cb 0.00 -1.48 -0.17 0.00 1.24 0.00 0.00 39.78 39.37 2fwu n ASN 584 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 2fwu s LYS 585 N 5.73 1.66 -0.06 1.20 2.36 -1.26 -4.94 119.74 124.43 2fwu s LYS 585 Ca 0.99 -0.39 -0.16 0.00 -2.55 0.00 0.00 55.97 53.87 2fwu s LYS 585 Cb -0.48 -1.81 0.03 0.00 -1.05 0.00 0.00 37.83 34.52 2fwu s LYS 585 CO 0.41 -0.30 0.36 -0.08 1.55 0.00 0.00 175.35 177.28 2fwu s THR 586 N 1.64 0.04 0.10 3.43 -1.32 -1.26 -2.05 115.64 116.22 2fwu s THR 586 Ca 0.04 -0.29 0.07 0.00 -1.21 0.00 0.00 61.69 60.30 2fwu s THR 586 Cb -0.13 -0.62 -0.03 0.00 -1.51 0.00 0.00 72.50 70.20 2fwu s THR 586 CO -0.09 -0.16 -0.19 0.72 -2.21 0.00 0.00 174.62 172.70 2fwu s PHE 587 N -0.84 1.64 -0.08 9.09 -0.12 -1.11 -3.04 117.98 123.51 2fwu s PHE 587 Ca -0.09 -0.44 -0.01 0.00 -0.05 0.00 0.00 56.93 56.34 2fwu s PHE 587 Cb -0.04 -0.89 -0.03 0.00 -0.63 0.00 0.00 43.02 41.42 2fwu s PHE 587 CO 0.04 0.18 -0.03 -0.06 -0.05 0.00 0.00 175.22 175.30 2fwu s PHE 588 N -1.30 3.07 -0.13 3.49 0.08 -0.15 -1.41 117.98 121.63 2fwu s PHE 588 Ca 0.05 0.10 -0.03 0.00 0.12 0.00 0.00 56.93 57.17 2fwu s PHE 588 Cb -0.09 -1.77 -0.03 0.00 -0.57 0.00 0.00 43.02 40.55 2fwu s PHE 588 CO 0.04 0.38 -0.02 -1.17 -0.10 0.00 0.00 175.22 174.35 2fwu s LEU 589 N -0.76 3.41 -0.05 -0.37 1.98 0.58 0.18 118.68 123.64 2fwu s LEU 589 Ca 0.12 -0.00 -0.03 0.00 -2.89 0.00 0.00 54.13 51.32 2fwu s LEU 589 Cb -0.11 -1.80 0.02 0.00 0.66 0.00 0.00 46.19 44.95 2fwu s LEU 589 CO 0.02 0.26 0.12 -0.70 -1.89 0.00 0.00 176.35 174.16 2fwu s GLU 590 N -0.18 0.11 0.29 1.98 2.12 -1.10 -1.20 118.70 120.72 2fwu s GLU 590 Ca 0.04 0.21 0.06 0.00 0.36 0.00 0.00 54.97 55.65 2fwu s GLU 590 Cb -0.13 -0.01 -0.02 0.00 0.26 0.00 0.00 34.13 34.23 2fwu s GLU 590 CO 0.02 -0.06 0.36 0.96 -0.54 0.00 0.00 175.26 176.00 2fwu s ILE 591 N 0.39 4.47 0.00 -3.70 -4.36 -1.26 -1.79 121.20 114.95 2fwu s ILE 591 Ca -0.03 -1.12 0.00 0.00 -0.26 0.00 0.00 60.65 59.24 2fwu s ILE 591 Cb -0.04 -3.53 0.00 0.00 1.25 0.00 0.00 42.46 40.14 2fwu s ILE 591 CO -0.02 -0.25 0.00 0.61 0.24 0.00 0.00 174.94 175.52 2fwu n GLY 592 N -1.44 4.63 3.65 6.27 0.00 0.14 -4.88 105.19 113.56 2fwu n GLY 592 Ca -0.05 -2.08 -0.43 0.00 0.00 0.00 0.00 46.02 43.47 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 0.74 4.03 0.43 1.61 2.12 0.13 -4.64 118.70 123.12 2fwu s GLU 593 Ca 0.00 2.00 -0.23 0.00 0.36 0.00 0.00 54.97 57.10 2fwu s GLU 593 Cb 0.00 -4.01 -0.08 0.00 0.26 0.00 0.00 34.13 30.30 2fwu s GLU 593 CO 0.00 -1.02 1.09 -1.25 -0.54 0.00 0.00 175.26 173.54 2fwu s PRO 594 N 4.29 3.98 -0.05 4.30 0.04 -1.26 -4.50 135.00 141.80 2fwu s PRO 594 Ca 0.73 1.59 0.03 0.00 0.04 0.00 0.00 61.00 63.39 2fwu s PRO 594 Cb -0.30 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 31.80 2fwu s PRO 594 CO 0.29 -0.32 -0.14 -0.98 0.04 0.00 0.00 177.00 175.89 2fwu s ARG 595 N -2.65 1.58 0.10 4.56 1.70 0.29 -4.04 118.95 120.50 2fwu s ARG 595 Ca 0.61 -0.48 -0.30 0.00 -0.47 0.00 0.00 55.73 55.09 2fwu s ARG 595 Cb -0.24 -1.36 -0.06 0.00 -0.57 0.00 0.00 34.95 32.72 2fwu s ARG 595 CO 0.29 0.14 1.19 -1.17 -1.08 0.00 0.00 175.30 174.68 2fwu s LEU 596 N 0.27 4.40 -1.56 -1.89 1.98 -1.26 -0.30 118.68 120.32 2fwu s LEU 596 Ca -0.07 2.07 -0.10 0.00 -2.89 0.00 0.00 54.13 53.14 2fwu s LEU 596 Cb -0.12 -3.59 -0.04 0.00 0.66 0.00 0.00 46.19 43.10 2fwu s LEU 596 CO 0.02 -0.42 2.78 0.52 -1.89 0.00 0.00 176.35 177.37 2fwu n VAL 597 N 3.43 4.34 -0.12 1.68 0.31 0.85 -4.71 118.33 124.11 2fwu n VAL 597 Ca 0.07 -2.89 0.00 0.00 -0.01 0.00 0.00 64.34 61.51 2fwu n VAL 597 Cb 0.46 -2.54 0.00 0.00 -0.91 0.00 0.00 33.84 30.85 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 3.65 0.00 -1.36 5.55 1.02 -1.26 -2.94 120.64 125.30 2fwu n GLU 598 Ca 0.73 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.74 2fwu n GLU 598 Cb 0.25 -3.93 -0.05 0.00 -0.02 0.00 0.00 31.44 27.69 2fwu n GLU 598 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2fwu n MET 599 N -1.89 -0.97 -3.57 3.49 2.81 -1.26 -4.90 117.12 110.83 2fwu n MET 599 Ca 0.00 0.92 -0.12 0.00 -1.81 0.00 0.00 57.70 56.69 2fwu n MET 599 Cb 0.00 -4.99 -0.05 0.00 -0.71 0.00 0.00 33.22 27.47 2fwu n MET 599 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2fwu s SER 600 N -2.78 -0.45 0.38 7.83 0.15 -1.15 -5.04 113.70 112.63 2fwu s SER 600 Ca 0.00 0.52 0.16 0.00 0.70 0.00 0.00 55.95 57.33 2fwu s SER 600 Cb 0.00 0.40 0.76 0.00 -1.71 0.00 0.00 66.02 65.47 2fwu s SER 600 CO 0.00 -0.40 1.80 -0.33 1.20 0.00 0.00 173.24 175.52 2fwu h GLU 601 N 2.78 0.00 -3.37 5.44 5.08 -1.91 -3.43 114.58 119.18 2fwu h GLU 601 Ca -0.21 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.00 2fwu h GLU 601 Cb 1.16 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.19 2fwu h GLU 601 CO 0.32 0.37 -0.46 0.15 -1.00 0.00 0.00 179.01 178.39 2fwu s LYS 602 N -3.95 0.43 -1.14 2.33 1.02 -1.26 -4.95 119.74 112.23 2fwu s LYS 602 Ca -0.02 -0.17 -0.19 0.00 0.02 0.00 0.00 55.97 55.61 2fwu s LYS 602 Cb 0.13 0.19 0.09 0.00 -0.52 0.00 0.00 37.83 37.71 2fwu s