#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ynt n VAL 502 N 0.00 0.03 -3.76 -0.39 0.31 -1.26 -4.53 118.33 108.73 1ynt n VAL 502 Ca 0.00 -0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.19 1ynt n VAL 502 Cb 0.00 -0.56 -0.14 0.00 -0.91 0.00 0.00 33.84 32.22 1ynt n VAL 502 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1ynt s GLN 503 N 3.04 0.09 -0.11 5.55 0.74 -0.49 -5.00 119.66 123.48 1ynt s GLN 503 Ca 1.04 0.33 0.02 0.00 0.05 0.00 0.00 55.36 56.80 1ynt s GLN 503 Cb -1.46 -0.15 -0.01 0.00 1.10 0.00 0.00 33.01 32.49 1ynt s GLN 503 CO 0.80 -0.14 -0.17 -0.51 -0.55 0.00 0.00 175.29 174.72 1ynt s LEU 504 N 1.01 2.52 -0.00 3.68 1.43 -1.26 -1.91 118.68 124.15 1ynt s LEU 504 Ca -0.08 -0.38 0.07 0.00 -1.03 0.00 0.00 54.13 52.72 1ynt s LEU 504 Cb -0.10 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 1ynt s LEU 504 CO -0.05 0.19 -0.23 -1.10 0.23 0.00 0.00 176.35 175.39 1ynt s GLN 505 N 0.16 1.80 0.25 1.70 -1.52 -1.05 -4.29 119.66 116.73 1ynt s GLN 505 Ca -0.09 -0.88 0.11 0.00 -1.95 0.00 0.00 55.36 52.55 1ynt s GLN 505 Cb -0.16 -1.80 -0.05 0.00 -0.22 0.00 0.00 33.01 30.79 1ynt s GLN 505 CO 0.06 0.49 -0.15 -0.65 -0.25 0.00 0.00 175.29 174.78 1ynt s GLN 506 N -0.72 1.83 1.00 2.91 -0.21 -1.26 -0.26 119.66 122.95 1ynt s GLN 506 Ca 0.09 -1.61 -0.11 0.00 0.02 0.00 0.00 55.36 53.75 1ynt s GLN 506 Cb -0.09 -1.91 0.19 0.00 1.00 0.00 0.00 33.01 32.20 1ynt s GLN 506 CO -0.00 0.36 1.09 -1.54 -2.12 0.00 0.00 175.29 173.08 1ynt s SER 507 N -3.35 2.32 1.23 5.90 1.04 -1.25 -4.95 113.70 114.64 1ynt s SER 507 Ca 0.28 1.85 -0.15 0.00 0.48 0.00 0.00 55.95 58.41 1ynt s SER 507 Cb -0.06 -2.43 0.23 0.00 0.10 0.00 0.00 66.02 63.86 1ynt s SER 507 CO 0.15 -3.42 0.73 0.61 0.98 0.00 0.00 173.24 172.30 1ynt n GLY 508 N 0.21 -3.02 3.74 7.32 0.00 -1.26 -4.71 105.19 107.46 1ynt n GLY 508 Ca 0.08 -1.42 -0.34 0.00 0.00 0.00 0.00 46.02 44.34 1ynt n GLY 508 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynt s ALA 509 N -2.75 2.22 -0.02 4.61 0.00 -1.26 -4.68 121.76 119.87 1ynt s ALA 509 Ca 0.50 0.77 0.04 0.00 0.00 0.00 0.00 51.96 53.27 1ynt s ALA 509 Cb -0.06 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 1ynt s ALA 509 CO 0.39 -1.70 -0.15 -1.21 0.00 0.00 0.00 175.76 173.10 1ynt s GLU 510 N -3.97 1.32 -0.21 0.00 0.41 -0.04 -4.98 118.70 111.24 1ynt s GLU 510 Ca 0.72 -0.52 -0.01 0.00 -0.41 0.00 0.00 54.97 54.75 1ynt s GLU 510 Cb -0.26 -1.23 0.06 0.00 -1.78 0.00 0.00 34.13 30.91 1ynt s GLU 510 CO 0.44 0.27 -0.01 -1.17 -0.49 0.00 0.00 175.26 174.30 1ynt s LEU 511 N -0.16 1.82 0.11 1.80 2.96 -1.26 -1.43 118.68 122.52 1ynt s LEU 511 Ca 0.02 -0.96 0.03 0.00 -0.22 0.00 0.00 54.13 53.00 1ynt s LEU 511 Cb -0.08 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.70 1ynt s LEU 511 CO 0.00 -0.26 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.99 1ynt s VAL 512 N 1.64 0.90 0.52 1.68 1.01 -0.61 -5.02 120.40 120.51 1ynt s VAL 512 Ca -0.03 -1.82 -0.16 0.00 0.00 0.00 0.00 61.98 59.97 1ynt s VAL 512 Cb -0.18 -1.56 -0.08 0.00 0.00 0.00 0.00 36.38 34.57 1ynt s VAL 512 CO -0.07 -0.70 0.99 -0.13 0.00 0.00 0.00 175.10 175.19 1ynt s ARG 513 N -3.32 3.92 1.08 2.72 0.52 -1.26 -0.87 118.95 121.74 1ynt s ARG 513 Ca 0.10 0.95 -0.13 0.00 -0.52 0.00 0.00 55.73 56.13 1ynt s ARG 513 Cb 0.01 -2.13 0.19 0.00 0.52 0.00 0.00 34.95 33.54 1ynt s ARG 513 CO -0.01 -0.29 0.79 -2.30 0.02 0.00 0.00 175.30 173.51 1ynt n PRO 514 N -1.63 -1.56 0.00 3.54 -0.02 -1.26 -3.15 135.00 130.92 1ynt n PRO 514 Ca 0.07 -0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.13 1ynt n PRO 514 Cb 0.54 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1ynt n PRO 514 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ynt n GLY 515 N 1.07 0.97 3.55 -1.23 0.00 0.24 -4.89 105.19 104.90 1ynt n GLY 515 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1ynt n GLY 515 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynt s VAL 516 N 0.00 2.01 0.26 1.61 1.01 -1.19 -3.34 120.40 120.75 1ynt s VAL 516 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 61.98 62.07 1ynt s VAL 516 Cb 0.00 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1ynt s VAL 516 CO 0.00 -0.00 0.05 -0.55 0.00 0.00 0.00 175.10 174.60 1ynt s SER 517 N -2.87 4.82 -0.04 3.32 0.15 -1.26 -1.71 113.70 116.11 1ynt s SER 517 Ca 0.67 -0.52 -0.15 0.00 0.70 0.00 0.00 55.95 56.65 1ynt s SER 517 Cb -0.23 -1.00 0.03 0.00 -1.71 0.00 0.00 66.02 63.11 1ynt s SER 517 CO 0.62 -0.00 0.33 0.54 1.20 0.00 0.00 173.24 175.93 1ynt s VAL 518 N -2.23 0.04 -0.05 4.45 0.11 0.10 -4.97 120.40 117.84 1ynt s VAL 518 Ca 0.31 -0.35 0.04 0.00 -2.93 0.00 0.00 61.98 59.05 1ynt s VAL 518 Cb -0.07 -0.60 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 1ynt s VAL 518 CO 0.21 -0.19 -0.17 -0.75 -3.33 0.00 0.00 175.10 170.87 1ynt s LYS 519 N -0.98 1.92 -0.00 1.54 2.20 -1.26 0.13 119.74 123.29 1ynt s LYS 519 Ca -0.10 -0.60 0.08 0.00 -0.36 0.00 0.00 55.97 54.98 1ynt s LYS 519 Cb -0.04 -1.61 -0.02 0.00 -1.51 0.00 0.00 37.83 34.64 1ynt s LYS 519 CO 0.04 0.19 -0.24 0.96 -0.36 0.00 0.00 175.35 175.94 1ynt s ILE 520 N 0.21 1.89 0.00 5.43 -4.36 0.11 -4.96 121.20 119.52 1ynt s ILE 520 Ca -0.08 -1.09 0.00 0.00 -0.26 0.00 0.00 60.65 59.22 1ynt s ILE 520 Cb -0.13 -1.58 0.00 0.00 1.25 0.00 0.00 42.46 41.99 1ynt s ILE 520 CO 0.03 0.47 0.00 -1.54 0.24 0.00 0.00 174.94 174.14 1ynt n SER 521 N 2.31 0.00 0.00 4.36 3.41 -1.26 -1.21 113.62 121.22 1ynt n SER 521 Ca -0.16 -0.98 0.00 0.00 -0.26 0.00 0.00 58.87 57.47 1ynt n SER 521 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1ynt n SER 521 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ynt s LYS 523 N 0.00 3.36 0.60 0.00 1.02 0.64 0.48 119.74 125.84 1ynt s LYS 523 Ca 0.00 -0.73 -0.14 0.00 0.02 0.00 0.00 55.97 55.12 1ynt s LYS 523 Cb 0.00 -3.75 -0.04 0.00 -0.52 0.00 0.00 37.83 33.52 1ynt s LYS 523 CO 0.00 -0.48 1.03 0.20 -0.92 0.00 0.00 175.35 175.18 1ynt s GLY 524 N 1.68 1.94 -0.04 -3.33 0.00 -0.21 -2.53 107.32 104.83 1ynt s GLY 524 Ca 0.05 0.19 -0.29 0.00 0.00 0.00 0.00 44.72 44.68 1ynt s GLY 524 CO 0.09 0.49 0.78 -0.56 0.00 0.00 0.00 173.10 173.90 1ynt s SER 525 N -3.29 -0.53 0.00 1.64 0.01 -0.80 -4.87 113.70 105.86 1ynt s SER 525 Ca 0.60 0.42 0.00 0.00 1.31 0.00 0.00 55.95 58.28 1ynt s SER 525 Cb -0.13 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1ynt s SER 525 CO 0.42 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 174.07 1ynt n GLY 526 N 0.49 0.63 3.81 3.44 0.00 -1.26 -1.40 105.19 110.90 1ynt n GLY 526 Ca -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 1ynt n GLY 526 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ynt s TYR 527 N -2.17 -0.05 -1.09 1.61 1.13 -1.26 -4.18 117.35 111.33 1ynt s TYR 527 Ca 0.00 -0.35 -0.23 0.00 -1.41 0.00 0.00 57.07 55.08 1ynt s TYR 527 Cb 0.00 0.69 -0.06 0.00 -1.10 0.00 0.00 41.96 41.50 1ynt s TYR 527 CO 0.00 -1.02 1.90 0.99 -2.51 0.00 0.00 175.55 174.91 1ynt s THR 528 N -2.98 3.58 0.37 -3.49 2.01 -1.26 -4.81 115.64 109.05 1ynt s THR 528 Ca 0.15 -0.81 0.25 0.00 0.31 0.00 0.00 61.69 61.59 1ynt s THR 528 Cb -0.03 -4.46 0.40 0.00 0.01 0.00 0.00 72.50 68.42 1ynt s THR 528 CO 0.05 -1.10 1.39 0.33 -0.69 0.00 0.00 174.62 174.60 1ynt n PHE 529 N 13.54 0.76 0.14 4.92 7.35 -1.26 0.97 117.46 143.88 1ynt n PHE 529 Ca 0.43 0.77 0.08 0.00 -0.76 0.00 0.00 57.45 57.97 1ynt n PHE 529 Cb 0.47 -1.19 0.05 0.00 0.35 0.00 0.00 39.48 39.16 1ynt n PHE 529 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1ynt h THR 530 N 0.00 0.24 0.00 -2.13 2.02 -1.90 -3.28 112.91 107.86 1ynt h THR 530 Ca 0.77 -1.