#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrh h LEU 502 N 0.00 0.00 -2.78 0.99 5.85 -1.93 -2.39 115.31 115.06 2wrh h LEU 502 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2wrh h LEU 502 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2wrh h LEU 502 CO 0.00 0.14 0.00 0.49 -0.34 0.00 0.00 178.44 178.73 2wrh n PHE 503 N -3.41 0.38 -1.21 1.25 3.01 -1.26 -5.01 117.46 111.20 2wrh n PHE 503 Ca -0.01 -0.46 -0.07 0.00 1.01 0.00 0.00 57.45 57.92 2wrh n PHE 503 Cb 0.32 -0.03 -0.03 0.00 -0.01 0.00 0.00 39.48 39.73 2wrh n PHE 503 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wrh n GLY 504 N 0.42 0.79 0.00 1.37 0.00 -0.90 -4.86 105.19 102.01 2wrh n GLY 504 Ca 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2wrh n GLY 504 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrh n ALA 505 N 1.14 0.00 -1.77 4.61 0.00 -1.26 -1.59 120.51 121.63 2wrh n ALA 505 Ca -0.07 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 2wrh n ALA 505 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.89 2wrh n ALA 505 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wrh s ILE 506 N -0.96 2.72 0.00 0.00 1.09 -1.26 -1.02 121.20 121.77 2wrh s ILE 506 Ca 0.00 0.16 0.00 0.00 -1.10 0.00 0.00 60.65 59.71 2wrh s ILE 506 Cb 0.00 -3.11 0.00 0.00 -1.06 0.00 0.00 42.46 38.29 2wrh s ILE 506 CO 0.00 -0.00 0.00 0.00 -0.10 0.00 0.00 174.94 174.84 2wrh n ALA 507 N 5.87 0.00 -2.00 9.38 0.00 -1.16 -4.57 120.51 128.03 2wrh n ALA 507 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2wrh n ALA 507 Cb 0.39 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.07 2wrh n ALA 507 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrh n GLY 508 N -1.13 0.91 0.19 0.00 0.00 -0.19 -4.86 105.19 100.10 2wrh n GLY 508 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2wrh n GLY 508 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2wrh h PHE 509 N 0.00 0.00 -2.80 1.61 -5.15 -1.31 -3.28 116.94 106.01 2wrh h PHE 509 Ca 0.00 0.00 -0.68 0.00 -0.20 0.00 0.00 57.97 57.09 2wrh h PHE 509 Cb 0.00 0.00 -0.18 0.00 0.22 0.00 0.00 35.95 35.99 2wrh h PHE 509 CO 0.00 0.37 0.32 0.42 -2.00 0.00 0.00 178.31 177.42 2wrh s ILE 510 N -3.55 4.67 0.39 0.88 1.09 -1.07 -3.17 121.20 120.43 2wrh s ILE 510 Ca 0.00 -0.88 0.07 0.00 -1.10 0.00 0.00 60.65 58.74 2wrh s ILE 510 Cb 0.11 -4.58 0.20 0.00 -1.06 0.00 0.00 42.46 37.13 2wrh s ILE 510 CO 0.69 -1.27 1.96 -0.33 -0.10 0.00 0.00 174.94 175.89 2wrh h GLU 511 N 9.24 0.42 -4.76 2.79 5.08 -1.82 -3.07 114.58 122.47 2wrh h GLU 511 Ca -0.24 -0.06 -0.41 0.00 -1.00 0.00 0.00 59.36 57.64 2wrh h GLU 511 Cb 1.07 -0.08 -0.13 0.00 0.50 0.00 0.00 28.75 30.12 2wrh h GLU 511 CO 1.12 0.41 -0.47 0.20 -1.00 0.00 0.00 179.01 179.27 2wrh s GLY 512 N -3.86 2.10 0.34 -3.84 0.00 -1.26 -4.43 107.32 96.37 2wrh s GLY 512 Ca -0.07 -1.95 0.07 0.00 0.00 0.00 0.00 44.72 42.77 2wrh s GLY 512 CO 0.74 -1.40 0.34 -0.32 0.00 0.00 0.00 173.10 172.46 2wrh s GLY 513 N -3.32 1.78 -0.34 0.20 0.00 -1.26 -4.88 107.32 99.49 2wrh s GLY 513 Ca 0.39 -1.63 -0.09 0.00 0.00 0.00 0.00 44.72 43.38 2wrh s GLY 513 CO 0.24 -1.54 0.16 -0.98 0.00 0.00 0.00 173.10 170.98 2wrh s TRP 514 N -2.29 3.21 -0.41 1.90 0.51 -1.26 -4.89 118.94 115.70 2wrh s TRP 514 Ca 0.43 -0.88 0.26 0.00 -2.12 0.00 0.00 56.10 53.78 2wrh s TRP 514 Cb -0.06 -2.37 0.98 0.00 -0.81 0.00 0.00 33.47 31.21 2wrh s TRP 514 CO 0.28 -0.58 1.77 1.79 -0.51 0.00 0.00 176.95 179.70 2wrh h THR 515 N 5.83 0.00 0.00 2.01 1.35 -2.03 -3.07 112.91 117.01 2wrh h THR 515 Ca -0.28 -0.39 -0.02 0.00 -0.55 0.00 0.00 66.41 65.18 2wrh h THR 515 Cb 1.12 1.24 -0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2wrh h THR 515 CO 0.64 0.00 -0.08 1.23 -0.25 0.00 0.00 175.52 177.05 2wrh h GLY 516 N 2.79 0.00 -7.48 5.82 0.00 -2.03 -3.39 103.07 98.77 2wrh h GLY 516 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.63 2wrh h GLY 516 CO 0.00 0.00 0.76 -0.29 0.00 0.00 0.00 176.54 177.01 2wrh s MET 517 N -3.43 3.59 0.12 4.80 0.00 -1.16 -4.82 119.30 118.41 2wrh s MET 517 Ca 0.04 -1.82 0.23 0.00 0.00 0.00 0.00 55.69 54.14 2wrh s MET 517 Cb 0.08 -4.87 0.17 0.00 0.00 0.00 0.00 34.83 30.21 2wrh s MET 517 CO 0.63 -1.73 1.16 0.44 0.00 0.00 0.00 175.02 175.52 2wrh n ILE 518 N 5.36 0.37 -0.86 10.11 -0.00 -1.26 -4.35 119.36 128.71 2wrh n ILE 518 Ca 0.23 -0.34 -0.06 0.00 -0.00 0.00 0.00 62.75 62.58 2wrh n ILE 518 Cb 0.49 -0.09 0.28 0.00 -0.00 0.00 0.00 39.64 40.32 2wrh n ILE 518 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 2wrh n ASP 519 N -2.21 4.60 0.00 7.28 5.75 -1.26 -4.98 116.55 125.73 2wrh n ASP 519 Ca 0.02 -3.13 0.00 0.00 -0.01 0.00 0.00 54.79 51.67 2wrh n ASP 519 Cb 0.47 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 39.82 2wrh n ASP 519 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wrh n GLY 520 N -0.13 -0.08 0.12 6.12 0.00 -1.26 -4.70 105.19 105.26 2wrh n GLY 520 Ca 0.38 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 2wrh n GLY 520 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2wrh h TRP 521 N 0.00 0.39 -3.27 1.61 6.55 -1.91 -3.47 115.95 115.85 2wrh h TRP 521 Ca 0.00 -0.28 -0.66 0.00 0.95 0.00 0.00 58.89 58.90 2wrh h TRP 521 Cb 0.00 -0.02 -0.19 0.00 -0.86 0.00 0.00 29.16 28.09 2wrh h TRP 521 CO 0.00 1.54 -0.83 0.71 -1.05 0.00 0.00 178.44 178.81 2wrh s TYR 522 N -2.46 2.30 0.00 0.49 1.51 -1.26 -5.07 117.35 112.85 2wrh s TYR 522 Ca -0.21 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.49 2wrh s TYR 522 Cb 0.04 -1.15 0.00 0.00 -0.11 0.00 0.00 41.96 40.75 2wrh s TYR 522 CO 0.75 0.48 0.00 0.41 -1.11 0.00 0.00 175.55 176.08 2wrh n GLY 523 N 0.33 0.83 3.44 0.71 0.00 -1.26 -0.95 105.19 108.30 2wrh n GLY 523 Ca -0.13 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.06 2wrh n GLY 523 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wrh s TYR 524 N -2.09 1.99 0.00 1.61 1.51 0.60 -4.86 117.35 116.10 2wrh s TYR 524 Ca 0.00 -0.75 0.00 0.00 -1.01 0.00 0.00 57.07 55.31 2wrh s TYR 524 Cb 0.00 -1.19 0.00 0.00 -0.11 0.00 0.00 41.96 40.66 2wrh s TYR 524 CO 0.00 0.23 0.00 1.58 -1.11 0.00 0.00 175.55 176.25 2wrh n HIS 525 N -0.63 0.00 -0.78 2.71 -0.00 -1.26 -2.40 115.22 112.86 2wrh n HIS 525 Ca -0.05 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.13 2wrh n HIS 525 Cb 0.64 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.51 2wrh n HIS 525 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 2wrh n HIS 526 N -2.47 -2.12 -3.71 1.57 -0.00 -1.26 -3.76 115.22 103.46 2wrh n HIS 526 Ca 0.00 1.12 -0.16 0.00 -0.00 0.00 0.00 57.72 58.68 2wrh n HIS 526 Cb 0.00 -2.29 -0.16 0.00 -0.00 0.00 0.00 29.99 27.54 2wrh n HIS 526 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 2wrh s GLN 527 N -4.45 0.00 0.34 -1.40 0.74 -1.26 -3.21 119.66 110.42 2wrh s GLN 527 Ca 0.00 0.38 0.01 0.00 0.05 0.00 0.00 55.36 55.80 2wrh s GLN 527 Cb 0.00 -0.31 0.01 0.00 1.10 0.00 0.00 33.01 33.81 2wrh s GLN 527 CO 0.00 -0.25 0.07 0.09 -0.55 0.00 0.00 175.29 174.65 2wrh n ASN 528 N 4.79 2.72 -0.25 6.67 3.02 0.32 -4.99 115.26 127.55 2wrh n ASN 528 Ca -0.15 -2.41 0.13 0.00 -0.03 0.00 0.00 54.58 52.13 2wrh n ASN 528 Cb 0.50 0.17 0.44 0.00 -0.61 0.00 0.00 39.78 40.28 2wrh n ASN 528 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2wrh n GLU 529 N -0.97 0.90 -0.27 3.52 0.28 -1.26 -3.43 120.64 119.41 2wrh n GLU 529 Ca -0.11 -0.50 0.10 0.00 -0.16 0.00 0.00 57.16 56.50 2wrh n GLU 529 Cb 0.42 -1.49 0.27 0.00 1.43 0.00 0.00 31.44 32.07 2wrh n GLU 529 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2wrh n GLN 530 N -0.62 2.36 0.00 3.44 6.02 -1.26 -5.07 117.38 122.26 2wrh n GLN 530 Ca 0.13 -2.11 0.00 0.00 -0.01 0.00 0.00 57.00 55.02 2wrh n GLN 530 Cb 0.34 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.13 2wrh n GLN 530 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wrh n GLY 531 N 1.44 0.07 2.51 1.08 0.00 -1.22 -5.10 105.19 103.98 2wrh n GLY 531 Ca 0.20 -2.25 -0.09 0.00 0.00 0.00 0.00 46.02 43.88 2wrh n GLY 531 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wrh n SER 532 N 0.00 -1.21 0.00 1.61 3.41 -1.26 0.12 113.62 116.29 2wrh n SER 532 Ca 0.00 -2.29 0.00 0.00 -0.26 0.00 0.00 58.87 56.32 2wrh n SER 532 Cb 0.00 2.14 0.00 0.00 -0.26 0.00 0.00 64.21 66.09 2wrh n SER 532 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wrh n GLY 533 N -0.40 1.29 3.95 5.00 0.00 -1.20 -5.03 105.19 108.80 2wrh n GLY 533 Ca -0.02 -1.63 -0.24 0.00 0.00 0.00 0.00 46.02 44.13 2wrh n GLY 533 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wrh s TYR 534 N -1.62 3.48 -0.28 1.61 1.51 -1.26 -4.30 117.35 116.48 2wrh s TYR 534 Ca 0.00 0.19 -0.16 0.00 -1.01 0.00 0.00 57.07 56.10 2wrh s TYR 534 Cb 0.00 -1.75 0.09 0.00 -0.11 0.00 0.00 41.96 40.19 2wrh s TYR 534 CO 0.00 0.32 0.70 0.00 -1.11 0.00 0.00 175.55 175.47 2wrh s ALA 535 N -2.06 -1.92 0.45 3.71 0.00 -1.01 -5.01 121.76 115.93 2wrh s ALA 535 Ca 0.37 2.41 -0.20 0.00 0.00 0.00 0.00 51.96 54.54 2wrh s ALA 535 Cb -0.10 -1.47 -0.10 0.00 0.00 0.00 0.00 23.12 21.45 2wrh s ALA 535 CO 0.31 -0.42 0.97 0.00 0.00 0.00 0.00 175.76 176.62 2wrh s ALA 536 N 1.72 3.02 -0.47 0.00 0.00 -1.26 -0.29 121.76 124.48 2wrh s ALA 536 Ca -0.10 0.39 -0.24 0.00 0.00 0.00 0.00 51.96 52.01 2wrh s ALA 536 Cb -0.05 -3.16 0.03 0.00 0.00 0.00 0.00 23.12 19.94 2wrh s ALA 536 CO -0.20 0.01 0.85 0.34 0.00 0.00 0.00 175.76 176.76 2wrh s ASP 537 N -2.32 6.42 0.22 0.00 -1.08 -0.12 -4.86 116.67 114.93 2wrh s ASP 537 Ca 0.62 -0.10 -0.06 0.00 -0.52 0.00 0.00 52.55 52.49 2wrh s ASP 537 Cb -0.10 -2.41 0.19 0.00 -1.46 0.00 0.00 42.92 39.14 2wrh s ASP 537 CO 0.17 -1.01 1.73 1.56 0.52 0.00 0.00 175.17 178.14 2wrh h GLN 538 N 9.07 1.04 0.64 4.34 1.08 -1.95 -2.60 115.11 126.72 2wrh h GLN 538 Ca -0.25 -0.26 -0.03 0.00 -1.45 0.00 0.00 58.65 56.66 2wrh h GLN 538 Cb 1.08 -0.13 0.01 0.00 -0.05 0.00 0.00 27.48 28.38 2wrh h GLN 538 CO 1.00 0.94 -0.31 -0.22 -0.95 0.00 0.00 178.83 179.30 2wrh h LYS 539 N 0.98 -0.83 -0.49 1.46 3.64 -1.98 0.14 116.57 119.50 2wrh h LYS 539 Ca 0.20 0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 59.51 2wrh h LYS 539 Cb 0.39 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2wrh h LYS 539 CO 0.01 -0.53 -0.19 0.66 -2.27 0.00 0.00 179.45 177.13 2wrh h SER 540 N -0.93 1.01 -0.18 4.20 4.64 -1.97 -0.72 113.55 119.60 2wrh h SER 540 Ca -0.09 -0.39 0.02 0.00 -0.47 0.00 0.00 61.79 60.87 2wrh h SER 540 Cb 0.68 