LYS 602 CO 0.70 -0.10 1.51 0.15 -0.92 0.00 0.00 175.35 176.69 2fwu s LYS 603 N -0.92 3.81 -0.03 1.68 1.02 -1.26 -4.70 119.74 119.34 2fwu s LYS 603 Ca -0.10 -1.74 0.20 0.00 0.02 0.00 0.00 55.97 54.35 2fwu s LYS 603 Cb -0.05 -5.32 0.62 0.00 -0.52 0.00 0.00 37.83 32.55 2fwu s LYS 603 CO 0.02 -2.11 1.52 0.41 -0.92 0.00 0.00 175.35 174.27 2fwu n GLY 604 N 5.76 2.64 0.07 -3.33 0.00 -1.26 -4.35 105.19 104.72 2fwu n GLY 604 Ca 0.38 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 2fwu n GLY 604 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2fwu h GLY 605 N 3.87 0.00 -3.89 -0.02 0.00 -2.04 -3.49 103.07 97.50 2fwu h GLY 605 Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 47.33 47.55 2fwu h GLY 605 CO 0.06 0.00 0.75 -0.12 0.00 0.00 0.00 176.54 177.23 2fwu s PHE 606 N -2.03 -0.17 0.16 5.60 5.36 -1.26 -5.14 117.98 120.50 2fwu s PHE 606 Ca -0.14 0.15 -0.30 0.00 -0.96 0.00 0.00 56.93 55.68 2fwu s PHE 606 Cb 0.00 0.51 -0.07 0.00 -0.34 0.00 0.00 43.02 43.12 2fwu s PHE 606 CO 0.37 -0.25 1.13 0.95 -1.46 0.00 0.00 175.22 175.96 2fwu s THR 607 N -2.24 3.85 0.29 0.12 -4.23 -1.26 -4.96 115.64 107.20 2fwu s THR 607 Ca 0.08 1.54 0.03 0.00 -1.18 0.00 0.00 61.69 62.16 2fwu s THR 607 Cb -0.01 -3.99 -0.03 0.00 1.34 0.00 0.00 72.50 69.82 2fwu s THR 607 CO -0.05 0.24 0.44 -0.63 -0.54 0.00 0.00 174.62 174.08 2fwu s ILE 608 N -0.02 5.10 -1.00 2.99 -1.09 -1.26 -4.99 121.20 120.94 2fwu s ILE 608 Ca 0.51 -0.79 -0.23 0.00 -2.23 0.00 0.00 60.65 57.90 2fwu s ILE 608 Cb -0.30 -3.82 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 2fwu s ILE 608 CO 0.34 -0.40 1.75 -0.89 -1.23 0.00 0.00 174.94 174.52 2fwu s THR 609 N -2.13 3.67 -0.27 2.92 2.01 -1.26 -4.69 115.64 115.90 2fwu s THR 609 Ca 0.37 -0.67 0.22 0.00 0.31 0.00 0.00 61.69 61.93 2fwu s THR 609 Cb -0.09 -4.52 0.06 0.00 0.01 0.00 0.00 72.50 67.96 2fwu s THR 609 CO 0.32 -1.38 1.15 1.05 -0.69 0.00 0.00 174.62 175.06 2fwu h GLU 610 N 10.36 0.00 -6.27 4.92 4.11 -2.02 -3.48 114.58 122.20 2fwu h GLU 610 Ca 0.17 0.00 -0.46 0.00 0.07 0.00 0.00 59.36 59.14 2fwu h GLU 610 Cb 0.99 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 2fwu h GLU 610 CO 1.31 0.01 -0.80 0.39 0.07 0.00 0.00 179.01 179.98 2fwu n GLU 611 N -2.77 -4.95 -2.35 1.06 1.02 -1.26 -3.60 120.64 107.79 2fwu n GLU 611 Ca 0.01 0.57 -0.03 0.00 -0.02 0.00 0.00 57.16 57.69 2fwu n GLU 611 Cb 0.55 -5.25 0.00 0.00 -0.02 0.00 0.00 31.44 26.72 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 -4.49 -2.45 -3.08 -0.32 4.02 -1.26 -5.00 117.16 104.58 2fwu n TYR 612 Ca -0.12 1.03 -0.41 0.00 -0.01 0.00 0.00 57.90 58.39 2fwu n TYR 612 Cb 0.60 -3.19 -0.06 0.00 -0.02 0.00 0.00 39.34 36.67 2fwu n TYR 612 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2fwu s ASP 613 N -1.63 6.53 0.00 7.72 2.15 -1.24 -5.01 116.67 125.18 2fwu s ASP 613 Ca 0.09 0.47 0.00 0.00 0.43 0.00 0.00 52.55 53.54 2fwu s ASP 613 Cb -0.03 -2.35 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 2fwu s ASP 613 CO 0.51 -0.51 0.00 -0.67 -0.17 0.00 0.00 175.17 174.33 2fwu n ASP 614 N 5.95 0.25 -3.60 -0.34 -0.08 -1.26 -5.12 116.55 112.35 2fwu n ASP 614 Ca -0.00 -0.44 -0.28 0.00 -1.51 0.00 0.00 54.79 52.56 2fwu n ASP 614 Cb 0.49 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.83 2fwu n ASP 614 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 2fwu s LYS 615 N -0.31 1.22 0.05 -0.67 -2.85 -1.26 -4.91 119.74 111.01 2fwu s LYS 615 Ca 0.00 -2.11 0.00 0.00 -1.00 0.00 0.00 55.97 52.86 2fwu s LYS 615 Cb 0.00 -2.05 0.01 0.00 -2.06 0.00 0.00 37.83 33.73 2fwu s LYS 615 CO 0.00 -1.25 0.07 1.04 0.10 0.00 0.00 175.35 175.31 2fwu n GLN 616 N 3.20 0.78 -2.54 1.78 6.02 -1.26 -4.69 117.38 120.67 2fwu n GLN 616 Ca 0.17 -0.24 -0.27 0.00 -0.01 0.00 0.00 57.00 56.64 2fwu n GLN 616 Cb 0.39 -0.04 0.01 0.00 1.02 0.00 0.00 30.24 31.62 2fwu n GLN 616 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2fwu s PRO 617 N -2.40 3.44 -0.68 -1.09 0.04 -1.26 0.20 135.00 133.27 2fwu s PRO 617 Ca 0.05 0.20 -0.27 0.00 0.04 0.00 0.00 61.00 61.03 2fwu s PRO 617 Cb -0.00 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.20 2fwu s PRO 617 CO 0.03 -0.31 1.61 -0.51 0.04 0.00 0.00 177.00 177.86 2fwu s LEU 618 N -4.81 3.23 -0.26 -3.56 2.01 -1.26 -4.75 118.68 109.27 2fwu s LEU 618 Ca 0.49 -0.03 -0.03 0.00 0.01 0.00 0.00 54.13 54.57 2fwu s LEU 618 Cb -0.10 -2.54 0.09 0.00 0.01 0.00 0.00 46.19 43.64 2fwu s LEU 618 CO 0.46 -2.15 0.09 0.42 1.01 0.00 0.00 176.35 176.18 2fwu s THR 619 N 7.64 0.43 -0.34 5.49 -4.23 -1.26 -5.08 115.64 118.29 2fwu s THR 619 Ca 0.53 -0.90 -0.06 0.00 -1.18 0.00 0.00 61.69 60.08 2fwu s THR 619 Cb -0.10 -1.22 0.04 0.00 1.34 0.00 0.00 72.50 72.56 2fwu s THR 619 CO 0.18 -0.54 0.10 -0.44 -0.54 0.00 0.00 174.62 173.38 2fwu s SER 620 N 1.86 5.31 0.00 3.99 0.01 -1.26 -4.98 113.70 118.63 2fwu s SER 620 Ca 0.06 -1.14 0.00 0.00 1.31 0.00 0.00 55.95 56.18 2fwu s SER 620 Cb -0.17 -1.87 0.00 0.00 0.21 0.00 0.00 66.02 64.20 2fwu s SER 620 CO -0.23 -0.33 0.00 1.17 0.41 0.00 0.00 173.24 