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.56 1ynt h THR 530 Cb 2.34 1.93 -0.00 0.00 -1.74 0.00 0.00 68.15 70.68 1ynt h THR 530 CO -0.51 0.13 -0.09 0.44 0.37 0.00 0.00 175.52 175.87 1ynt h ASP 531 N 0.00 0.00 -2.90 4.18 3.45 0.21 -3.38 116.42 117.98 1ynt h ASP 531 Ca -0.02 0.00 -0.63 0.00 0.43 0.00 0.00 57.03 56.81 1ynt h ASP 531 Cb 1.16 0.00 -0.15 0.00 -0.56 0.00 0.00 39.33 39.78 1ynt h ASP 531 CO 0.02 0.09 -0.74 -0.31 -1.57 0.00 0.00 179.24 176.73 1ynt s TYR 532 N -4.28 2.52 0.68 4.55 1.51 -1.22 -4.98 117.35 116.13 1ynt s TYR 532 Ca -0.03 -0.27 -0.01 0.00 -1.01 0.00 0.00 57.07 55.75 1ynt s TYR 532 Cb 0.13 -1.21 0.10 0.00 -0.11 0.00 0.00 41.96 40.87 1ynt s TYR 532 CO 0.57 0.54 0.94 0.20 -1.11 0.00 0.00 175.55 176.70 1ynt s GLY 533 N -2.93 1.77 -0.06 0.71 0.00 -1.23 -4.02 107.32 101.55 1ynt s GLY 533 Ca 0.25 -1.54 0.01 0.00 0.00 0.00 0.00 44.72 43.44 1ynt s GLY 533 CO 0.14 -1.06 -0.08 -0.29 0.00 0.00 0.00 173.10 171.81 1ynt s MET 534 N -5.06 1.24 -0.10 2.90 1.75 -0.29 -2.58 119.30 117.16 1ynt s MET 534 Ca 0.63 -0.24 -0.04 0.00 -1.25 0.00 0.00 55.69 54.79 1ynt s MET 534 Cb -0.07 -1.14 -0.04 0.00 2.84 0.00 0.00 34.83 36.42 1ynt s MET 534 CO 0.43 -0.06 0.08 -1.01 -0.65 0.00 0.00 175.02 173.81 1ynt s HIS 535 N 0.91 3.39 -0.18 4.11 3.76 0.12 -0.15 115.29 127.26 1ynt s HIS 535 Ca -0.11 0.36 0.01 0.00 -0.15 0.00 0.00 55.06 55.18 1ynt s HIS 535 Cb -0.15 -1.86 0.02 0.00 1.11 0.00 0.00 32.58 31.70 1ynt s HIS 535 CO 0.01 0.61 -0.20 -1.58 -0.85 0.00 0.00 174.74 172.73 1ynt s TRP 536 N -0.98 2.77 0.05 1.40 0.52 -1.05 -0.09 118.94 121.56 1ynt s TRP 536 Ca 0.15 -1.60 0.09 0.00 0.02 0.00 0.00 56.10 54.76 1ynt s TRP 536 Cb -0.12 -1.91 -0.03 0.00 -1.15 0.00 0.00 33.47 30.26 1ynt s TRP 536 CO 0.04 -0.78 -0.26 0.08 0.02 0.00 0.00 176.95 176.05 1ynt s VAL 537 N 1.24 2.20 -0.15 4.03 1.01 0.16 0.59 120.40 129.49 1ynt s VAL 537 Ca 0.04 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.60 1ynt s VAL 537 Cb -0.13 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1ynt s VAL 537 CO -0.12 0.35 -0.06 -0.75 0.00 0.00 0.00 175.10 174.53 1ynt s LYS 538 N -1.29 3.60 -0.16 2.72 2.20 0.45 0.08 119.74 127.33 1ynt s LYS 538 Ca 0.12 -0.56 0.01 0.00 -0.36 0.00 0.00 55.97 55.18 1ynt s LYS 538 Cb -0.10 -2.84 0.02 0.00 -1.51 0.00 0.00 37.83 33.39 1ynt s LYS 538 CO 0.02 0.23 -0.19 -1.14 -0.36 0.00 0.00 175.35 173.92 1ynt s GLN 539 N 0.37 2.79 -0.01 4.03 0.74 0.88 -0.80 119.66 127.66 1ynt s GLN 539 Ca -0.06 -0.76 -0.00 0.00 0.05 0.00 0.00 55.36 54.60 1ynt s GLN 539 Cb -0.15 -2.40 0.02 0.00 1.10 0.00 0.00 33.01 31.58 1ynt s GLN 539 CO 0.04 -0.18 0.02 -1.54 -0.55 0.00 0.00 175.29 173.08 1ynt s SER 540 N 1.24 0.03 -0.98 6.67 1.04 -1.22 -0.03 113.70 120.45 1ynt s SER 540 Ca 0.02 0.03 -0.04 0.00 0.48 0.00 0.00 55.95 56.44 1ynt s SER 540 Cb -0.13 -0.02 0.13 0.00 0.10 0.00 0.00 66.02 66.09 1ynt s SER 540 CO -0.10 -0.07 2.45 1.41 0.98 0.00 0.00 173.24 177.91 1ynt n HIS 541 N 3.64 2.29 -0.87 5.02 8.25 -1.26 0.25 115.22 132.54 1ynt n HIS 541 Ca -0.20 -2.47 0.00 0.00 -0.26 0.00 0.00 57.72 54.78 1ynt n HIS 541 Cb 0.55 -1.59 0.00 0.00 1.12 0.00 0.00 29.99 30.07 1ynt n HIS 541 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ynt n ALA 542 N 1.16 0.00 -0.81 -1.41 0.00 -1.26 -4.81 120.51 113.38 1ynt n ALA 542 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1ynt n ALA 542 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 1ynt n ALA 542 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ynt n LYS 543 N 0.00 0.00 0.00 0.00 5.02 -1.02 -5.16 118.16 116.99 1ynt n LYS 543 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1ynt n LYS 543 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.20 1ynt n LYS 543 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ynt n SER 544 N 0.00 0.00 -4.74 4.39 2.88 0.68 -4.77 113.62 112.06 1ynt n SER 544 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1ynt n SER 544 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1ynt n SER 544 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1ynt s LEU 545 N 0.00 4.37 -0.05 2.46 1.43 -1.25 -3.41 118.68 122.23 1ynt s LEU 545 Ca 0.00 2.76 -0.02 0.00 -1.03 0.00 0.00 54.13 55.84 1ynt s LEU 545 Cb 0.00 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.64 1ynt s LEU 545 CO 0.00 -0.81 0.11 -1.61 0.23 0.00 0.00 176.35 174.27 1ynt s GLU 546 N -0.07 0.05 -0.04 1.70 2.02 0.02 -4.96 118.70 117.43 1ynt s GLU 546 Ca 0.63 0.33 -0.30 0.00 0.02 0.00 0.00 54.97 55.65 1ynt s GLU 546 Cb -0.45 -0.21 -0.04 0.00 0.10 0.00 0.00 34.13 33.54 1ynt s GLU 546 CO 0.42 -0.18 1.24 -0.46 0.02 0.00 0.00 175.26 176.30 1ynt s TRP 547 N 1.22 3.14 -0.11 1.61 -0.00 -1.26 -0.42 118.94 123.12 1ynt s TRP 547 Ca -0.08 1.15 0.05 0.00 -0.00 0.00 0.00 56.10 57.21 1ynt s TRP 547 Cb -0.12 -3.47 -0.24 0.00 -0.00 0.00 0.00 33.47 29.65 1ynt s TRP 547 CO -0.05 -1.52 0.39 -0.89 -0.00 0.00 0.00 176.95 174.88 1ynt n ILE 548 N 4.58 1.64 -3.88 5.86 5.41 0.20 -4.80 119.36 128.36 1ynt n ILE 548 Ca 0.11 -0.73 0.00 0.00 1.00 0.00 0.00 62.75 63.13 1ynt n ILE 548 Cb 0.46 -1.27 0.00 0.00 -0.71 0.00 0.00 39.64 38.12 1ynt n ILE 548 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ynt n GLY 549 N 1.82 -0.96 3.28 7.39 0.00 -1.19 -3.33 105.19 112.20 1ynt n GLY 549 Ca -0.27 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 1ynt n GLY 549 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1ynt s ILE 550 N -3.00 -0.00 -0.13 -0.61 2.07 -0.48 -2.52 121.20 116.53 1ynt s ILE 550 Ca 0.00 0.02 0.02 0.00 -1.41 0.00 0.00 60.65 59.28 1ynt s ILE 550 Cb 0.00 -0.56 0.01 0.00 0.13 0.00 0.00 42.46 42.04 1ynt s ILE 550 CO 0.00 0.01 -0.20 -0.51 -1.91 0.00 0.00 174.94 172.33 1ynt s ILE 551 N 0.43 1.87 -0.49 2.00 1.10 0.79 -1.64 121.20 125.25 1ynt s ILE 551 Ca -0.02 -0.87 -0.29 0.00 -0.51 0.00 0.00 60.65 58.97 1ynt s ILE 551 Cb -0.04 -1.67 0.02 0.00 0.15 0.00 0.00 42.46 40.92 1ynt s ILE 551 CO -0.02 0.51 1.31 -0.44 -2.11 0.00 0.00 174.94 174.19 1ynt s SER 552 N 0.88 6.38 0.48 4.50 0.01 0.58 -1.14 113.70 125.39 1ynt s SER 552 Ca -0.07 0.49 0.24 0.00 1.31 0.00 0.00 55.95 57.92 1ynt s SER 552 Cb -0.15 -2.55 1.28 0.00 0.21 0.00 0.00 66.02 64.82 1ynt s SER 552 CO -0.02 -1.46 1.89 0.71 0.41 0.00 0.00 173.24 174.76 1ynt h THR 553 N 6.34 0.63 0.00 1.44 1.35 -1.84 0.77 112.91 121.60 1ynt h THR 553 Ca -0.26 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1ynt h THR 553 Cb 1.08 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 1ynt h THR 553 CO 1.14 0.04 -0.34 0.22 -0.25 0.00 0.00 175.52 176.33 1ynt h TYR 554 N 0.19 0.00 -0.84 4.73 3.20 -1.88 -3.39 116.97 118.99 1ynt h TYR 554 Ca 0.43 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.29 1ynt h TYR 554 Cb 1.37 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.60 1ynt h TYR 554 CO -0.00 0.00 0.50 0.66 -1.64 0.00 0.00 178.16 177.68 1ynt h SER 555 N -0.97 1.01 0.00 -2.11 4.64 -1.94 -3.46 113.55 110.71 1ynt h SER 555 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1ynt h SER 555 Cb 0.34 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1ynt h SER 555 CO 0.00 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 177.34 1ynt n GLY 556 N -1.27 0.63 3.79 -0.77 0.00 0.27 -5.03 105.19 102.81 1ynt n GLY 556 Ca 0.09 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1ynt n GLY 556 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ynt s ASP 557 N -2.07 6.94 0.55 1.61 2.15 -1.20 -4.77 116.67 119.90 1ynt s ASP 557 Ca 0.00 1.12 0.04 0.00 0.43 0.00 0.00 52.55 54.15 1ynt s ASP 557 Cb 0.00 -2.33 0.04 0.00 -0.30 0.00 0.00 42.92 40.33 1ynt s ASP 557 CO 0.00 0.21 0.34 0.00 -0.17 0.00 0.00 175.17 175.56 1ynt s ALA 558 N -0.68 4.46 -0.20 3.66 0.00 -1.26 -0.30 121.76 127.44 1ynt s ALA 558 Ca 0.28 -0.97 -0.09 0.00 0.00 0.00 0.00 51.96 51.18 1ynt s ALA 558 Cb -0.18 -0.60 0.08 0.00 0.00 0.00 0.00 23.12 22.42 1ynt s ALA 558 CO 0.16 -0.39 0.45 -1.12 0.00 0.00 0.00 175.76 174.86 1ynt s SER 559 N -4.24 -0.46 0.00 0.00 0.01 -0.65 -4.97 113.70 103.39 1ynt s SER 559 Ca 0.27 1.04 0.00 0.00 1.31 0.00 0.00 55.95 58.57 1ynt s SER 559 Cb -0.02 1.22 0.00 0.00 0.21 0.00 0.00 66.02 67.43 1ynt s SER 559 CO 0.17 -0.22 0.00 -1.22 0.41 0.00 0.00 173.24 172.38 1ynt n TYR 560 N 4.93 0.00 -3.94 2.43 4.01 -1.26 -1.38 117.16 121.95 1ynt n TYR 560 Ca -0.15 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.44 1ynt n TYR 560 Cb 0.52 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.40 1ynt n TYR 560 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1ynt s ASN 561 N -0.93 0.30 0.16 7.72 3.84 -1.21 -4.73 114.94 120.09 1ynt s ASN 561 Ca 0.00 -0.02 -0.08 0.00 0.21 0.00 0.00 52.86 52.97 1ynt s ASN 561 Cb 0.00 -0.12 0.22 0.00 -0.55 0.00 0.00 41.25 40.80 1ynt s ASN 561 CO 0.00 -0.05 0.98 0.00 -2.79 0.00 0.00 177.10 175.24 1ynt n GLN 562 N 3.65 -0.10 -0.16 0.43 1.13 -1.26 -1.29 117.38 119.77 1ynt n GLN 562 Ca -0.21 0.97 -0.05 0.00 -1.94 0.00 0.00 57.00 55.78 1ynt n GLN 562 Cb 0.54 -1.45 -0.05 0.00 0.11 0.00 0.00 30.24 29.40 1ynt n GLN 562 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1ynt h LYS 563 N 0.00 -0.03 -0.29 -1.09 6.56 -1.96 -2.90 116.57 116.87 1ynt h LYS 563 Ca 0.26 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.85 1ynt h LYS 563 Cb 0.42 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 1ynt h LYS 563 CO -0.64 -0.02 0.00 1.19 -2.06 0.00 0.00 179.45 177.92 1ynt n PHE 564 N -3.99 0.38 -1.88 -1.35 3.72 -0.41 -4.89 117.46 109.02 1ynt n PHE 564 Ca 0.00 -0.19 -0.41 0.00 -0.05 0.00 0.00 57.45 56.80 1ynt n PHE 564 Cb 0.12 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.64 1ynt n PHE 564 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1ynt s LYS 565 N -1.62 4.19 0.00 -1.08 2.20 -1.08 -0.05 119.74 122.30 1ynt s LYS 565 Ca 0.24 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.30 1ynt s LYS 565 Cb 0.12 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.37 1ynt s LYS 565 CO 0.17 -0.54 0.00 0.41 -0.36 0.00 0.00 175.35 175.03 1ynt n GLY 566 N 2.33 0.42 0.49 5.54 0.00 -1.26 -4.71 105.19 108.00 1ynt n GLY 566 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 1ynt n GLY 566 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ynt n LYS 567 N -1.63 0.16 -3.79 1.61 0.00 0.35 -4.92 118.16 109.94 1ynt n LYS 567 Ca 0.00 0.06 -0.21 0.00 0.00 0.00 0.00 58.31 58.16 1ynt n LYS 567 Cb 0.12 -0.90 -0.03 0.00 0.00 0.00 0.00 35.03 34.23 1ynt n LYS 567 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ynt s ALA 568 N -2.13 3.91 -0.34 3.14 0.00 0.93 -3.33 121.76 123.94 1ynt s ALA 568 Ca -0.10 -1.54 0.05 0.00 0.00 0.00 0.00 51.96 50.38 1ynt s ALA 568 Cb 0.03 -1.36 0.18 0.00 0.00 0.00 0.00 23.12 21.97 1ynt s ALA 568 CO 0.14 0.05 0.53 0.99 0.00 0.00 0.00 175.76 177.47 1ynt s THR 569 N -2.22 -0.83 -0.18 0.00 2.01 -1.13 -4.84 115.64 108.44 1ynt s THR 569 Ca 0.40 -0.20 -0.25 0.00 0.31 0.00 0.00 61.69 61.95 1ynt s THR 569 Cb -0.07 -0.65 -0.01 0.00 0.01 0.00 0.00 72.50 71.78 1ynt s THR 569 CO 0.28 -0.14 0.81 -0.04 -0.69 0.00 0.00 174.62 174.84 1ynt s MET 570 N 2.28 4.27 -0.01 4.92 -1.94 -1.26 -3.09 119.30 124.47 1ynt s MET 570 Ca 0.13 0.97 0.01 0.00 -1.71 0.00 0.00 55.69 55.09 1ynt s MET 570 Cb -0.09 -3.59 0.00 0.00 2.01 0.00 0.00 34.83 33.16 1ynt s MET 570 CO -0.18 -0.35 -0.03 0.95 -0.01 0.00 0.00 175.02 175.40 1ynt s THR 571 N 2.25 0.26 0.08 2.05 -4.23 -1.10 -4.78 115.64 110.16 1ynt s THR 571 Ca 0.37 -0.11 0.01 0.00 -1.18 0.00 0.00 61.69 60.77 1ynt s THR 571 Cb -0.16 -0.24 0.01 0.00 1.34 0.00 0.00 72.50 73.45 1ynt s THR 571 CO 0.11 0.09 0.08 0.55 -0.54 0.00 0.00 174.62 174.91 1ynt n VAL 572 N 3.17 0.00 -2.87 2.29 3.14 -1.26 -0.90 118.33 121.90 1ynt n VAL 572 Ca -0.15 -0.28 -0.02 0.00 -2.96 0.00 0.00 64.34 60.94 1ynt n VAL 572 Cb 0.58 -0.65 0.01 0.00 -1.06 0.00 0.00 33.84 32.72 1ynt n VAL 572 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1ynt s ASP 573 N -1.45 -1.09 0.00 6.55 2.15 -1.15 -4.89 116.67 116.78 1ynt s ASP 573 Ca 0.06 -0.99 0.00 0.00 0.43 0.00 0.00 52.55 52.05 1ynt s ASP 573 Cb -0.00 1.42 0.00 0.00 -0.30 0.00 0.00 42.92 44.03 1ynt s ASP 573 CO 0.04 -0.07 0.23 1.17 -0.17 0.00 0.00 175.17 176.37 1ynt n LYS 574 N 3.38 0.00 0.00 4.34 4.81 -1.26 -2.75 118.16 126.68 1ynt n LYS 574 Ca 0.13 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 1ynt n LYS 574 Cb 0.59 -0.62 0.00 0.00 0.02 0.00 0.00 35.03 35.02 1ynt n LYS 574 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1ynt n SER 575 N -0.53 0.00 -1.19 3.14 3.41 -1.26 0.16 113.62 117.34 1ynt n SER 575 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 1ynt n SER 575 Cb 0.00 0.00 0.29 0.00 -0.26 0.00 0.00 64.21 64.24 1ynt n SER 575 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ynt n SER 576 N -1.53 4.25 -3.94 4.04 3.41 -1.12 -5.01 113.62 113.73 1ynt n SER 576 Ca 0.00 -2.67 -0.40 0.00 -0.26 0.00 0.00 58.87 55.54 1ynt n SER 576 Cb 0.00 -0.52 0.02 0.00 -0.26 0.00 0.00 64.21 63.45 1ynt n SER 576 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ynt n SER 577 N 0.29 -4.57 -3.93 4.04 7.64 0.41 -4.84 113.62 112.67 1ynt n SER 577 Ca 0.22 -1.18 -0.12 0.00 1.01 0.00 0.00 58.87 58.79 1ynt n SER 577 Cb 0.86 -2.12 -0.13 0.00 -1.01 0.00 0.00 64.21 61.80 1ynt n SER 577 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ynt s THR 578 N -3.44 0.16 0.05 0.44 2.01 -1.24 -1.05 115.64 112.57 1ynt s THR 578 Ca 0.43 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 62.15 1ynt s THR 578 Cb -0.22 -0.19 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 1ynt s THR 578 CO 0.94 -0.11 -0.09 0.00 -0.69 0.00 0.00 174.62 174.67 1ynt s ALA 579 N -0.45 2.96 0.11 7.40 0.00 0.18 -2.96 121.76 129.01 1ynt s ALA 579 Ca -0.04 -1.13 0.11 0.00 0.00 0.00 0.00 51.96 50.90 1ynt s ALA 579 Cb -0.03 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.05 1ynt s ALA 579 CO -0.00 0.63 -0.27 0.71 0.00 0.00 0.00 175.76 176.83 1ynt s TYR 580 N -1.09 2.29 -0.12 0.00 2.02 -0.08 -2.16 117.35 118.22 1ynt s TYR 580 Ca 0.19 -0.39 -0.01 0.00 -0.37 0.00 0.00 57.07 56.49 1ynt s TYR 580 Cb -0.11 -1.26 0.03 0.00 -0.40 0.00 0.00 41.96 40.22 1ynt s TYR 580 CO 0.10 0.30 -0.02 -1.64 -1.57 0.00 0.00 175.55 172.72 1ynt s MET 581 N -1.91 0.97 -0.20 -0.62 -1.94 -0.35 -2.69 119.30 112.55 1ynt s MET 581 Ca 0.13 -0.16 -0.02 0.00 -1.71 0.00 0.00 55.69 53.93 1ynt s MET 581 Cb -0.10 -1.46 -0.00 0.00 2.01 0.00 0.00 34.83 35.28 1ynt s MET 581 CO 0.05 -0.37 -0.09 -2.00 -0.01 0.00 0.00 175.02 172.61 1ynt s GLU 582 N 1.84 3.30 -0.32 2.03 2.12 -1.18 0.06 118.70 126.56 1ynt s GLU 582 Ca 0.03 -0.68 -0.06 0.00 0.36 0.00 0.00 