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 2wrh h SER 540 CO 0.14 1.17 0.03 0.74 -0.87 0.00 0.00 176.83 178.04 2wrh h THR 541 N 0.85 0.91 -0.67 2.95 2.02 -1.40 0.90 112.91 118.46 2wrh h THR 541 Ca 0.11 -0.03 -0.05 0.00 0.77 0.00 0.00 66.41 67.21 2wrh h THR 541 Cb 0.77 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 2wrh h THR 541 CO 0.06 0.02 0.21 -0.61 0.37 0.00 0.00 175.52 175.57 2wrh h GLN 542 N 0.09 1.04 -0.22 6.66 5.75 -0.83 0.25 115.11 127.84 2wrh h GLN 542 Ca 0.08 -0.21 -0.00 0.00 -0.15 0.00 0.00 58.65 58.36 2wrh h GLN 542 Cb 0.08 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.46 2wrh h GLN 542 CO -0.11 0.89 0.12 -0.91 -2.65 0.00 0.00 178.83 176.17 2wrh h ASN 543 N 1.00 0.28 0.06 -0.69 2.35 -0.76 -0.10 115.58 117.71 2wrh h ASN 543 Ca 0.22 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2wrh h ASN 543 Cb 0.29 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2wrh h ASN 543 CO -0.01 0.28 -0.03 0.00 -1.65 0.00 0.00 177.43 176.02 2wrh h ALA 544 N 1.01 -0.08 -0.86 -0.83 0.00 -0.45 0.85 119.26 118.90 2wrh h ALA 544 Ca 0.08 -0.04 0.16 0.00 0.00 0.00 0.00 54.91 55.11 2wrh h ALA 544 Cb 0.06 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.78 2wrh h ALA 544 CO -0.01 -0.52 0.43 0.82 0.00 0.00 0.00 179.25 179.96 2wrh h ILE 545 N -0.12 0.69 -0.16 0.00 5.03 -0.38 0.12 117.51 122.69 2wrh h ILE 545 Ca -0.01 -0.20 -0.02 0.00 -0.12 0.00 0.00 64.86 64.51 2wrh h ILE 545 Cb 0.10 0.05 -0.01 0.00 -3.03 0.00 0.00 36.82 33.93 2wrh h ILE 545 CO 0.01 0.11 0.02 0.44 -0.68 0.00 0.00 178.15 178.05 2wrh h ASP 546 N 0.58 0.27 0.25 1.72 3.32 -0.57 -0.89 116.42 121.11 2wrh h ASP 546 Ca 0.48 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2wrh h ASP 546 Cb 0.72 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2wrh h ASP 546 CO -0.39 0.48 -0.12 1.23 -1.72 0.00 0.00 179.24 178.72 2wrh h GLY 547 N 0.05 -0.36 1.19 2.75 0.00 -0.02 -1.55 103.07 105.13 2wrh h GLY 547 Ca 0.05 0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.53 2wrh h GLY 547 CO 0.01 -0.13 0.51 -2.22 0.00 0.00 0.00 176.54 174.71 2wrh h ILE 548 N -0.47 1.17 -0.61 2.60 5.03 -0.83 -0.92 117.51 123.48 2wrh h ILE 548 Ca -0.03 -0.34 -0.01 0.00 -0.12 0.00 0.00 64.86 64.35 2wrh h ILE 548 Cb 0.35 0.07 -0.03 0.00 -3.03 0.00 0.00 36.82 34.19 2wrh h ILE 548 CO 0.06 0.18 0.36 0.74 -0.68 0.00 0.00 178.15 178.81 2wrh h THR 549 N 1.00 1.19 -0.71 -0.27 2.02 -0.93 -1.01 112.91 114.19 2wrh h THR 549 Ca 0.29 -0.44 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 2wrh h THR 549 Cb -0.05 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.69 2wrh h THR 549 CO -0.07 0.20 0.33 -1.28 0.37 0.00 0.00 175.52 175.07 2wrh h SER 550 N 0.83 0.92 0.14 4.18 0.87 -0.35 -0.79 113.55 119.34 2wrh h SER 550 Ca 0.22 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 2wrh h SER 550 Cb 0.00 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2wrh h SER 550 CO -0.04 0.79 -0.07 0.50 -0.53 0.00 0.00 176.83 177.48 2wrh h LYS 551 N 1.01 -0.18 -0.66 2.24 3.64 -0.68 0.25 116.57 122.20 2wrh h LYS 551 Ca 0.25 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.60 2wrh h LYS 551 Cb 0.12 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 2wrh h LYS 551 CO -0.03 -0.11 0.27 0.28 -2.27 0.00 0.00 179.45 177.59 2wrh h VAL 552 N -0.19 1.24 -0.55 2.00 2.07 -0.94 -2.02 116.25 117.85 2wrh h VAL 552 Ca -0.02 -0.74 0.01 0.00 0.82 0.00 0.00 66.70 66.77 2wrh h VAL 552 Cb 0.15 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 2wrh h VAL 552 CO 0.03 0.30 0.36 0.78 0.02 0.00 0.00 177.57 179.05 2wrh h ASN 553 N 0.94 0.61 -0.04 0.57 2.35 -0.90 -1.19 115.58 117.91 2wrh h ASN 553 Ca 0.22 -0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.99 2wrh h ASN 553 Cb 0.20 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 2wrh h ASN 553 CO -0.02 0.44 -0.11 0.28 -1.65 0.00 0.00 177.43 176.37 2wrh h SER 554 N 0.72 -0.32 -0.61 5.81 0.02 -0.64 0.23 113.55 118.77 2wrh h SER 554 Ca 0.21 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 2wrh h SER 554 Cb -0.06 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 2wrh h SER 554 CO -0.06 -0.15 0.30 0.58 -1.14 0.00 0.00 176.83 176.36 2wrh h VAL 555 N -0.16 1.21 -0.16 2.27 2.07 -1.20 -2.30 116.25 117.98 2wrh h VAL 555 Ca 0.05 -0.58 -0.18 0.00 0.82 0.00 0.00 66.70 66.82 2wrh h VAL 555 Cb 0.24 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2wrh h VAL 555 CO -0.14 0.24 -0.64 0.40 0.02 0.00 0.00 177.57 177.44 2wrh h ILE 556 N 0.83 1.32 0.00 4.57 2.04 -0.94 -3.41 117.51 121.93 2wrh h ILE 556 Ca 0.21 -1.92 0.00 0.00 1.00 0.00 0.00 64.86 64.15 2wrh h ILE 556 Cb 0.10 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 2wrh h ILE 556 CO -0.03 0.60 -1.08 1.21 0.00 0.00 0.00 178.15 178.85 2wrh n GLU 557 N -3.92 1.46 0.08 2.37 2.13 0.78 -4.26 120.64 119.27 2wrh n GLU 557 Ca -0.04 -0.05 0.11 0.00 0.66 0.00 0.00 57.16 57.83 2wrh n GLU 557 Cb 0.66 -1.10 0.44 0.00 0.27 0.00 0.00 31.44 31.72 2wrh n GLU 557 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2wrh n LYS 558 N -1.61 0.13 -1.80 5.31 4.76 -0.87 -4.68 118.16 119.40 2wrh n LYS 558 Ca -0.01 0.28 -0.43 0.00 -2.87 0.00 0.00 58.31 55.29 2wrh n