174.26 2fwu n LYS 621 N 4.81 0.00 0.16 12.44 0.00 -1.26 -4.54 118.16 129.77 2fwu n LYS 621 Ca -0.12 0.15 0.04 0.00 0.00 0.00 0.00 58.31 58.38 2fwu n LYS 621 Cb 0.45 -0.59 0.17 0.00 0.00 0.00 0.00 35.03 35.05 2fwu n LYS 621 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2fwu h GLU 622 N 0.00 0.00 0.00 1.64 4.39 -2.03 -3.47 114.58 115.11 2fwu h GLU 622 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2fwu h GLU 622 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2fwu h GLU 622 CO 0.00 0.46 0.00 0.39 -1.16 0.00 0.00 179.01 178.70 2fwu n GLU 623 N -3.37 0.00 0.17 2.33 1.02 -1.26 -4.77 120.64 114.76 2fwu n GLU 623 Ca 0.01 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.01 2fwu n GLU 623 Cb 0.63 -0.14 -0.08 0.00 -0.02 0.00 0.00 31.44 31.83 2fwu n GLU 623 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2fwu h GLU 624 N 0.00 -0.70 0.00 3.49 5.08 -1.98 0.22 114.58 120.69 2fwu h GLU 624 Ca 0.00 0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.31 2fwu h GLU 624 Cb 0.00 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2fwu h GLU 624 CO 0.00 -0.47 -0.48 0.93 -1.00 0.00 0.00 179.01 178.00 2fwu h GLU 625 N -0.73 0.00 -0.24 2.33 5.08 -2.02 -3.01 114.58 115.99 2fwu h GLU 625 Ca -0.03 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 2fwu h GLU 625 Cb 0.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2fwu h GLU 625 CO -0.14 0.48 -0.24 -0.09 -1.00 0.00 0.00 179.01 178.01 2fwu h ARG 626 N 0.00 0.46 -0.30 2.33 9.65 -1.86 -2.58 114.38 122.09 2fwu h ARG 626 Ca -0.00 -0.17 0.09 0.00 -1.10 0.00 0.00 59.98 58.79 2fwu h ARG 626 Cb 1.18 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.71 2fwu h ARG 626 CO 0.06 0.67 0.23 -0.09 2.80 0.00 0.00 179.97 183.64 2fwu h ARG 627 N 0.41 0.00 -0.25 0.20 2.43 -0.42 0.13 114.38 116.89 2fwu h ARG 627 Ca 0.06 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 59.04 2fwu h ARG 627 Cb 0.64 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 2fwu h ARG 627 CO 0.05 0.00 -0.61 0.82 -1.51 0.00 0.00 179.97 178.71 2fwu h ILE 628 N 0.00 1.28 -0.34 1.20 2.04 -1.58 -1.75 117.51 118.36 2fwu h ILE 628 Ca 0.14 -1.80 -0.15 0.00 1.00 0.00 0.00 64.86 64.04 2fwu h ILE 628 Cb 0.60 1.73 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2fwu h ILE 628 CO -0.00 0.58 -0.39 0.00 0.00 0.00 0.00 178.15 178.34 2fwu h ALA 629 N 0.67 0.50 0.00 1.87 0.00 -0.96 -2.37 119.26 118.97 2fwu h ALA 629 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2fwu h ALA 629 Cb 1.