54.97 54.62 1ynt s GLU 582 Cb -0.14 -2.87 0.03 0.00 0.26 0.00 0.00 34.13 31.41 1ynt s GLU 582 CO -0.07 -0.15 0.09 -0.51 -0.54 0.00 0.00 175.26 174.08 1ynt s LEU 583 N 1.29 4.06 0.35 2.70 1.02 0.35 -2.85 118.68 125.61 1ynt s LEU 583 Ca 0.03 -0.94 0.07 0.00 0.02 0.00 0.00 54.13 53.32 1ynt s LEU 583 Cb -0.14 -1.87 -0.01 0.00 0.02 0.00 0.00 46.19 44.19 1ynt s LEU 583 CO -0.04 -0.26 0.42 0.00 0.02 0.00 0.00 176.35 176.49 1ynt s ALA 584 N 1.44 4.14 -1.20 4.21 0.00 -1.21 0.01 121.76 129.15 1ynt s ALA 584 Ca 0.00 -1.58 -0.20 0.00 0.00 0.00 0.00 51.96 50.18 1ynt s ALA 584 Cb -0.18 -1.46 0.00 0.00 0.00 0.00 0.00 23.12 21.48 1ynt s ALA 584 CO 0.02 -0.07 0.70 0.54 0.00 0.00 0.00 175.76 176.96 1ynt n ARG 585 N -1.58 -1.34 -2.27 0.00 1.74 -1.22 -4.87 116.66 107.14 1ynt n ARG 585 Ca 0.01 0.36 -0.40 0.00 -0.77 0.00 0.00 57.85 57.05 1ynt n ARG 585 Cb 0.59 -3.85 -0.03 0.00 -1.02 0.00 0.00 32.46 28.16 1ynt n ARG 585 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ynt s LEU 586 N -6.77 4.37 0.04 0.55 1.43 -0.69 -4.75 118.68 112.86 1ynt s LEU 586 Ca 0.40 2.46 0.02 0.00 -1.03 0.00 0.00 54.13 55.98 1ynt s LEU 586 Cb -0.16 -3.78 -0.02 0.00 0.03 0.00 0.00 46.19 42.26 1ynt s LEU 586 CO 0.89 -0.49 -0.07 0.28 0.23 0.00 0.00 176.35 177.19 1ynt s THR 587 N -1.24 0.51 -1.14 5.49 -1.32 -1.26 0.79 115.64 117.47 1ynt s THR 587 Ca 0.51 -1.10 0.00 0.00 -1.21 0.00 0.00 61.69 59.89 1ynt s THR 587 Cb -0.35 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.02 1ynt s THR 587 CO 0.45 -0.41 0.22 -1.54 -2.21 0.00 0.00 174.62 171.12 1ynt n SER 588 N 1.41 0.00 0.08 8.08 3.41 -1.26 0.25 113.62 125.59 1ynt n SER 588 Ca -0.22 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.41 1ynt n SER 588 Cb 0.55 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 1ynt n SER 588 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1ynt h GLU 589 N 0.00 0.00 0.00 4.33 4.39 -1.95 -3.25 114.58 118.11 1ynt h GLU 589 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1ynt h GLU 589 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1ynt h GLU 589 CO 0.00 0.33 0.00 -0.25 -1.16 0.00 0.00 179.01 177.93 1ynt n ASP 590 N -2.99 0.76 -4.67 1.42 8.00 0.14 -4.76 116.55 114.44 1ynt n ASP 590 Ca -0.04 0.57 -0.49 0.00 0.71 0.00 0.00 54.79 55.54 1ynt n ASP 590 Cb 0.77 -0.77 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 1ynt n ASP 590 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ynt n SER 591 N -2.21 3.30 0.00 -2.24 7.64 -1.23 -4.77 113.62 114.11 1ynt n SER 591 Ca 0.06 0.93 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1ynt n SER 591 Cb 0.42 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1ynt n SER 591 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ynt n ALA 592 N 6.86 0.00 -2.29 -0.43 0.00 0.11 -4.87 120.51 119.89 1ynt n ALA 592 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.31 1ynt n ALA 592 Cb 0.28 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.67 1ynt n ALA 592 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ynt s ILE 593 N -2.00 4.76 -0.09 0.00 -1.09 0.96 0.23 121.20 123.97 1ynt s ILE 593 Ca 0.00 1.10 0.01 0.00 -2.23 0.00 0.00 60.65 59.53 1ynt s ILE 593 Cb 0.00 -3.84 0.02 0.00 -1.58 0.00 0.00 42.46 37.05 1ynt s ILE 593 CO 0.00 0.43 -0.12 -0.31 -1.23 0.00 0.00 174.94 173.70 1ynt s TYR 594 N -1.26 1.68 0.11 3.97 2.02 -1.11 -0.08 117.35 122.67 1ynt s TYR 594 Ca 0.33 -0.75 0.10 0.00 -0.37 0.00 0.00 57.07 56.38 1ynt s TYR 594 Cb -0.18 -1.26 -0.04 0.00 -0.40 0.00 0.00 41.96 40.09 1ynt s TYR 594 CO 0.19 -0.42 -0.23 0.71 -1.57 0.00 0.00 175.55 174.24 1ynt s TYR 595 N 1.05 2.42 0.07 2.71 2.02 0.11 -1.52 117.35 124.21 1ynt s TYR 595 Ca -0.06 -0.33 0.10 0.00 -0.37 0.00 0.00 57.07 56.41 1ynt s TYR 595 Cb -0.15 -1.32 -0.03 0.00 -0.40 0.00 0.00 41.96 40.06 1ynt s TYR 595 CO -0.01 0.33 -0.26 0.00 -1.57 0.00 0.00 175.55 174.03 1ynt s ALA 597 N -0.88 -0.42 0.04 0.00 0.00 0.87 -0.47 121.76 120.89 1ynt s ALA 597 Ca 0.12 0.10 -0.21 0.00 0.00 0.00 0.00 51.96 51.97 1ynt s ALA 597 Cb -0.10 -0.00 -0.06 0.00 0.00 0.00 0.00 23.12 22.96 1ynt s ALA 597 CO 0.03 -0.18 0.62 0.50 0.00 0.00 0.00 175.76 176.73 1ynt s ARG 598 N -1.00 4.32 -0.26 0.00 3.52 -0.07 0.15 118.95 125.61 1ynt s ARG 598 Ca -0.11 0.81 -0.01 0.00 -0.13 0.00 0.00 55.73 56.29 1ynt s ARG 598 Cb -0.06 -3.31 0.08 0.00 -1.56 0.00 0.00 34.95 30.11 1ynt s ARG 598 CO 0.02 0.46 0.05 -1.54 -0.81 0.00 0.00 175.30 173.47 1ynt s SER 599 N -0.54 3.67 0.53 -2.12 1.04 -1.06 0.43 113.70 115.64 1ynt s SER 599 Ca 0.32 -1.31 0.20 0.00 0.48 0.00 0.00 55.95 55.64 1ynt s SER 599 Cb -0.19 -0.87 1.37 0.00 0.10 0.00 0.00 66.02 66.43 1ynt s SER 599 CO 0.19 -0.34 2.13 0.77 0.98 0.00 0.00 173.24 176.96 1ynt h SER 600 N 8.10 0.00 -4.56 7.02 4.64 -1.89 -3.27 113.55 123.59 1ynt h SER 600 Ca -0.15 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.91 1ynt h SER 600 Cb 1.06 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.98 1ynt h SER 600 CO 0.42 0.00 -0.71 0.28 -0.87 0.00 0.00 176.83 175.95 1ynt s THR 601 N -5.00 0.74 0.06 2.95 -1.32 -1.26 -4.92 115.64 106.89 1ynt s THR 601 Ca -0.05 -1.69 -0.35 0.00 -1.21 0.00 0.00 61.69 58.39 1ynt s THR 601 Cb 0.17 -1.38 -0.20 0.00 -1.51 0.00 0.00 72.50 69.58 1ynt s THR 601 CO 0.66 -0.69 1.55 -0.50 -2.21 0.00 0.00 174.62 173.44 1ynt h TRP 602 N 3.43 -1.06 -0.19 9.09 4.06 -2.02 -3.31 115.95 125.95 1ynt h TRP 602 Ca -0.36 -0.03 0.05 0.00 2.06 0.00 0.00 58.89 60.62 1ynt h TRP 602 Cb 1.18 0.35 -0.01 0.00 -1.00 0.00 0.00 29.16 29.68 1ynt h TRP 602 CO 0.61 -0.66 0.16 0.10 -3.56 0.00 0.00 178.44 175.09 1ynt h TYR 603 N -1.18 0.00 -3.34 0.49 -0.00 -1.99 -3.44 116.97 107.52 1ynt h TYR 603 Ca -0.12 0.00 -0.57 0.00 -0.00 0.00 0.00 58.73 58.04 1ynt h TYR 603 Cb 0.88 0.00 -0.19 0.00 -0.00 0.00 0.00 36.73 37.43 1ynt h TYR 603 CO -0.01 0.00 -0.80 1.52 -0.00 0.00 0.00 178.16 178.87 1ynt s TYR 604 N -4.88 1.99 -0.36 0.10 -0.00 -1.25 -5.12 117.35 107.82 1ynt s TYR 604 Ca -0.05 -0.42 -0.09 0.00 -0.00 0.00 0.00 57.07 56.50 1ynt s TYR 604 Cb 0.17 -1.00 0.03 0.00 -0.00 0.00 0.00 41.96 41.16 1ynt s TYR 604 CO 0.64 0.37 0.17 -0.06 -0.00 0.00 0.00 175.55 176.67 1ynt s PHE 605 N -1.80 3.24 0.00 -3.49 2.99 -1.26 -4.55 117.98 113.10 1ynt s PHE 605 Ca 0.16 -1.07 0.00 0.00 0.00 0.00 0.00 56.93 56.03 1ynt s PHE 605 Cb -0.07 -2.38 0.00 0.00 0.00 0.00 0.00 43.02 40.57 1ynt s PHE 605 CO 0.07 -0.66 0.41 -0.25 -0.00 0.00 0.00 175.22 174.80 1ynt n ASP 606 N 4.94 0.00 -4.33 1.36 8.00 0.17 -4.86 116.55 121.83 1ynt n ASP 606 Ca -0.12 0.41 -0.26 0.00 0.71 0.00 0.00 54.79 55.53 1ynt n ASP 606 Cb 0.46 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.43 1ynt n ASP 606 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1ynt s TYR 607 N -0.82 2.02 0.27 1.24 1.51 -1.19 -4.96 117.35 115.42 1ynt s TYR 607 Ca 0.00 -0.40 0.09 0.00 -1.01 0.00 0.00 57.07 55.75 1ynt s TYR 607 Cb 0.00 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.70 1ynt s TYR 607 CO 0.00 0.25 0.01 -1.58 -1.11 0.00 0.00 175.55 173.13 1ynt s TRP 608 N -1.09 2.72 0.00 2.71 0.52 -1.26 -0.89 118.94 121.64 1ynt s TRP 608 Ca 0.10 -0.23 0.00 0.00 0.02 0.00 0.00 56.10 55.99 1ynt s TRP 608 Cb -0.10 -1.23 0.00 0.00 -1.15 0.00 0.00 33.47 30.99 1ynt s TRP 608 CO 0.05 0.60 0.00 0.41 0.02 0.00 0.00 176.95 178.03 1ynt n GLY 609 N -0.92 -0.26 0.00 0.98 0.00 0.37 -4.55 105.19 100.81 1ynt n GLY 609 Ca -0.06 