LYS 558 Cb 0.19 -1.72 -0.03 0.00 -1.84 0.00 0.00 35.03 31.63 2wrh n LYS 558 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 2wrh s MET 559 N -3.15 3.37 0.32 1.97 -2.45 -1.26 -4.99 119.30 113.11 2wrh s MET 559 Ca 0.07 1.84 -0.22 0.00 -1.25 0.00 0.00 55.69 56.14 2wrh s MET 559 Cb 0.11 -4.25 -0.10 0.00 1.25 0.00 0.00 34.83 31.84 2wrh s MET 559 CO 0.42 -1.82 0.86 1.21 1.05 0.00 0.00 175.02 176.74 2wrh s ASN 560 N 6.70 7.11 -0.04 1.11 2.47 -1.26 -5.08 114.94 125.96 2wrh s ASN 560 Ca 0.89 1.62 -0.01 0.00 0.42 0.00 0.00 52.86 55.78 2wrh s ASN 560 Cb -0.29 -2.50 0.03 0.00 -1.45 0.00 0.00 41.25 37.03 2wrh s ASN 560 CO 0.34 -0.11 0.05 0.28 -3.72 0.00 0.00 177.10 173.95 2wrh s THR 561 N -1.74 -0.10 -0.11 -5.21 -1.32 -1.26 -5.14 115.64 100.75 2wrh s THR 561 Ca 0.51 0.37 -0.04 0.00 -1.21 0.00 0.00 61.69 61.32 2wrh s THR 561 Cb -0.15 -0.13 -0.04 0.00 -1.51 0.00 0.00 72.50 70.67 2wrh s THR 561 CO 0.20 0.15 0.04 -1.10 -2.21 0.00 0.00 174.62 171.71 2wrh s GLN 562 N 1.87 3.30 0.07 7.08 -1.52 -1.26 -5.06 119.66 124.14 2wrh s GLN 562 Ca 0.01 -0.33 -0.30 0.00 -1.95 0.00 0.00 55.36 52.78 2wrh s GLN 562 Cb -0.12 -2.97 -0.09 0.00 -0.22 0.00 0.00 33.01 29.61 2wrh s GLN 562 CO -0.03 0.63 1.87 0.12 -0.25 0.00 0.00 175.29 177.63 2wrh s PHE 563 N -0.65 1.75 -0.06 0.91 5.36 -1.26 -4.98 117.98 119.06 2wrh s PHE 563 Ca 0.11 -0.20 -0.12 0.00 -0.96 0.00 0.00 56.93 55.77 2wrh s PHE 563 Cb -0.12 -4.18 0.02 0.00 -0.34 0.00 0.00 43.02 38.40 2wrh s PHE 563 CO 0.02 -5.09 0.29 0.99 -1.46 0.00 0.00 175.22 169.98 2wrh s THR 564 N 3.59 0.03 -0.14 0.12 2.01 -1.26 -5.06 115.64 114.93 2wrh s THR 564 Ca 0.84 -0.25 0.20 0.00 0.31 0.00 0.00 61.69 62.78 2wrh s THR 564 Cb -0.43 -0.50 -0.17 0.00 0.01 0.00 0.00 72.50 71.41 2wrh s THR 564 CO 0.38 -0.14 0.70 0.00 -0.69 0.00 0.00 174.62 174.88 2wrh n ALA 565 N 2.13 2.28 0.00 7.40 0.00 -1.26 -4.98 120.51 126.09 2wrh n ALA 565 Ca -0.17 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.73 2wrh n ALA 565 Cb 0.57 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.17 2wrh n ALA 565 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wrh n VAL 566 N -2.64 0.00 -1.63 0.00 0.31 -1.26 -4.86 118.33 108.25 2wrh n VAL 566 Ca -0.08 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.82 2wrh n VAL 566 Cb 0.72 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.65 2wrh n VAL 566 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wrh n GLY 567 N 0.00 0.01 3.17 2.92 0.00 -1.26 -5.02 105.19 105.01 2wrh n GLY 567 Ca 0.00 0.26 -0.15 0.00 0.00 0.00 0.00 46.02 46.13 2wrh n GLY 567 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wrh s LYS 568 N -1.82 0.83 -0.17 1.61 -0.14 -1.26 -5.14 119.74 113.66 2wrh s LYS 568 Ca 0.59 -1.11 0.01 0.00 -1.36 0.00 0.00 55.97 54.10 2wrh s LYS 568 Cb -0.61 -0.57 0.03 0.00 -1.68 0.00 0.00 37.83 35.00 2wrh s LYS 568 CO 0.60 0.10 -0.13 -1.21 -0.76 0.00 0.00 175.35 173.94 2wrh s GLU 569 N -2.57 2.24 0.06 1.68 2.02 -1.26 -5.12 118.70 115.74 2wrh s GLU 569 Ca 0.04 -0.66 0.09 0.00 0.02 0.00 0.00 54.97 54.45 2wrh s GLU 569 Cb -0.04 -2.22 -0.03 0.00 0.10 0.00 0.00 34.13 31.93 2wrh s GLU 569 CO 0.00 -0.30 -0.24 -0.06 0.02 0.00 0.00 175.26 174.69 2wrh s PHE 570 N 1.45 2.09 0.87 1.61 0.08 -1.26 -5.13 117.98 117.69 2wrh s PHE 570 Ca 0.03 -0.39 -0.13 0.00 0.12 0.00 0.00 56.93 56.56 2wrh s PHE 570 Cb -0.14 -1.23 0.15 0.00 -0.57 0.00 0.00 43.02 41.23 2wrh s PHE 570 CO -0.10 0.14 1.22 0.54 -0.10 0.00 0.00 175.22 176.92 2wrh s ASN 571 N -1.33 3.79 0.00 1.36 2.20 -1.26 -4.92 114.94 114.77 2wrh s ASN 571 Ca 0.10 0.37 0.05 0.00 -0.94 0.00 0.00 52.86 52.45 2wrh s ASN 571 Cb -0.10 -0.64 0.32 0.00 -2.00 0.00 0.00 41.25 38.84 2wrh s ASN 571 CO 0.02 -2.31 1.03 -0.46 -2.94 0.00 0.00 177.10 172.45 2wrh n ASN 572 N -3.47 0.00 -0.30 3.54 2.04 -1.26 -1.31 115.26 114.50 2wrh n ASN 572 Ca 0.12 -1.44 0.06 0.00 -0.44 0.00 0.00 54.58 52.89 2wrh n ASN 572 Cb 0.60 0.00 0.13 0.00 -2.53 0.00 0.00 39.78 37.98 2wrh n ASN 572 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2wrh n LEU 573 N -0.60 2.64 -0.76 -4.53 4.77 -1.26 -4.60 117.00 112.66 2wrh n LEU 573 Ca 0.04 -2.61 0.05 0.00 -0.03 0.00 0.00 56.01 53.46 2wrh n LEU 573 Cb 0.02 -0.30 0.18 0.00 -2.33 0.00 0.00 43.42 40.99 2wrh n LEU 573 CO 0.03 0.65 0.31 -0.62 -1.33 0.00 0.00 177.39 176.43 2wrh n GLU 574 N -0.71 1.41 -0.36 3.23 1.02 -0.43 -4.84 120.64 119.96 2wrh n GLU 574 Ca 0.12 -3.15 0.02 0.00 -0.02 0.00 0.00 57.16 54.13 2wrh n GLU 574 Cb 0.55 -1.41 0.17 0.00 -0.02 0.00 0.00 31.44 30.74 2wrh n GLU 574 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2wrh h ARG 575 N 1.03 1.16 0.00 3.49 9.65 -1.81 -0.65 114.38 127.25 2wrh h ARG 575 Ca -0.03 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2wrh h ARG 575 Cb 1.14 -0.26 0.00 0.00 -1.39 0.00 0.00 29.97 29.46 2wrh h ARG 575 CO 0.03 0.77 -0.00 0.00 2.80 0.00 0.00 179.97 183.56 2wrh h ARG 576 N 1.19 -0.01 0.00 0.20 3.08 -1.95 -1.36 114.38 115.54 2wrh h ARG 576 Ca 0.42 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.41 2wrh h ARG 576 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2wrh h ARG 576 CO -0.15 0.10 -0.26 0.97 -1.07 0.00 0.00 179.97 179.56 2wrh h