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2fwu h ALA 629 CO 0.13 0.60 0.00 0.93 0.00 0.00 0.00 179.25 180.92 2fwu h GLU 630 N 0.65 0.00 0.15 0.00 4.39 -0.82 0.14 114.58 119.09 2fwu h GLU 630 Ca 0.05 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.43 2fwu h GLU 630 Cb 0.98 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 2fwu h GLU 630 CO 0.09 0.00 -1.54 1.98 -1.16 0.00 0.00 179.01 178.38 2fwu h MET 631 N 0.00 0.32 0.13 2.33 4.05 -0.88 -3.38 114.93 117.50 2fwu h MET 631 Ca 0.00 -0.54 -0.33 0.00 -0.28 0.00 0.00 59.70 58.55 2fwu h MET 631 Cb 0.36 0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 2fwu h MET 631 CO 0.00 1.20 -1.70 0.78 0.23 0.00 0.00 176.91 177.43 2fwu h GLY 632 N 1.30 0.32 -4.37 1.39 0.00 -0.94 -3.46 103.07 97.29 2fwu h GLY 632 Ca -0.25 -0.81 -0.58 0.00 0.00 0.00 0.00 47.33 45.69 2fwu h GLY 632 CO 0.18 0.71 -0.21 0.50 0.00 0.00 0.00 176.54 177.72 2fwu s ARG 633 N -2.59 3.78 0.51 4.80 0.52 -0.01 -4.96 118.95 120.99 2fwu s ARG 633 Ca -0.13 0.21 -0.23 0.00 -0.52 0.00 0.00 55.73 55.06 2fwu s ARG 633 Cb 0.06 -2.93 -0.06 0.00 0.52 0.00 0.00 34.95 32.54 2fwu s ARG 633 CO 0.84 0.51 1.38 -1.25 0.02 0.00 0.00 175.30 176.80 2fwu s PRO 634 N -2.09 3.36 0.45 3.54 0.04 -1.26 -4.68 135.00 134.36 2fwu s PRO 634 Ca 0.36 2.30 0.03 0.00 0.04 0.00 0.00 61.00 63.73 2fwu s PRO 634 Cb -0.14 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 31.96 2fwu s PRO 634 CO 0.19 -1.03 0.04 0.96 0.04 0.00 0.00 177.00 177.20 2fwu s ILE 635 N -1.27 1.16 0.75 0.56 -5.25 -1.26 -4.13 121.20 111.77 2fwu s ILE 635 Ca 0.67 -2.00 -0.12 0.00 -0.99 0.00 0.00 60.65 58.22 2fwu s ILE 635 Cb -0.41 -2.42 0.05 0.00 2.95 0.00 0.00 42.46 42.62 2fwu s ILE 635 CO 0.51 0.00 1.10 -0.22 -1.79 0.00 0.00 174.94 174.54 2fwu s LEU 636 N -3.74 3.11 0.00 0.37 2.96 -1.26 -4.04 118.68 116.08 2fwu s LEU 636 Ca 0.19 1.91 0.00 0.00 -0.22 0.00 0.00 54.13 56.00 2fwu s LEU 636 Cb 0.04 -4.53 0.00 0.00 0.50 0.00 0.00 46.19 42.20 2fwu s LEU 636 CO 0.10 -2.02 0.00 0.61 -1.32 0.00 0.00 176.35 173.72 2fwu n GLY 637 N -0.90 1.65 0.90 7.98 0.00 0.89 -4.45 105.19 111.26 2fwu n GLY 637 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.72 1.61 2.13 -1.26 -4.90 120.64 114.51 2fwu n GLU 638 Ca 0.00 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.44 2fwu n GLU 638 Cb 0.00 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 31.59 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 -0.69 3.17 -0.68 4.31 -3.43 -1.26 -4.99 115.29 111.72 2fwu s HIS 