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1ynt n GLY 609 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ynt n GLN 610 N 0.00 1.27 0.00 1.61 -0.00 -1.26 -4.96 117.38 114.04 1ynt n GLN 610 Ca 0.00 -1.03 0.00 0.00 -0.00 0.00 0.00 57.00 55.97 1ynt n GLN 610 Cb 0.00 -0.96 0.00 0.00 -0.00 0.00 0.00 30.24 29.28 1ynt n GLN 610 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ynt n GLY 611 N -0.27 -2.11 2.62 2.61 0.00 -1.26 -4.99 105.19 101.79 1ynt n GLY 611 Ca 0.00 -1.40 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 1ynt n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ynt s THR 612 N -3.55 0.21 0.10 2.61 2.01 -0.58 -4.83 115.64 111.62 1ynt s THR 612 Ca 0.00 -0.75 -0.31 0.00 0.31 0.00 0.00 61.69 60.94 1ynt s THR 612 Cb 0.00 -1.06 -0.09 0.00 0.01 0.00 0.00 72.50 71.37 1ynt s THR 612 CO 0.00 -0.56 1.64 -0.89 -0.69 0.00 0.00 174.62 174.11 1ynt s THR 613 N 1.97 2.90 -0.15 -0.82 2.01 -1.26 -2.75 115.64 117.54 1ynt s THR 613 Ca 0.06 0.46 -0.00 0.00 0.31 0.00 0.00 61.69 62.52 1ynt s THR 613 Cb -0.16 -3.30 -0.00 0.00 0.01 0.00 0.00 72.50 69.05 1ynt s THR 613 CO -0.25 0.01 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.33 1ynt s LEU 614 N 2.22 2.55 -0.25 4.42 2.96 0.14 -0.86 118.68 129.86 1ynt s LEU 614 Ca 0.73 -0.43 0.02 0.00 -0.22 0.00 0.00 54.13 54.22 1ynt s LEU 614 Cb -0.41 -1.58 0.06 0.00 0.50 0.00 0.00 46.19 44.76 1ynt s LEU 614 CO 0.32 0.10 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.49 1ynt s THR 615 N 0.75 1.76 -0.34 3.68 2.01 -0.52 0.05 115.64 123.04 1ynt s THR 615 Ca -0.06 -1.39 -0.16 0.00 0.31 0.00 0.00 61.69 60.39 1ynt s THR 615 Cb -0.15 -1.98 -0.01 0.00 0.01 0.00 0.00 72.50 70.36 1ynt s THR 615 CO 0.01 -0.09 0.39 -0.69 -0.69 0.00 0.00 174.62 173.55 1ynt s VAL 616 N 1.28 5.14 -0.20 3.82 1.01 -1.26 -1.58 120.40 128.61 1ynt s VAL 616 Ca -0.06 0.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.78 1ynt s VAL 616 Cb -0.19 -3.84 0.11 0.00 0.00 0.00 0.00 36.38 32.46 1ynt s VAL 616 CO -0.06 -0.09 0.92 -0.94 0.00 0.00 0.00 175.10 174.93 1ynt s SER 617 N 1.73 -0.50 -0.92 3.32 1.04 -0.05 -4.49 113.70 113.84 1ynt s SER 617 Ca 0.13 0.78 -0.01 0.00 0.48 0.00 0.00 55.95 57.33 1ynt s SER 617 Cb -0.16 0.72 0.26 0.00 0.10 0.00 0.00 66.02 66.94 1ynt s SER 617 CO 0.12 -0.30 1.03 -1.54 0.98 0.00 0.00 173.24 173.53 1ynt n SER 618 N 1.60 4.92 -3.86 7.02 3.41 -1.26 -4.02 113.62 121.42 1ynt n SER 618 Ca -0.13 -3.28 -0.19 0.00 -0.26 0.00 0.00 58.87 55.00 1ynt n SER 618 Cb 0.57 -1.06 -0.16 0.00 -0.26 0.00 0.00 64.21 63.29 1ynt n SER 618 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ynt s ALA 619 N -2.06 0.58 0.46 7.33 0.00 -1.26 -5.10 121.76 121.71 1ynt s ALA 619 Ca 0.32 -0.00 -0.19 0.00 0.00 0.00 0.00 51.96 52.09 1ynt s ALA 619 Cb 0.01 -0.42 -0.10 0.00 0.00 0.00 0.00 23.12 22.61 1ynt s ALA 619 CO -0.03 -0.07 0.96 0.15 0.00 0.00 0.00 175.76 176.78 1ynt s LYS 620 N 1.03 4.11 0.55 0.00 -0.14 -1.26 -5.00 119.74 119.04 1ynt s LYS 620 Ca -0.09 1.04 -0.20 0.00 -1.36 0.00 0.00 55.97 55.36 1ynt s LYS 620 Cb -0.14 -2.17 -0.06 0.00 -1.68 0.00 0.00 37.83 33.78 1ynt s LYS 620 CO -0.01 -0.12 0.97 2.41 -0.76 0.00 0.00 175.35 177.85 1ynt n THR 621 N -1.00 3.31 -3.65 2.17 -1.04 -1.26 -4.82 114.28 107.98 1ynt n THR 621 Ca 0.07 -0.50 -0.06 0.00 -2.04 0.00 0.00 64.05 61.52 1ynt n THR 621 Cb 0.54 -1.16 -0.07 0.00 -1.82 0.00 0.00 70.33 67.82 1ynt n THR 621 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ynt s THR 622 N -1.46 -0.79 0.43 12.58 2.01 -0.92 -4.98 115.64 122.51 1ynt s THR 622 Ca 0.72 0.10 -0.24 0.00 0.31 0.00 0.00 61.69 62.58 1ynt s THR 622 Cb -0.45 -0.80 -0.08 0.00 0.01 0.00 0.00 72.50 71.19 1ynt s THR 622 CO 0.50 0.04 1.23 0.00 -0.69 0.00 0.00 174.62 175.71 1ynt s ALA 623 N 2.72 3.10 0.45 7.40 0.00 -1.26 -3.01 121.76 131.16 1ynt s ALA 623 Ca -0.03 1.09 -0.20 0.00 0.00 0.00 0.00 51.96 52.81 1ynt s ALA 623 Cb -0.12 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 1ynt s ALA 623 CO -0.15 -0.76 0.96 -1.25 0.00 0.00 0.00 175.76 174.56 1ynt s PRO 624 N -2.46 4.14 -0.12 0.00 0.04 -1.26 -4.55 135.00 130.79 1ynt s PRO 624 Ca 0.60 1.12 -0.08 0.00 0.04 0.00 0.00 61.00 62.68 1ynt s PRO 624 Cb -0.34 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 1ynt s PRO 624 CO 0.42 -0.11 0.17 -1.12 0.04 0.00 0.00 177.00 176.40 1ynt s SER 625 N -2.28 6.40 -0.13 6.66 0.01 0.19 -4.93 113.70 119.62 1ynt s SER 625 Ca 0.62 0.48 0.02 0.00 1.31 0.00 0.00 55.95 58.38 1ynt s SER 625 Cb -0.10 -2.09 0.00 0.00 0.21 0.00 0.00 66.02 64.04 1ynt s SER 625 CO 0.16 0.35 -0.21 -0.69 0.41 0.00 0.00 173.24 173.27 1ynt s VAL 626 N -0.75 2.24 0.04 3.43 1.01 -1.26 -1.36 120.40 123.74 1ynt s VAL 626 Ca 0.15 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.27 1ynt s VAL 626 Cb -0.12 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 1ynt s VAL 626 CO 0.04 0.54 -0.22 -0.31 0.00 0.00 0.00 175.10 175.16 1ynt s TYR 627 N 0.68 1.90 0.54 5.22 2.02 -0.80 -5.00 117.35 121.91 1ynt s TYR 627 Ca -0.10 -0.38 -0.09 0.00 -0.37 0.00 0.00 57.07 56.14 1ynt s TYR 627 Cb -0.16 -1.14 -0.04 0.00 -0.40 0.00 0.00 41.96 40.22 1ynt s TYR 627 CO 0.01 0.09 0.90 -2.14 -1.57 0.00 0.00 175.55 172.84 1ynt s PRO 628 N -1.15 3.60 -0.57 -1.71 0.02 -1.26 -1.24 135.00 132.69 1ynt s PRO 628 Ca 0.08 0.49 0.04 0.00 0.02 0.00 0.00 61.00 61.64 1ynt s PRO 628 Cb -0.09 -2.24 0.17 0.00 0.02 0.00 0.00 34.50 32.36 1ynt s PRO 628 CO 0.02 -0.35 0.42 -0.51 -0.33 0.00 0.00 177.00 176.24 1ynt s LEU 629 N -4.83 3.27 0.17 -5.54 1.43 -1.12 -4.82 118.68 107.24 1ynt s LEU 629 Ca 0.51 -3.48 -0.17 0.00 -1.03 0.00 0.00 54.13 49.97 1ynt s LEU 629 Cb -0.11 -1.09 -0.07 0.00 0.03 0.00 0.00 46.19 44.95 1ynt s LEU 629 CO 0.47 -0.13 0.62 0.00 0.23 0.00 0.00 176.35 177.55 1ynt s ALA 630 N -0.74 3.51 1.05 4.21 0.00 -1.26 -2.49 121.76 126.04 1ynt s ALA 630 Ca 0.28 0.01 -0.16 0.00 0.00 0.00 0.00 51.96 52.09 1ynt s ALA 630 Cb -0.01 -2.66 0.08 0.00 0.00 0.00 0.00 23.12 20.52 1ynt s ALA 630 CO -0.18 0.40 0.18 -2.30 0.00 0.00 0.00 175.76 173.86 1ynt n PRO 631 N 0.91 -1.03 -2.79 0.00 -0.02 -1.26 -4.94 135.00 125.87 1ynt n PRO 631 Ca -0.05 -0.27 -0.33 0.00 -2.02 0.00 0.00 63.50 60.83 1ynt n PRO 631 Cb 0.51 -1.77 -0.06 0.00 -0.02 0.00 0.00 33.50 32.16 1ynt n PRO 631 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ynt s VAL 632 N -2.30 4.43 0.01 -1.45 1.01 -1.26 -4.69 120.40 116.15 1ynt s VAL 632 Ca 0.56 1.40 0.00 0.00 0.00 0.00 0.00 61.98 63.95 1ynt s VAL 632 Cb -0.16 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.62 1ynt s VAL 632 CO 0.67 -0.36 0.05 0.00 0.00 0.00 0.00 175.10 175.46 1ynt s GLY 634 N -3.50 0.01 0.30 0.00 0.00 -1.26 -5.14 107.32 97.74 1ynt s GLY 634 Ca -0.00 -0.51 0.04 0.00 0.00 0.00 0.00 44.72 44.25 1ynt s GLY 634 CO 0.03 2.51 0.45 0.51 0.00 0.00 0.00 173.10 176.60 1ynt s ASP 635 N 2.29 6.21 -0.62 1.64 1.47 -1.09 -4.97 116.67 121.60 1ynt s ASP 635 Ca 0.09 0.12 -0.26 0.00 1.18 0.00 0.00 52.55 53.69 1ynt s ASP 635 Cb -0.14 -1.75 -0.08 0.00 -0.34 0.00 0.00 42.92 40.60 1ynt s ASP 635 CO -0.34 -0.24 2.32 0.42 0.68 0.00 0.00 175.17 178.01 1ynt s THR 636 N -2.14 3.07 0.00 2.11 -4.23 -1.26 -4.74 115.64 108.46 1ynt s THR 636 Ca 0.39 -0.00 -0.00 0.00 -1.18 0.00 0.00 61.69 60.89 1ynt s THR 636 Cb -0.09 -3.18 -0.01 0.00 1.34 0.00 0.00 72.50 70.55 1ynt s THR 636 CO 0.32 -0.17 0.51 0.41 -0.54 0.00 0.00 174.62 175.15 1ynt n THR 