ILE 577 N -0.11 0.73 -0.41 2.04 6.09 -1.88 -1.22 117.51 122.75 2wrh h ILE 577 Ca -0.00 -1.12 -0.07 0.00 -1.37 0.00 0.00 64.86 62.30 2wrh h ILE 577 Cb 0.11 1.71 -0.02 0.00 0.47 0.00 0.00 36.82 39.09 2wrh h ILE 577 CO 0.00 0.26 -0.04 -0.08 -3.07 0.00 0.00 178.15 175.22 2wrh h GLU 578 N 0.00 0.68 0.02 2.19 4.81 -0.70 -2.45 114.58 119.13 2wrh h GLU 578 Ca -0.00 -0.18 -0.23 0.00 -0.13 0.00 0.00 59.36 58.82 2wrh h GLU 578 Cb 0.69 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 2wrh h GLU 578 CO 0.03 0.73 -1.08 -0.91 -0.73 0.00 0.00 179.01 177.05 2wrh h ASN 579 N 0.64 0.08 -0.67 1.04 2.35 -0.60 -1.63 115.58 116.79 2wrh h ASN 579 Ca 0.12 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.82 2wrh h ASN 579 Cb 0.46 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.76 2wrh h ASN 579 CO 0.02 1.07 0.42 0.25 -1.65 0.00 0.00 177.43 177.53 2wrh h LEU 580 N 0.01 0.68 -0.07 1.61 6.46 -1.22 0.16 115.31 122.95 2wrh h LEU 580 Ca -0.05 -0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.71 2wrh h LEU 580 Cb 1.82 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 41.60 2wrh h LEU 580 CO 0.14 0.48 0.04 -1.13 -0.62 0.00 0.00 178.44 177.34 2wrh h ASN 581 N 0.82 0.09 -0.72 1.25 -1.24 -1.25 -1.05 115.58 113.48 2wrh h ASN 581 Ca 0.27 -0.10 0.06 0.00 0.71 0.00 0.00 56.30 57.23 2wrh h ASN 581 Cb 0.01 -0.02 -0.04 0.00 0.73 0.00 0.00 38.32 39.00 2wrh h ASN 581 CO -0.10 0.17 0.47 0.50 -1.29 0.00 0.00 177.43 177.18 2wrh h LYS 582 N 0.01 0.75 -0.48 6.67 3.64 -0.98 -0.73 116.57 125.44 2wrh h LYS 582 Ca 0.02 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2wrh h LYS 582 Cb 0.10 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2wrh h LYS 582 CO -0.00 0.49 0.15 -0.22 -2.27 0.00 0.00 179.45 177.60 2wrh h LYS 583 N 0.77 0.75 0.44 1.90 3.64 -0.11 0.56 116.57 124.51 2wrh h LYS 583 Ca 0.31 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2wrh h LYS 583 Cb 0.23 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2wrh h LYS 583 CO -0.10 0.71 -0.21 0.28 -2.27 0.00 0.00 179.45 177.85 2wrh h VAL 584 N 0.64 0.57 -0.54 2.00 2.07 -0.36 0.93 116.25 121.55 2wrh h VAL 584 Ca 0.15 -0.12 0.06 0.00 0.82 0.00 0.00 66.70 67.61 2wrh h VAL 584 Cb 0.27 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 2wrh h VAL 584 CO -0.00 0.02 0.25 0.44 0.02 0.00 0.00 177.57 178.30 2wrh h ASP 585 N -0.66 0.33 0.02 0.57 3.32 -1.05 -1.82 116.42 117.13 2wrh h ASP 585 Ca -0.06 0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.93 2wrh h ASP 585 Cb 0.49 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2wrh h ASP 585 CO 0.10 0.22 -0.30 0.44 -1.72 0.00 0.00 179.24 177.98 2wrh h ASP 586 N 0.48 0.43 -0.23 6.45 3.32 -0.85 -1.84 116.42 124.17 2wrh h ASP 586 Ca 0.25 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 2wrh h ASP 586 Cb 0.20 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2wrh h ASP 586 CO -0.20 0.72 0.07 1.23 -1.72 0.00 0.00 179.24 179.34 2wrh h GLY 587 N 1.06 0.40 1.45 2.75 0.00 -0.21 -2.03 103.07 106.49 2wrh h GLY 587 Ca 0.05 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 47.03 2wrh h GLY 587 CO 0.06 0.22 -0.27 0.74 0.00 0.00 0.00 176.54 177.29 2wrh h PHE 588 N 0.21 0.72 -0.60 5.60 0.05 -1.26 -2.02 116.94 119.63 2wrh h PHE 588 Ca 0.07 -0.17 0.10 0.00 3.82 0.00 0.00 57.97 61.79 2wrh h PHE 588 Cb 0.25 -0.17 -0.07 0.00 2.00 0.00 0.00 35.95 37.96 2wrh h PHE 588 CO 0.01 0.84 0.21 1.25 -0.18 0.00 0.00 178.31 180.44 2wrh h LEU 589 N 0.54 0.20 -0.31 1.54 5.85 -1.18 0.11 115.31 122.06 2wrh h LEU 589 Ca 0.07 0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 2wrh h LEU 589 Cb 0.75 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 2wrh h LEU 589 CO 0.06 0.12 -0.29 0.44 -0.34 0.00 0.00 178.44 178.43 2wrh h ASP 590 N 0.39 0.79 0.20 1.25 3.32 -1.01 -0.70 116.42 120.65 2wrh h ASP 590 Ca 0.31 -0.46 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 2wrh h ASP 590 Cb 0.39 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.72 2wrh h ASP 590 CO -0.32 1.09 -0.10 0.58 -1.72 0.00 0.00 179.24 178.78 2wrh h VAL 591 N 0.50 0.89 -0.43 -1.35 2.07 -1.05 -2.63 116.25 114.24 2wrh h VAL 591 Ca 0.05 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 2wrh h VAL 591 Cb 0.86 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 2wrh h VAL 591 CO 0.07 0.12 0.15 -0.50 0.02 0.00 0.00 177.57 177.43 2wrh h TRP 592 N -0.54 0.68 -0.36 1.57 4.06 -0.81 -1.74 115.95 118.81 2wrh h TRP 592 Ca -0.03 -0.06 0.06 0.00 2.06 0.00 0.00 58.89 60.91 2wrh h TRP 592 Cb 0.40 -0.20 -0.05 0.00 -1.00 0.00 0.00 29.16 28.31 2wrh h TRP 592 CO 0.01 0.61 0.06 1.15 -3.56 0.00 0.00 178.44 176.72 2wrh h THR 593 N 0.55 0.81 0.40 1.49 2.02 -1.16 -0.03 112.91 116.99 2wrh h THR 593 Ca 0.14 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 2wrh h THR 593 Cb 0.24 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2wrh h THR 593 CO -0.01 0.03 -0.19 0.22 0.37 0.00 0.00 175.52 175.94 2wrh h TYR 594 N 0.18 -0.50 0.00 3.16 3.20 -1.40 -1.22 116.97 120.39 2wrh h TYR 594 Ca 0.17 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 2wrh h TYR 594 Cb 0.20 0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 2wrh h TYR 594 CO -0.20 -0.18 -0.16 -0.91 -1.64 0.00 0.00 178.16 175.08 2wrh h ASN 595 N -0.88 0.00 0.05 -2.11 2.35 -1.29 -0.78 115.58 112.93 2wrh h ASN 595 Ca -0.06 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2wrh h ASN 595 Cb 0.55 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2wrh h ASN 595 CO 0.09 0.16 -0.03 0.00 -1.65 0.00 0.00 177.43 176.00 2wrh h ALA 596 N 1.84 -0.07 -0.26 -0.83 0.00 -0.96 -0.98 119.26 117.99 2wrh h ALA 596 Ca -0.00 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.68 2wrh h ALA 596 Cb 0.51 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 2wrh h ALA 596 CO 0.02 -0.23 -0.13 0.93 0.00 0.00 0.00 179.25 179.84 2wrh h GLU 597 N -0.70 -0.10 0.00 0.00 4.39 -0.90 -2.11 114.58 115.18 2wrh h GLU 597 Ca -0.01 0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 2wrh h GLU 597 Cb 0.59 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 2wrh h GLU 597 CO 0.01 -0.06 -0.61 -0.07 -1.16 0.00 0.00 179.01 177.12 2wrh h LEU 598 N -0.10 0.00 -0.28 1.33 3.38 -1.23 -2.43 115.31 115.99 2wrh h LEU 598 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2wrh h LEU 598 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2wrh h LEU 598 CO -0.33 0.61 0.13 0.25 0.09 0.00 0.00 178.44 179.19 2wrh h LEU 599 N 0.00 0.36 0.00 1.67 5.85 -0.82 -0.37 115.31 122.01 2wrh h LEU 599 Ca -0.01 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 2wrh h LEU 599 Cb 1.11 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.05 2wrh h LEU 599 CO 0.08 0.38 -0.00 0.58 -0.34 0.00 0.00 178.44 179.14 2wrh h VAL 600 N 0.31 1.11 -0.44 1.05 2.07 -1.31 -0.41 116.25 118.63 2wrh h VAL 600 Ca 0.09 -0.34 0.09 0.00 0.82 0.00 0.00 66.70 67.36 2wrh h VAL 600 Cb 0.12 1.34 -0.08 0.00 -1.52 0.00 0.00 31.29 31.15 2wrh h VAL 600 CO -0.01 0.09 -0.06 -0.07 0.02 0.00 0.00 177.57 177.54 2wrh h LEU 601 N -0.15 -0.31 -0.11 2.57 3.38 -1.33 0.28 115.31 119.64 2wrh h LEU 601 Ca -0.00 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2wrh h LEU 601 Cb 0.15 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2wrh h LEU 601 CO 0.00 -0.11 -0.13 -0.07 0.09 0.00 0.00 178.44 178.22 2wrh h LEU 602 N 0.05 0.31 -1.64 1.67 4.07 -0.96 -2.62 115.31 116.18 2wrh h LEU 602 Ca 0.22 -0.50 -0.04 0.00 0.08 0.00 0.00 57.88 57.63 2wrh h LEU 602 Cb 0.33 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 2wrh h LEU 602 CO -0.42 0.75 -0.19 -0.33 -1.08 0.00 0.00 178.44 177.17 2wrh h GLU 603 N -0.13 0.00 -0.41 1.13 4.39 -0.96 -2.14 114.58 116.45 2wrh h GLU 603 Ca 0.01 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.60 2wrh h GLU 603 Cb 0.67 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 2wrh h GLU 603 CO 0.03 0.19 -0.19 -0.91 -1.16 0.00 0.00 179.01 176.98 2wrh h ASN 604 N 0.00 0.88 -0.10 1.42 2.35 -0.83 0.30 115.58 119.60 2wrh h ASN 604 Ca -0.00 -0.40 -0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2wrh h ASN 604 Cb 0.35 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 2wrh h ASN 604 CO 0.02 1.08 0.06 -0.08 -1.65 0.00 0.00 177.43 176.87 2wrh h GLU 605 N 0.68 0.14 -0.88 0.81 4.57 -1.17 -2.36 114.58 116.37 2wrh h GLU 605 Ca 0.09 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.24 2wrh h GLU 605 Cb 0.75 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.26 2wrh h GLU 605 CO 0.06 0.12 0.47 0.00 -1.18 0.00 0.00 179.01 178.48 2wrh h ARG 606 N 0.11 1.23 0.17 1.92 2.47 -1.16 -1.81 114.38 117.31 2wrh h ARG 606 Ca 0.04 -0.15 -0.01 0.00 -1.26 0.00 0.00 59.98 58.60 2wrh h ARG 606 Cb 0.02 -0.24 0.00 0.00 -1.65 0.00 0.00 29.97 28.10 2wrh h ARG 606 CO -0.01 0.91 -0.08 1.15 0.56 0.00 0.00 179.97 182.50 2wrh h THR 607 N 1.23 0.90 -0.84 2.04 2.02 -0.75 -0.30 112.91 117.20 2wrh h THR 607 Ca 0.31 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 67.20 2wrh h THR 607 Cb 0.05 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 2wrh h THR 607 CO -0.05 0.08 0.56 -0.07 0.37 0.00 0.00 175.52 176.40 2wrh h LEU 608 N -0.39 0.90 -0.85 2.58 3.38 -1.30 -1.55 115.31 118.09 2wrh h LEU 608 Ca -0.02 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2wrh h LEU 608 Cb 0.30 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2wrh h LEU 608 CO 0.04 0.62 -0.54 0.44 0.09 0.00 0.00 178.44 179.10 2wrh h ASP 609 N 1.05 0.12 -0.31 -0.43 3.32 -1.12 -1.58 116.42 117.47 2wrh h ASP 609 Ca 0.34 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 2wrh h ASP 609 Cb 0.03 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2wrh h ASP 609 CO -0.10 0.64 0.15 0.15 -1.72 0.00 0.00 179.24 178.35 2wrh h PHE 610 N 0.09 0.45 -0.66 4.55 3.57 -0.10 0.09 116.94 124.92 2wrh h PHE 610 Ca -0.00 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 2wrh h PHE 610 Cb 0.98 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 2wrh h PHE 610 CO 0.01 0.40 0.27 0.45 -2.23 0.00 0.00 178.31 177.21 2wrh h HIS 611 N 0.36 0.99 -0.53 0.41 3.86 -1.14 -1.60 115.15 117.50 2wrh h HIS 611 Ca 0.11 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.25 2wrh h HIS 611 Cb 0.12 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.27 2wrh h HIS 611 CO -0.02 0.77 0.34 0.22 0.86 0.00 0.00 177.93 180.11 2wrh h ASP 612 N 0.92 0.59 -0.81 2.45 -0.00 -0.95 -2.27 116.42 116.34 