639 Ca 0.00 -0.90 -0.08 0.00 -0.80 0.00 0.00 55.06 53.28 2fwu s HIS 639 Cb 0.00 -2.30 0.18 0.00 -1.43 0.00 0.00 32.58 29.03 2fwu s HIS 639 CO 0.00 -0.56 0.55 -0.08 -2.00 0.00 0.00 174.74 172.65 2fwu s THR 640 N 1.53 4.49 -0.30 -5.38 -1.32 -1.26 -2.49 115.64 110.91 2fwu s THR 640 Ca 0.03 -2.63 -0.16 0.00 -1.21 0.00 0.00 61.69 57.72 2fwu s THR 640 Cb -0.17 -3.86 0.17 0.00 -1.51 0.00 0.00 72.50 67.13 2fwu s THR 640 CO 0.04 -0.92 1.06 -0.75 -2.21 0.00 0.00 174.62 171.84 2fwu s LYS 641 N 0.20 0.24 -0.18 7.08 2.36 -1.25 -4.69 119.74 123.50 2fwu s LYS 641 Ca 0.16 0.56 -0.01 0.00 -2.55 0.00 0.00 55.97 54.13 2fwu s LYS 641 Cb -0.17 0.29 0.05 0.00 -1.05 0.00 0.00 37.83 36.95 2fwu s LYS 641 CO -0.05 -0.07 -0.03 -1.17 1.55 0.00 0.00 175.35 175.57 2fwu s LEU 642 N 2.15 1.67 -0.51 5.43 2.96 -0.34 -4.42 118.68 125.62 2fwu s LEU 642 Ca -0.03 -0.78 -0.19 0.00 -0.22 0.00 0.00 54.13 52.91 2fwu s LEU 642 Cb -0.04 -0.87 0.07 0.00 0.50 0.00 0.00 46.19 45.84 2fwu s LEU 642 CO -0.16 -0.22 0.60 -0.70 -1.32 0.00 0.00 176.35 174.54 2fwu s GLU 643 N 1.65 3.09 -0.48 1.98 2.12 0.13 -0.31 118.70 126.88 2fwu s GLU 643 Ca -0.01 -1.01 -0.19 0.00 0.36 0.00 0.00 54.97 54.13 2fwu s GLU 643 Cb -0.16 -4.12 0.05 0.00 0.26 0.00 0.00 34.13 30.15 2fwu s GLU 643 CO -0.07 -1.23 0.57 0.08 -0.54 0.00 0.00 175.26 174.07 2fwu s VAL 644 N 2.49 4.94 -0.29 3.70 1.01 -0.50 -1.13 120.40 130.63 2fwu s VAL 644 Ca 0.13 -0.47 -0.21 0.00 0.00 0.00 0.00 61.98 61.43 2fwu s VAL 644 Cb -0.21 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 2fwu s VAL 644 CO 0.10 -0.70 0.68 -0.63 0.00 0.00 0.00 175.10 174.56 2fwu s ILE 645 N 2.47 4.91 -0.44 2.22 1.09 -0.25 -2.76 121.20 128.43 2fwu s ILE 645 Ca 0.14 1.07 -0.15 0.00 -1.10 0.00 0.00 60.65 60.62 2fwu s ILE 645 Cb -0.19 -4.03 0.05 0.00 -1.06 0.00 0.00 42.46 37.24 2fwu s ILE 645 CO 0.12 -0.11 0.34 -0.63 -0.10 0.00 0.00 174.94 174.56 2fwu s ILE 646 N 2.68 5.13 -0.13 2.92 1.09 -0.87 -1.56 121.20 130.47 2fwu s ILE 646 Ca 0.28 -0.93 -0.05 0.00 -1.10 0.00 0.00 60.65 58.85 2fwu s ILE 646 Cb -0.15 -3.98 -0.04 0.00 -1.06 0.00 0.00 42.46 37.23 2fwu s ILE 646 CO 0.11 -0.46 0.06 -1.83 -0.10 0.00 0.00 174.94 172.72 2fwu s GLU 647 N 1.64 3.48 0.38 2.79 -1.05 -0.48 -4.45 118.70 121.00 2fwu s GLU 647 Ca 0.04 -0.30 -0.27 0.00 -0.15 0.00 0.00 54.97 54.29 2fwu s GLU 647 Cb -0.22 -3.06 -0.09 0.00 -0.44 0.00 0.00 34.13 30.32 2fwu s GLU 647 CO 0.08 0.57 1.27 -1.21 0.95 0.00 0.00 175.26 176.92 2fwu s GLU 648 N -0.48 4.13 -1.21 -4.83 2.02 -1.26 -0.35 118.70 116.72 2fwu s GLU 648 Ca 0.10 2.09 -0.21 0.00 0.02 0.00 0.00 54.97 56.97 2fwu s GLU 648 Cb -0.12 -2.85 -0.01 0.00 0.10 0.00 0.00 34.13 31.25 2fwu s GLU 648 CO 0.02 -0.33 1.82 0.45 0.02 0.00 0.00 175.26 177.23 2fwu s SER 649 N -0.75 5.93 -0.20 -0.19 0.15 -1.26 -4.36 113.70 113.01 2fwu s SER 649 Ca 0.54 -1.94 -0.11 0.00 0.70 0.00 0.00 55.95 55.14 2fwu s SER 649 Cb -0.37 -2.58 -0.20 0.00 -1.71 0.00 0.00 66.02 61.16 2fwu s SER 649 CO 0.48 -2.12 0.07 0.00 1.20 0.00 0.00 173.24 172.86 2fwu n TYR 650 N 11.37 0.70 -2.23 3.44 9.36 -1.26 -5.06 117.16 133.49 2fwu n TYR 650 Ca 0.46 0.21 0.00 0.00 3.32 0.00 0.00 57.90 61.89 2fwu n TYR 650 Cb 0.47 -1.08 0.00 0.00 -0.63 0.00 0.00 39.34 38.09 2fwu n TYR 650 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 2fwu n GLU 651 N -3.86 0.00 -3.63 2.98 2.13 -1.26 -5.18 120.64 111.82 2fwu n GLU 651 Ca -0.39 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.28 2fwu n GLU 651 Cb 0.90 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.54 2fwu n GLU 651 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2fwu s PHE 652 N -2.97 -0.61 -1.18 4.31 5.36 -1.26 -4.90 117.98 116.73 2fwu s PHE 652 Ca 0.00 1.32 0.00 0.00 -0.96 0.00 0.00 56.93 57.29 2fwu s PHE 652 Cb 0.00 0.27 0.00 0.00 -0.34 0.00 0.00 43.02 42.95 2fwu s PHE 652 CO 0.00 -0.43 0.00 1.63 -1.46 0.00 0.00 175.22 174.96 2fwu n LYS 653 N 1.96 -0.83 -0.01 10.12 5.02 -1.26 -4.90 118.16 128.26 2fwu n LYS 653 Ca -0.16 0.83 -0.13 0.00 -2.02 0.00 0.00 58.31 56.83 2fwu n LYS 653 Cb 0.56 -4.86 -0.00 0.00 -0.02 0.00 0.00 35.03 30.72 2fwu n LYS 653 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 2fwu h SER 654 N 0.00 0.75 -3.58 4.39 0.02 -2.03 -3.45 113.55 109.65 2fwu h SER 654 Ca -0.24 -0.44 -0.02 0.00 -0.84 0.00 0.00 61.79 60.24 2fwu h SER 654 Cb 0.85 -0.22 -0.21 0.00 0.14 0.00 0.00 62.40 62.96 2fwu h SER 654 CO 0.34 1.20 0.05 -0.89 -1.14 0.00 0.00 176.83 176.39 2fwu s THR 655 N -3.90 -0.00 0.29 -2.27 2.01 -1.26 -5.16 115.64 105.35 2fwu s THR 655 Ca -0.08 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.84 2fwu s THR 655 Cb 0.10 -0.96 -0.06 0.00 0.01 0.00 0.00 72.50 71.59 2fwu s THR 655 CO 0.87 0.00 0.60 0.68 -0.69 0.00 0.00 174.62 176.07 2fwu s VAL 656 N 0.90 4.95 0.00 3.82 -7.23 -1.26 -5.14 120.40 116.43 2fwu s VAL 656 Ca -0.04 0.30 0.00 0.00 -1.81 0.00 0.00 61.98 60.43 2fwu s VAL 656 Cb -0.05 -3.69 0.00 0.00 0.56 0.00 0.00 36.38 33.20 2fwu s VAL 656 CO -0.08 -0.28 0.00 -0.67 -0.31 0.00 0.00 175.10 173.77