637 N 8.15 0.34 0.00 3.99 -1.04 -1.26 -4.72 114.28 119.74 1ynt n THR 637 Ca 0.38 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 62.27 1ynt n THR 637 Cb 0.50 -1.24 0.00 0.00 -1.82 0.00 0.00 70.33 67.77 1ynt n THR 637 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ynt n GLY 638 N 2.27 -3.25 0.14 3.41 0.00 -1.26 -4.86 105.19 101.63 1ynt n GLY 638 Ca 0.02 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 1ynt n GLY 638 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ynt h SER 639 N 0.00 0.48 -2.77 1.61 0.02 -1.97 -3.43 113.55 107.48 1ynt h SER 639 Ca 0.00 -0.42 -0.52 0.00 -0.84 0.00 0.00 61.79 60.01 1ynt h SER 639 Cb 0.00 -0.15 -0.14 0.00 0.14 0.00 0.00 62.40 62.25 1ynt h SER 639 CO 0.00 1.24 -0.74 -0.94 -1.14 0.00 0.00 176.83 175.26 1ynt s SER 640 N -7.09 3.01 0.02 3.07 1.04 -1.26 -2.17 113.70 110.32 1ynt s SER 640 Ca -0.05 -1.04 0.05 0.00 0.48 0.00 0.00 55.95 55.39 1ynt s SER 640 Cb 0.08 -0.21 -0.02 0.00 0.10 0.00 0.00 66.02 65.98 1ynt s SER 640 CO 0.87 -0.11 -0.16 0.54 0.98 0.00 0.00 173.24 175.36 1ynt s VAL 641 N -2.79 1.29 -0.08 5.02 0.11 0.19 -4.52 120.40 119.62 1ynt s VAL 641 Ca 0.26 -0.94 0.03 0.00 -2.93 0.00 0.00 61.98 58.40 1ynt s VAL 641 Cb -0.02 -1.12 -0.02 0.00 -1.53 0.00 0.00 36.38 33.69 1ynt s VAL 641 CO 0.11 0.17 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.97 1ynt s THR 642 N -0.68 2.69 0.33 5.04 2.01 -1.26 -0.35 115.64 123.42 1ynt s THR 642 Ca 0.05 -0.83 0.09 0.00 0.31 0.00 0.00 61.69 61.31 1ynt s THR 642 Cb -0.07 -2.05 -0.06 0.00 0.01 0.00 0.00 72.50 70.32 1ynt s THR 642 CO 0.01 0.56 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.65 1ynt s LEU 643 N -0.21 2.69 0.00 4.42 1.43 0.19 -4.56 118.68 122.64 1ynt s LEU 643 Ca -0.01 -1.19 0.03 0.00 -1.03 0.00 0.00 54.13 51.93 1ynt s LEU 643 Cb -0.13 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.13 1ynt s LEU 643 CO 0.03 -0.22 0.15 0.61 0.23 0.00 0.00 176.35 177.15 1ynt n GLY 644 N -0.76 3.35 3.62 -3.19 0.00 -1.04 -0.39 105.19 106.78 1ynt n GLY 644 Ca -0.05 -1.71 -0.03 0.00 0.00 0.00 0.00 46.02 44.23 1ynt n GLY 644 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynt s LEU 646 N 2.40 3.16 -0.48 0.00 2.96 -0.37 -1.46 118.68 124.88 1ynt s LEU 646 Ca -0.07 -0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 53.48 1ynt s LEU 646 Cb -0.09 -1.82 0.13 0.00 0.50 0.00 0.00 46.19 44.90 1ynt s LEU 646 CO -0.19 -0.03 0.31 -0.69 -1.32 0.00 0.00 176.35 174.43 1ynt s VAL 647 N 1.54 3.74 0.25 1.68 1.01 0.85 -1.90 120.40 127.58 1ynt s VAL 647 Ca 0.06 -2.15 0.08 0.00 0.00 0.00 0.00 61.98 59.98 1ynt s VAL 647 Cb -0.15 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 1ynt s VAL 647 CO -0.00 -0.76 -0.12 -1.59 0.00 0.00 0.00 175.10 172.63 1ynt s LYS 648 N 0.97 1.50 0.00 2.72 -2.85 -0.47 0.20 119.74 121.81 1ynt s LYS 648 Ca 0.09 -1.71 0.00 0.00 -1.00 0.00 0.00 55.97 53.35 1ynt s LYS 648 Cb -0.23 -1.27 0.00 0.00 -2.06 0.00 0.00 37.83 34.27 1ynt s LYS 648 CO -0.03 0.15 0.00 0.41 0.10 0.00 0.00 175.35 175.98 1ynt n GLY 649 N -0.52 0.76 3.78 0.59 0.00 -1.14 0.56 105.19 109.22 1ynt n GLY 649 Ca -0.06 -0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 1ynt n GLY 649 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ynt s TYR 650 N -2.00 2.75 -0.28 1.61 1.13 -0.93 -4.43 117.35 115.19 1ynt s TYR 650 Ca 0.00 -0.40 -0.26 0.00 -1.41 0.00 0.00 57.07 55.01 1ynt s TYR 650 Cb 0.00 -1.78 0.16 0.00 -1.10 0.00 0.00 41.96 39.24 1ynt s TYR 650 CO 0.00 0.22 1.23 0.12 -2.51 0.00 0.00 175.55 174.62 1ynt s PHE 651 N -2.42 -0.26 0.71 -3.49 5.36 -1.16 0.90 117.98 117.62 1ynt s PHE 651 Ca 0.40 0.61 -0.11 0.00 -0.96 0.00 0.00 56.93 56.87 1ynt s PHE 651 Cb -0.03 0.43 0.01 0.00 -0.34 0.00 0.00 43.02 43.09 1ynt s PHE 651 CO 0.24 -0.14 1.09 -1.25 -1.46 0.00 0.00 175.22 173.71 1ynt s PRO 652 N -0.01 2.86 0.63 10.12 0.04 -1.26 -2.18 135.00 145.20 1ynt s PRO 652 Ca 0.05 0.48 0.03 0.00 0.04 0.00 0.00 61.00 61.60 1ynt s PRO 652 Cb -0.05 -2.02 0.09 0.00 0.04 0.00 0.00 34.50 32.56 1ynt s PRO 652 CO -0.10 -1.04 0.99 -1.91 0.04 0.00 0.00 177.00 174.98 1ynt n GLU 653 N -3.01 0.03 -2.69 4.56 2.13 -1.26 -4.73 120.64 115.66 1ynt n GLU 653 Ca 0.07 0.92 -0.41 0.00 0.66 0.00 0.00 57.16 58.40 1ynt n GLU 653 Cb 0.57 -2.46 -0.05 0.00 0.27 0.00 0.00 31.44 29.77 1ynt n GLU 653 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1ynt s PRO 654 N -3.92 4.74 -0.30 5.31 0.02 -1.26 -5.00 135.00 134.60 1ynt s PRO 654 Ca -0.00 1.52 -0.05 0.00 0.02 0.00 0.00 61.00 62.49 1ynt s PRO 654 Cb 0.01 -3.32 0.19 0.00 0.02 0.00 0.00 34.50 31.41 1ynt s PRO 654 CO 0.05 0.31 0.85 0.54 -0.33 0.00 0.00 177.00 178.41 1ynt s VAL 655 N -0.54 -0.60 0.31 3.83 0.11 -1.26 -4.61 120.40 117.65 1ynt s VAL 655 Ca 0.45 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.21 1ynt s VAL 655 Cb -0.26 -0.70 -0.11 0.00 -1.53 0.00 0.00 36.38 33.79 1ynt s VAL 655 CO 0.32 0.00 1.44 -0.89 -3.33 0.00 0.00 175.10 172.64 1ynt s THR 656 N 2.90 2.43 -0.17 5.04 2.01 -0.26 -4.86 115.64 122.73 1ynt s THR 656 Ca 0.17 0.39 -0.05 0.00 0.31 0.00 0.00 61.69 62.51 1ynt s THR 656 Cb -0.07 -3.25 0.08 0.00 0.01 0.00 0.00 72.50 69.27 1ynt s THR 656 CO -0.22 0.08 0.30 -0.22 -0.69 0.00 0.00 174.62 173.87 1ynt s LEU 657 N -1.20 -0.37 0.12 4.42 1.98 -1.26 -0.24 118.68 122.13 1ynt s LEU 657 Ca 0.56 0.45 0.04 0.00 -2.89 0.00 0.00 54.13 52.28 1ynt s LEU 657 Cb -0.43 0.81 -0.04 0.00 0.66 0.00 0.00 46.19 47.18 1ynt s LEU 657 CO 0.52 -0.26 -0.11 0.42 -1.89 0.00 0.00 176.35 175.02 1ynt s THR 658 N 2.45 1.11 -0.20 3.68 -4.23 0.56 -4.99 115.64 114.02 1ynt s THR 658 Ca 0.04 -1.85 -0.05 0.00 -1.18 0.00 0.00 61.69 58.65 1ynt s THR 658 Cb -0.13 -1.62 -0.02 0.00 1.34 0.00 0.00 72.50 72.07 1ynt s THR 658 CO -0.11 -0.63 -0.00 0.26 -0.54 0.00 0.00 174.62 173.60 1ynt s TRP 659 N -2.81 3.04 -1.40 3.99 0.52 -1.26 -0.41 118.94 120.60 1ynt s TRP 659 Ca 0.11 -0.46 0.00 0.00 0.02 0.00 0.00 56.10 55.77 1ynt s TRP 659 Cb -0.01 -2.08 0.00 0.00 -1.15 0.00 0.00 33.47 30.24 1ynt s TRP 659 CO 0.01 -0.23 0.00 0.09 0.02 0.00 0.00 176.95 176.83 1ynt n ASN 660 N 4.21 -4.47 -2.46 2.95 5.03 0.62 -2.14 115.26 119.00 1ynt n ASN 660 Ca -0.17 0.19 -0.11 0.00 0.87 0.00 0.00 54.58 55.36 1ynt n ASN 660 Cb 0.52 -3.84 0.05 0.00 -1.02 0.00 0.00 39.78 35.49 1ynt n ASN 660 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1ynt n SER 661 N -1.58 -2.59 0.00 6.41 7.64 -1.26 -3.30 113.62 118.95 1ynt n SER 661 Ca -0.18 -0.37 0.00 0.00 1.01 0.00 0.00 58.87 59.34 1ynt n SER 661 Cb 0.60 -3.30 0.00 0.00 -1.01 0.00 0.00 64.21 60.50 1ynt n SER 661 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ynt n GLY 662 N -1.15 2.58 0.34 0.23 0.00 -0.91 -4.89 105.19 101.39 1ynt n GLY 662 Ca -0.14 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.93 1ynt n GLY 662 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ynt h SER 663 N 0.00 0.82 -3.76 1.61 0.02 -1.52 -3.37 113.55 107.34 1ynt h SER 663 Ca 0.00 0.05 -0.63 0.00 -0.84 0.00 0.00 61.79 60.37 1ynt h SER 663 Cb 0.00 -0.12 -0.15 0.00 0.14 0.00 0.00 62.40 62.27 1ynt h SER 663 CO 0.00 0.45 -0.42 -0.76 -1.14 0.00 0.00 176.83 174.97 1ynt s LEU 664 N -10.25 4.05 0.09 5.07 1.02 -1.07 -4.94 118.68 112.66 1ynt s LEU 664 Ca -0.12 0.13 0.00 0.00 0.02 0.00 0.00 54.13 54.16 1ynt s LEU 664 Cb 0.21 -2.23 0.00 0.00 0.02 0.00 0.00 46.19 44.19 1ynt s LEU 664 CO 0.80 -0.07 0.00 -1.20 0.02 0.00 0.00 176.35 