2wrh h ASP 612 Ca 0.22 -0.01 0.02 0.00 -0.00 0.00 0.00 57.03 57.26 2wrh h ASP 612 Cb 0.19 -0.14 -0.04 0.00 -0.00 0.00 0.00 39.33 39.33 2wrh h ASP 612 CO -0.02 0.42 0.53 -1.28 -0.00 0.00 0.00 179.24 178.89 2wrh h SER 613 N 0.70 0.90 -0.77 2.28 0.87 -0.61 -1.92 113.55 114.99 2wrh h SER 613 Ca 0.20 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 2wrh h SER 613 Cb -0.06 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 61.65 2wrh h SER 613 CO -0.05 0.63 0.35 0.78 -0.53 0.00 0.00 176.83 178.02 2wrh h ASN 614 N 1.06 1.04 -0.23 6.23 2.35 -0.89 0.20 115.58 125.34 2wrh h ASN 614 Ca 0.31 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 2wrh h ASN 614 Cb -0.06 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.04 2wrh h ASN 614 CO -0.09 0.89 0.01 0.58 -1.65 0.00 0.00 177.43 177.17 2wrh h VAL 615 N 1.12 1.25 -0.40 2.81 2.07 -1.15 -1.32 116.25 120.62 2wrh h VAL 615 Ca 0.27 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2wrh h VAL 615 Cb 0.15 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2wrh h VAL 615 CO -0.03 0.26 0.21 -0.09 0.02 0.00 0.00 177.57 177.95 2wrh h ARG 616 N 0.18 0.57 -0.69 1.57 2.43 -1.11 -0.52 114.38 116.81 2wrh h ARG 616 Ca 0.07 -0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2wrh h ARG 616 Cb 0.37 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 2wrh h ARG 616 CO 0.01 0.47 0.41 -0.91 -1.51 0.00 0.00 179.97 178.43 2wrh h ASN 617 N 0.52 0.63 -0.41 -3.80 2.35 -0.59 -0.63 115.58 113.64 2wrh h ASN 617 Ca 0.14 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 2wrh h ASN 617 Cb 0.07 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 2wrh h ASN 617 CO -0.02 0.42 0.11 0.25 -1.65 0.00 0.00 177.43 176.53 2wrh h LEU 618 N 0.76 0.62 -1.26 1.61 5.85 -0.99 -0.76 115.31 121.14 2wrh h LEU 618 Ca 0.30 -0.23 0.06 0.00 0.84 0.00 0.00 57.88 58.84 2wrh h LEU 618 Cb 0.13 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 2wrh h LEU 618 CO -0.15 0.69 0.53 0.22 -0.34 0.00 0.00 178.44 179.38 2wrh h TYR 619 N 0.52 0.92 0.00 1.25 3.20 -0.81 -2.34 116.97 119.71 2wrh h TYR 619 Ca 0.13 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.86 2wrh h TYR 619 Cb 0.30 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2wrh h TYR 619 CO 0.02 0.50 -0.79 0.93 -1.64 0.00 0.00 178.16 177.17 2wrh h GLU 620 N 0.92 0.00 -0.64 1.82 5.08 -0.53 -1.87 114.58 119.36 2wrh h GLU 620 Ca 0.34 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.65 2wrh h GLU 620 Cb 0.17 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2wrh h GLU 620 CO -0.12 0.79 0.19 -0.22 -1.00 0.00 0.00 179.01 178.66 2wrh h LYS 621 N 0.00 0.98 0.50 2.33 3.64 -0.64 -0.79 116.57 122.58 2wrh h LYS 621 Ca -0.01 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.15 2wrh h LYS 621 Cb 1.45 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2wrh h LYS 621 CO 0.10 0.84 -0.24 0.28 -2.27 0.00 0.00 179.45 178.17 2wrh h VAL 622 N 0.94 0.09 -0.94 2.00 2.07 -1.37 -2.96 116.25 116.09 2wrh h VAL 622 Ca 0.21 -0.52 0.25 0.00 0.82 0.00 0.00 66.70 67.46 2wrh h VAL 622 Cb 0.28 0.15 -0.17 0.00 -1.52 0.00 0.00 31.29 30.03 2wrh h VAL 622 CO -0.01 0.02 0.04 0.50 0.02 0.00 0.00 177.57 178.15 2wrh h LYS 623 N -1.14 0.05 -0.67 1.57 3.64 -1.30 -0.77 116.57 117.95 2wrh h LYS 623 Ca -0.07 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 2wrh h LYS 623 Cb 0.54 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 2wrh h LYS 623 CO 0.11 0.03 0.27 1.03 -2.27 0.00 0.00 179.45 178.62 2wrh h SER 624 N 0.05 0.92 0.15 4.20 0.87 -1.19 -1.27 113.55 117.26 2wrh h SER 624 Ca 0.56 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.94 2wrh h SER 624 Cb 1.13 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.85 2wrh h SER 624 CO -0.85 0.84 -0.07 1.56 -0.53 0.00 0.00 176.83 177.77 2wrh h GLN 625 N 0.94 -0.19 -0.41 2.24 4.20 -1.01 -3.30 115.11 117.59 2wrh h GLN 625 Ca 0.22 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.89 2wrh h GLN 625 Cb 0.20 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 2wrh h GLN 625 CO -0.02 0.16 0.01 -0.07 -0.67 0.00 0.00 178.83 178.24 2wrh h LEU 626 N -0.56 0.61 0.00 1.46 3.38 -1.22 -3.45 115.31 115.52 2wrh h LEU 626 Ca -0.02 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2wrh h LEU 626 Cb 0.43 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2wrh h LEU 626 CO 0.03 0.67 0.00 0.54 0.09 0.00 0.00 178.44 179.77 2wrh n ARG 627 N -4.26 0.00 -0.17 1.13 1.74 -0.49 -1.13 116.66 113.49 2wrh n ARG 627 Ca 0.02 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.12 2wrh n ARG 627 Cb 0.26 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 31.78 2wrh n ARG 627 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2wrh n ASN 628 N -0.31 1.87 -0.10 0.55 6.94 -1.26 -3.55 115.26 119.38 2wrh n ASN 628 Ca 0.00 -2.17 0.14 0.00 -0.02 0.00 0.00 54.58 52.52 2wrh n ASN 628 Cb 0.00 -0.51 0.50 0.00 -2.36 0.00 0.00 39.78 37.41 2wrh n ASN 628 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2wrh n ASN 629 N 0.11 0.52 -4.01 0.53 5.03 -0.28 -4.89 115.26 112.27 2wrh n ASN 629 Ca 0.05 -0.43 -0.10 0.00 0.87 0.00 0.00 54.58 54.98 2wrh n ASN 629 Cb 0.42 -0.03 -0.08 0.00 -1.02 0.00 0.00 