175.90 1ynt n SER 665 N 4.94 0.44 -4.77 2.29 7.64 -1.26 -4.50 113.62 118.41 1ynt n SER 665 Ca -0.12 0.14 -0.39 0.00 1.01 0.00 0.00 58.87 59.51 1ynt n SER 665 Cb 0.52 -0.07 -0.03 0.00 -1.01 0.00 0.00 64.21 63.61 1ynt n SER 665 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ynt s SER 666 N -5.31 6.90 0.00 6.43 1.04 -1.26 -2.19 113.70 119.31 1ynt s SER 666 Ca 0.00 2.28 0.00 0.00 0.48 0.00 0.00 55.95 58.71 1ynt s SER 666 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1ynt s SER 666 CO 0.00 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.42 1ynt n GLY 667 N 0.81 1.62 3.88 7.32 0.00 -1.26 -4.84 105.19 112.72 1ynt n GLY 667 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1ynt n GLY 667 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynt s VAL 668 N -2.37 4.80 -0.30 1.61 1.01 -0.93 -2.47 120.40 121.75 1ynt s VAL 668 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1ynt s VAL 668 Cb 0.00 -3.82 0.19 0.00 0.00 0.00 0.00 36.38 32.75 1ynt s VAL 668 CO 0.00 -0.81 0.64 -1.00 0.00 0.00 0.00 175.10 173.92 1ynt s HIS 669 N -2.73 -1.60 -0.16 5.22 3.76 0.00 -4.95 115.29 114.83 1ynt s HIS 669 Ca 0.51 1.38 -0.02 0.00 -0.15 0.00 0.00 55.06 56.78 1ynt s HIS 669 Cb -0.10 0.44 -0.02 0.00 1.11 0.00 0.00 32.58 34.01 1ynt s HIS 669 CO 0.42 -0.90 -0.07 -0.08 -0.85 0.00 0.00 174.74 173.26 1ynt s THR 670 N 2.86 3.46 0.33 1.30 -1.32 -1.26 0.27 115.64 121.27 1ynt s THR 670 Ca 0.16 -0.50 -0.06 0.00 -1.21 0.00 0.00 61.69 60.07 1ynt s THR 670 Cb -0.13 -2.51 -0.05 0.00 -1.51 0.00 0.00 72.50 68.30 1ynt s THR 670 CO -0.22 0.49 0.63 -0.36 -2.21 0.00 0.00 174.62 172.94 1ynt s PHE 671 N 0.63 3.48 0.70 9.09 0.40 0.26 -4.96 117.98 127.58 1ynt s PHE 671 Ca -0.04 0.76 -0.16 0.00 -0.60 0.00 0.00 56.93 56.88 1ynt s PHE 671 Cb -0.15 -2.21 0.01 0.00 0.51 0.00 0.00 43.02 41.18 1ynt s PHE 671 CO 0.03 0.07 1.15 -0.35 0.70 0.00 0.00 175.22 176.81 1ynt n PRO 672 N -1.13 0.73 -2.16 0.24 -0.04 -1.26 -4.25 135.00 127.12 1ynt n PRO 672 Ca -0.00 0.31 -0.38 0.00 -0.04 0.00 0.00 63.50 63.38 1ynt n PRO 672 Cb 0.54 -2.39 -0.01 0.00 -0.04 0.00 0.00 33.50 31.60 1ynt n PRO 672 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ynt s ALA 673 N -1.67 3.10 -0.11 0.55 0.00 -1.26 -4.81 121.76 117.57 1ynt s ALA 673 Ca 0.78 1.07 0.04 0.00 0.00 0.00 0.00 51.96 53.84 1ynt s ALA 673 Cb -0.36 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1ynt s ALA 673 CO 0.46 -0.73 -0.23 0.08 0.00 0.00 0.00 175.76 175.33 1ynt s VAL 674 N -1.39 2.07 -0.05 0.00 1.01 -1.02 -4.96 120.40 116.06 1ynt s VAL 674 Ca 0.60 -1.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.42 1ynt s VAL 674 Cb -0.33 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 1ynt s VAL 674 CO 0.41 0.56 0.40 -0.22 0.00 0.00 0.00 175.10 176.25 1ynt s LEU 675 N 0.42 4.40 -0.20 3.92 1.98 -1.26 -1.94 118.68 126.00 1ynt s LEU 675 Ca -0.17 0.86 -0.29 0.00 -2.89 0.00 0.00 54.13 51.65 1ynt s LEU 675 Cb -0.18 -2.57 0.13 0.00 0.66 0.00 0.00 46.19 44.24 1ynt s LEU 675 CO 0.07 0.23 1.03 0.00 -1.89 0.00 0.00 176.35 175.79 1ynt s GLN 676 N -0.52 0.54 -1.48 1.98 1.03 -0.61 -4.91 119.66 115.69 1ynt s GLN 676 Ca 0.23 0.25 -0.06 0.00 0.04 0.00 0.00 55.36 55.82 1ynt s GLN 676 Cb -0.16 0.26 0.02 0.00 0.03 0.00 0.00 33.01 33.16 1ynt s GLN 676 CO 0.11 -0.14 0.60 0.43 -2.54 0.00 0.00 175.29 173.75 1ynt n SER 677 N 1.12 -5.47 -3.28 12.60 7.64 -1.26 -0.47 113.62 124.50 1ynt n SER 677 Ca -0.10 -0.33 -0.18 0.00 1.01 0.00 0.00 58.87 59.27 1ynt n SER 677 Cb 0.57 -4.44 -0.02 0.00 -1.01 0.00 0.00 64.21 59.31 1ynt n SER 677 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ynt n ASP 678 N -2.48 -1.97 -3.86 6.43 10.43 -1.26 -4.89 116.55 118.94 1ynt n ASP 678 Ca -0.08 -0.22 -0.12 0.00 2.57 0.00 0.00 54.79 56.94 1ynt n ASP 678 Cb 0.60 -1.74 -0.13 0.00 1.84 0.00 0.00 41.12 41.69 1ynt n ASP 678 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ynt s LEU 679 N -6.00 1.78 0.28 0.64 1.43 0.38 -4.95 118.68 112.24 1ynt s LEU 679 Ca 0.33 0.07 -0.11 0.00 -1.03 0.00 0.00 54.13 53.39 1ynt s LEU 679 Cb -0.19 0.24 -0.07 0.00 0.03 0.00 0.00 46.19 46.19 1ynt s LEU 679 CO 0.40 -0.06 0.63 -0.31 0.23 0.00 0.00 176.35 177.24 1ynt s TYR 680 N -0.15 3.42 -0.01 0.29 2.02 0.26 -1.57 117.35 121.60 1ynt s TYR 680 Ca -0.02 0.97 0.04 0.00 -0.37 0.00 0.00 57.07 57.69 1ynt s TYR 680 Cb -0.02 -2.35 -0.01 0.00 -0.40 0.00 0.00 41.96 39.19 1ynt s TYR 680 CO 0.00 0.17 -0.12 0.99 -1.57 0.00 0.00 175.55 175.02 1ynt s THR 681 N -1.94 0.95 0.01 -0.71 2.01 -0.82 -2.20 115.64 112.93 1ynt s THR 681 Ca 0.50 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.95 1ynt s THR 681 Cb -0.11 -0.79 -0.01 0.00 0.01 0.00 0.00 72.50 71.60 1ynt s THR 681 CO 0.22 0.27 0.06 -0.22 -0.69 0.00 0.00 174.62 174.25 1ynt s LEU 682 N -0.27 1.87 0.08 4.42 0.20 0.53 -2.43 118.68 123.07 1ynt s LEU 682 Ca 0.04 -0.31 0.01 0.00 0.69 0.00 0.00 54.13 54.56 1ynt s LEU 682 Cb -0.05 0.39 -0.04 0.00 -0.43 0.00 0.00 46.19 46.06 1ynt s LEU 682 CO -0.00 -0.31 -0.05 -0.94 -0.29 0.00 0.00 176.35 174.75 1ynt s SER 683 N -1.31 0.86 -0.07 3.68 1.04 -1.26 0.29 113.70 116.93 1ynt s SER 683 Ca -0.14 -1.00 -0.15 0.00 0.48 0.00 0.00 55.95 55.14 1ynt s SER 683 Cb -0.08 0.14 0.03 0.00 0.10 0.00 0.00 66.02 66.21 1ynt s SER 683 CO 0.00 -0.52 0.36 -0.55 0.98 0.00 0.00 173.24 173.51 1ynt s SER 684 N -2.98 -0.30 0.16 7.02 0.15 -0.54 -0.57 113.70 116.64 1ynt s SER 684 Ca 0.10 0.41 0.07 0.00 0.70 0.00 0.00 55.95 57.22 1ynt s SER 684 Cb 0.06 0.52 -0.04 0.00 -1.71 0.00 0.00 66.02 64.85 1ynt s SER 684 CO -0.07 -0.32 -0.15 -0.94 1.20 0.00 0.00 173.24 172.97 1ynt s SER 685 N -0.66 2.30 0.01 5.45 1.04 0.14 -1.04 113.70 120.94 1ynt s SER 685 Ca -0.08 -0.91 -0.01 0.00 0.48 0.00 0.00 55.95 55.43 1ynt s SER 685 Cb -0.04 -0.10 -0.01 0.00 0.10 0.00 0.00 66.02 65.97 1ynt s SER 685 CO 0.03 -0.15 0.00 0.54 0.98 0.00 0.00 173.24 174.64 1ynt s VAL 686 N -2.54 0.05 -0.09 5.02 0.11 0.47 -0.82 120.40 122.61 1ynt s VAL 686 Ca 0.16 -0.44 0.01 0.00 -2.93 0.00 0.00 61.98 58.78 1ynt s VAL 686 Cb -0.03 -0.15 0.02 0.00 -1.53 0.00 0.00 36.38 34.69 1ynt s VAL 686 CO 0.05 -0.24 -0.10 -0.89 -3.33 0.00 0.00 175.10 170.59 1ynt s THR 687 N -0.71 1.08 0.43 5.04 2.01 -1.03 0.53 115.64 122.98 1ynt s THR 687 Ca -0.08 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 61.58 1ynt s THR 687 Cb -0.05 -1.05 -0.02 0.00 0.01 0.00 0.00 72.50 71.39 1ynt s THR 687 CO -0.00 0.36 0.09 -0.69 -0.69 0.00 0.00 174.62 173.69 1ynt s VAL 688 N 1.28 0.79 -0.07 3.82 1.01 0.52 -4.81 120.40 122.94 1ynt s VAL 688 Ca -0.03 -2.00 -0.30 0.00 0.00 0.00 0.00 61.98 59.65 1ynt s VAL 688 Cb -0.14 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 1ynt s VAL 688 CO -0.04 0.00 1.44 0.42 0.00 0.00 0.00 175.10 176.93 1ynt s THR 689 N -3.12 3.86 0.33 3.92 -4.23 -1.26 0.55 115.64 115.68 1ynt s THR 689 Ca 0.20 1.11 0.00 0.00 -1.18 0.00 0.00 61.69 61.82 1ynt s THR 689 Cb 0.03 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 70.15 1ynt s THR 689 CO 0.12 -0.07 0.74 -1.20 -0.54 0.00 0.00 174.62 173.67 1ynt n SER 690 N 6.41 0.00 -0.06 3.99 7.64 -0.92 0.13 113.62 130.81 1ynt n SER 690 Ca 0.15 0.25 -0.10 0.00 1.01 0.00 0.00 58.87 60.18 1ynt n SER 690 Cb 0.44 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.49 1ynt n SER 690 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ynt n SER 691 N -1.73 0.60 0.00 6.43 3.41 -1.26 -4.21 113.62 116.86 1ynt n SER 691 Ca 0.00 0.23 0.02 0.00 -0.26 0.00 0.00 58.87 58.85 1ynt n SER 691 Cb 0.74 0.33 0.10 0.00 -0.26 0.00 0.00 64.21 65.12 1ynt n SER 691 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1ynt n THR 692 N -2.95 0.00 -3.72 6.66 -1.04 0.35 -4.39 114.28 109.20 1ynt n THR 692 Ca -0.25 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.63 1ynt n THR 692 Cb 1.09 -0.88 -0.09 0.00 -1.82 0.00 0.00 70.33 68.63 1ynt n THR 692 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1ynt s TRP 693 N -2.00 -0.43 -1.85 -1.42 -0.00 -1.25 -2.37 118.94 109.61 1ynt s TRP 693 Ca 0.05 0.99 0.22 0.00 -0.00 0.00 0.00 56.10 57.37 1ynt s TRP 693 Cb 0.02 0.17 1.29 0.00 -0.00 0.00 0.00 33.47 34.95 1ynt s TRP 693 CO 0.04 -0.29 1.72 -2.30 -0.00 0.00 0.00 176.95 176.12 1ynt n PRO 694 N 2.39 0.61 0.00 5.86 -0.02 -1.26 -4.95 135.00 137.63 1ynt n PRO 694 Ca -0.15 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1ynt n PRO 694 Cb 0.57 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 1ynt n PRO 694 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ynt n SER 695 N -1.07 0.00 -4.85 2.55 7.64 -1.26 -4.13 113.62 112.50 1ynt n SER 695 Ca 0.15 0.64 -0.31 0.00 1.01 0.00 0.00 58.87 60.37 1ynt n SER 695 Cb 0.10 -0.20 0.03 0.00 -1.01 0.00 0.00 64.21 63.14 1ynt n SER 695 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1ynt s GLN 696 N -1.90 3.15 0.02 1.43 1.11 -1.00 -5.04 119.66 117.43 1ynt s GLN 696 Ca 0.00 0.73 0.02 0.00 0.01 0.00 0.00 55.36 56.11 1ynt s GLN 696 Cb 0.00 -2.03 -0.04 0.00 -1.01 0.00 0.00 33.01 29.93 1ynt s GLN 696 CO 0.00 -0.89 0.04 -1.54 0.01 0.00 0.00 175.29 172.91 1ynt s SER 697 N -4.10 5.39 -0.04 5.90 1.04 -1.26 -4.51 113.70 116.11 1ynt s SER 697 Ca 0.57 0.03 0.06 0.00 0.48 0.00 0.00 55.95 57.08 1ynt s SER 697 Cb -0.12 -1.45 -0.02 0.00 0.10 0.00 0.00 66.02 64.53 1ynt s SER 697 CO 0.54 0.24 -0.22 -0.63 0.98 0.00 0.00 173.24 174.15 1ynt s ILE 698 N -1.21 2.37 0.01 -1.02 1.01 -1.26 -5.01 121.20 116.08 1ynt s ILE 698 Ca 0.23 -0.98 0.03 0.00 0.00 0.00 0.00 60.65 59.93 1ynt s ILE 698 Cb -0.12 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.47 1ynt s ILE 698 CO 0.15 0.58 -0.08 -0.89 0.00 0.00 0.00 174.94 174.69 1ynt s THR 699 N -0.47 0.63 -0.60 2.92 2.01 -1.26 -1.84 115.64 117.03 1ynt s THR 699 Ca 0.06 -0.56 -0.12 0.00 0.31 0.00 0.00 61.69 61.38 1ynt s THR 699 Cb -0.11 -0.57 0.15 0.00 0.01 0.00 0.00 72.50 71.98 1ynt s THR 699 CO 0.01 0.02 0.51 0.00 -0.69 0.00 0.00 174.62 174.48 1ynt s ASN 701 N 2.61 6.72 0.12 0.00 -0.87 0.45 -2.29 114.94 121.69 1ynt s ASN 701 Ca 0.09 0.66 0.10 0.00 -1.57 0.00 0.00 52.86 52.14 1ynt s ASN 701 Cb -0.23 -2.48 -0.04 0.00 -0.02 0.00 0.00 41.25 38.48 1ynt s ASN 701 CO -0.02 -0.88 -0.23 -0.69 -2.57 0.00 0.00 177.10 172.71 1ynt s VAL 702 N 3.57 2.54 -0.08 1.60 1.01 0.24 -0.33 120.40 128.94 1ynt s VAL 702 Ca 0.40 -1.63 -0.14 0.00 0.00 0.00 0.00 61.98 60.61 1ynt s VAL 702 Cb -0.12 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 34.15 1ynt s VAL 702 CO 0.19 0.10 0.35 0.00 0.00 0.00 0.00 175.10 175.74 1ynt s ALA 703 N -1.09 -0.88 -0.40 5.51 0.00 0.67 -0.93 121.76 124.64 1ynt s ALA 703 Ca 0.16 0.75 0.01 0.00 0.00 0.00 0.00 51.96 52.88 1ynt s ALA 703 Cb -0.10 -0.31 0.13 0.00 0.00 0.00 0.00 23.12 22.84 1ynt s ALA 703 CO 0.08 -0.21 0.21 -1.58 0.00 0.00 0.00 175.76 174.26 1ynt s HIS 704 N -0.47 1.65 0.39 0.00 2.46 -1.06 -1.10 115.29 117.16 1ynt s HIS 704 Ca -0.06 -2.14 0.19 0.00 0.47 0.00 0.00 55.06 53.52 1ynt s HIS 704 Cb -0.04 -1.64 1.13 0.00 -0.13 0.00 0.00 32.58 31.90 1ynt s HIS 704 CO 0.02 -0.81 1.73 -1.35 -2.47 0.00 0.00 174.74 171.86 1ynt h PRO 705 N 7.00 0.35 0.00 2.88 0.11 -1.83 -0.37 132.00 140.14 1ynt h PRO 705 Ca -0.01 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 1ynt h PRO 705 Cb 0.95 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 1ynt h PRO 705 CO 0.43 0.23 -0.03 0.00 -0.21 0.00 0.00 178.00 178.42 1ynt h ALA 706 N 1.66 1.15 0.00 -0.75 0.00 -1.92 -2.81 119.26 116.58 1ynt h ALA 706 Ca 0.66 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.54 1ynt h ALA 706 Cb 1.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1ynt h ALA 706 CO -0.38 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 177.79 1ynt n SER 707 N -3.34 1.60 -3.73 0.00 3.41 -0.24 -4.96 113.62 106.35 1ynt n SER 707 Ca -0.02 -1.77 -0.27 0.00 -0.26 0.00 0.00 58.87 56.55 1ynt n SER 707 Cb 0.17 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.14 1ynt n SER 707 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ynt n SER 708 N -0.39 -3.18 -4.53 4.04 7.64 -0.63 -4.98 113.62 111.60 1ynt n SER 708 Ca 0.00 -0.96 -0.24 0.00 1.01 0.00 0.00 58.87 58.69 1ynt n SER 708 Cb 0.28 -3.54 -0.09 0.00 -1.01 0.00 0.00 64.21 59.85 1ynt n SER 708 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ynt s THR 709 N -3.63 2.74 -0.22 0.44 2.01 -1.13 -5.01 115.64 110.85 1ynt s THR 709 Ca 0.25 -2.25 -0.16 0.00 0.31 0.00 0.00 61.69 59.83 1ynt s THR 709 Cb -0.08 -2.48 0.06 0.00 0.01 0.00 0.00 72.50 70.01 1ynt s THR 709 CO 0.85 -0.38 0.56 -0.54 -0.69 0.00 0.00 174.62 174.42 1ynt s LYS 710 N -3.57 0.61 0.03 4.92 1.02 -1.26 -2.57 119.74 118.92 1ynt s LYS 710 Ca 0.31 0.89 0.01 0.00 0.02 0.00 0.00 55.97 57.20 1ynt s LYS 710 Cb -0.05 0.20 -0.02 0.00 -0.52 0.00 0.00 37.83 37.44 1ynt s LYS 710 CO 0.17 -0.11 -0.06 0.08 -0.92 0.00 0.00 175.35 174.51 1ynt s VAL 711 N 0.86 0.35 -0.51 3.17 1.01 -0.11 -5.01 120.40 120.16 1ynt s VAL 711 Ca -0.04 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.03 1ynt s VAL 711 Cb -0.05 -0.44 0.17 0.00 0.00 0.00 0.00 36.38 36.06 1ynt s VAL 711 CO -0.07 -0.40 0.39 -1.81 0.00 0.00 0.00 175.10 173.21 1ynt s ASP 712 N -1.43 2.56 -0.53 3.32 -0.00 -1.26 -0.59 116.67 118.74 1ynt s ASP 712 Ca -0.12 -3.32 -0.27 0.00 -0.00 0.00 0.00 52.55 48.85 1ynt s ASP 712 Cb -0.09 -0.83 0.03 0.00 -0.00 0.00 0.00 42.92 42.03 1ynt s ASP 712 CO -0.00 -0.14 1.05 -0.75 -0.00 0.00 0.00 175.17 175.33 1ynt s LYS 713 N -0.43 3.49 0.43 8.23 2.47 -0.97 -4.85 119.74 128.12 1ynt s LYS 713 Ca 0.30 0.13 -0.23 0.00 -1.56 0.00 0.00 55.97 54.61 1ynt s LYS 713 Cb 0.01 -3.99 -0.09 0.00 -1.46 0.00 0.00 37.83 32.30 1ynt s LYS 713 CO -0.19 -1.48 1.06 0.21 0.16 0.00 0.00 175.35 175.11 1ynt s LYS 714 N 4.33 4.00 -0.21 4.03 2.20 -1.26 -2.00 119.74 130.83 1ynt s LYS 714 Ca 0.39 1.49 -0.17 0.00 -0.36 0.00 0.00 55.97 57.32 1ynt s LYS 714 Cb -0.09 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.81 1ynt s LYS 714 CO 0.25 -0.28 0.44 0.42 -0.36 0.00 0.00 175.35 175.83 1ynt s ILE 715 N -1.75 5.16 0.13 5.43 -1.09 -0.77 -4.89 121.20 123.42 1ynt s ILE 715 Ca 0.61 0.79 0.09 0.00 -2.23 0.00 0.00 60.65 59.92 1ynt s ILE 715 Cb -0.21 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.86 1ynt s ILE 715 CO 0.26 0.21 -0.17 -1.61 -1.23 0.00 0.00 174.94 172.39 1ynt s GLU 716 N 1.56 1.80 1.01 2.79 0.41 -1.26 -4.63 118.70 120.38 1ynt s GLU 716 Ca 0.21 -1.21 -0.13 0.00 -0.41 0.00 0.00 54.97 53.43 1ynt s GLU 716 Cb -0.15 -2.10 0.19 0.00 -1.78 0.00 0.00 34.13 30.29 1ynt s GLU 716 CO 0.09 0.47 1.10 -1.25 -0.49 0.00 0.00 175.26 175.18 1ynt s PRO 717 N -2.26 0.34 0.00 0.39 0.04 -1.26 -4.70 135.00 127.55 1ynt s PRO 717 Ca 0.19 0.42 0.28 0.00 0.04 0.00 0.00 61.00 61.92 1ynt s PRO 717 Cb -0.10 -1.73 0.98 0.00 0.04 0.00 0.00 34.50 33.68 1ynt s PRO 717 CO 0.11 -2.77 1.70 0.54 0.04 0.00 0.00 177.00 176.62