39.78 39.07 2wrh n ASN 629 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2wrh s ALA 630 N -2.64 0.22 -0.12 5.41 0.00 -1.23 -1.14 121.76 122.26 2wrh s ALA 630 Ca 0.23 -1.03 -0.00 0.00 0.00 0.00 0.00 51.96 51.16 2wrh s ALA 630 Cb 0.19 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 24.14 2wrh s ALA 630 CO 0.53 -0.60 -0.12 -1.59 0.00 0.00 0.00 175.76 173.98 2wrh s LYS 631 N -3.98 3.29 -0.47 0.00 -2.85 0.25 -4.87 119.74 111.11 2wrh s LYS 631 Ca 0.18 -0.66 -0.27 0.00 -1.00 0.00 0.00 55.97 54.22 2wrh s LYS 631 Cb 0.04 -2.63 -0.03 0.00 -2.06 0.00 0.00 37.83 33.15 2wrh s LYS 631 CO -0.00 0.28 1.97 -1.21 0.10 0.00 0.00 175.35 176.50 2wrh s GLU 632 N 0.18 2.79 -0.05 1.78 2.02 -1.26 -1.04 118.70 123.12 2wrh s GLU 632 Ca -0.07 1.14 0.16 0.00 0.02 0.00 0.00 54.97 56.22 2wrh s GLU 632 Cb -0.15 -4.36 0.54 0.00 0.10 0.00 0.00 34.13 30.26 2wrh s GLU 632 CO 0.05 -2.51 1.43 0.44 0.02 0.00 0.00 175.26 174.69 2wrh n ILE 633 N 7.47 1.11 -0.10 -1.63 -0.00 -0.47 -5.00 119.36 120.74 2wrh n ILE 633 Ca 0.25 -0.84 0.01 0.00 -0.00 0.00 0.00 62.75 62.17 2wrh n ILE 633 Cb 0.50 0.20 -0.01 0.00 -0.00 0.00 0.00 39.64 40.34 2wrh n ILE 633 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2wrh n GLY 634 N 1.18 -2.48 2.37 3.28 0.00 -1.24 -4.87 105.19 103.42 2wrh n GLY 634 Ca 0.20 -1.44 -0.15 0.00 0.00 0.00 0.00 46.02 44.63 2wrh n GLY 634 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wrh n ASN 635 N -2.29 -4.66 0.00 1.61 2.85 -1.19 -2.80 115.26 108.78 2wrh n ASN 635 Ca -0.01 0.22 0.00 0.00 -0.11 0.00 0.00 54.58 54.69 2wrh n ASN 635 Cb 0.05 -3.58 0.00 0.00 1.24 0.00 0.00 39.78 37.49 2wrh n ASN 635 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2wrh n GLY 636 N -1.12 0.57 3.56 8.20 0.00 -1.26 -4.70 105.19 110.45 2wrh n GLY 636 Ca -0.16 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.20 2wrh n GLY 636 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrh s PHE 638 N -0.89 2.60 -0.28 0.00 0.40 -1.26 -1.37 117.98 117.17 2wrh s PHE 638 Ca 0.15 -0.75 -0.06 0.00 -0.60 0.00 0.00 56.93 55.67 2wrh s PHE 638 Cb -0.11 -1.70 0.00 0.00 0.51 0.00 0.00 43.02 41.73 2wrh s PHE 638 CO 0.04 -0.24 0.06 -2.00 0.70 0.00 0.00 175.22 173.79 2wrh s GLU 639 N 0.06 3.15 0.34 0.44 2.12 -0.21 -4.88 118.70 119.73 2wrh s GLU 639 Ca -0.09 -0.81 -0.28 0.00 0.36 0.00 0.00 54.97 54.15 2wrh s GLU 639 Cb -0.15 -3.32 -0.10 0.00 0.26 0.00 0.00 34.13 30.81 2wrh s GLU 639 CO 0.06 -0.40 1.34 -0.06 -0.54 0.00 0.00 175.26 175.66 2wrh s PHE 640 N 1.50 2.95 0.10 5.30 0.40 -1.26 -0.58 117.98 126.38 2wrh s PHE 640 Ca 0.03 1.37 0.08 0.00 -0.60 0.00 0.00 56.93 57.81 2wrh s PHE 640 Cb -0.17 -3.74 -0.21 0.00 0.51 0.00 0.00 43.02 39.40 2wrh s PHE 640 CO 0.02 -2.08 1.19 1.88 0.70 0.00 0.00 175.22 176.93 2wrh h TYR 641 N 3.27 0.00 -2.71 0.36 -1.99 -1.48 -3.46 116.97 110.96 2wrh h TYR 641 Ca -0.49 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.23 2wrh h TYR 641 Cb 1.23 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.96 2wrh h TYR 641 CO 0.55 1.00 0.00 -2.39 -0.00 0.00 0.00 178.16 177.32 2wrh n HIS 642 N -3.31 -0.89 -4.01 4.88 1.44 -1.26 -5.09 115.22 107.00 2wrh n HIS 642 Ca -0.02 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.33 2wrh n HIS 642 Cb 0.96 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.94 2wrh n HIS 642 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 2wrh s LYS 643 N 0.96 3.56 -0.50 -1.40 2.47 -1.26 -5.07 119.74 118.49 2wrh s LYS 643 Ca 0.00 -0.54 -0.03 0.00 -1.56 0.00 0.00 55.97 53.83 2wrh s LYS 643 Cb 0.00 -3.09 0.13 0.00 -1.46 0.00 0.00 37.83 33.42 2wrh s LYS 643 CO 0.00 -0.06 0.31 0.00 0.16 0.00 0.00 175.35 175.76 2wrh s ASP 645 N 1.39 2.17 0.21 0.00 3.84 -1.26 -4.68 116.67 118.35 2wrh s ASP 645 Ca 0.12 0.59 -0.09 0.00 -0.00 0.00 0.00 52.55 53.17 2wrh s ASP 645 Cb -0.22 -0.85 0.28 0.00 -1.38 0.00 0.00 42.92 40.75 2wrh s ASP 645 CO -0.04 -3.35 1.77 0.44 -0.00 0.00 0.00 175.17 174.00 2wrh h ASP 646 N -2.05 0.39 -0.46 2.11 3.32 -1.99 -1.43 116.42 116.31 2wrh h ASP 646 Ca -0.46 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 2wrh h ASP 646 Cb 1.28 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.80 2wrh h ASP 646 CO 0.41 0.24 0.27 -0.33 -1.72 0.00 0.00 179.24 178.11 2wrh h GLU 647 N 0.54 0.65 -0.10 3.56 5.08 -1.99 -1.49 114.58 120.84 2wrh h GLU 647 Ca 0.31 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.49 2wrh h GLU 647 Cb 0.32 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.44 2wrh h GLU 647 CO -0.25 0.48 -0.43 0.00 -1.00 0.00 0.00 179.01 177.80 2wrh h MET 649 N 0.04 0.26 -0.68 0.00 2.86 -1.16 -0.03 114.93 116.22 2wrh h MET 649 Ca -0.03 -0.02 0.16 0.00 -2.06 0.00 0.00 59.70 57.76 2wrh h MET 649 Cb 1.07 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.63 2wrh h MET 649 CO 0.09 0.18 0.47 1.49 1.06 0.00 0.00 176.91 180.20 2wrh h GLU 650 N 0.27 0.22 -0.19 1.72 4.57 -1.21 -0.61 114.58 119.35 2wrh h GLU 650 Ca 0.20 -0.01 -0.21 0.00 -1.18 0.00 0.00 59.36 58.15 2wrh h GLU 650 Cb 0.20 -0.05 0.01 0.00 -0.16 0.00 0.00 28.75 28.75 2wrh h GLU 650 CO -0.22 0.15 -0.72 0.66 -1.18 0.00 0.00 179.01 177.70 2wrh h SER 651 N 0.23 0.95 -0.75 1.04 4.64 -0.49 0.10 113.55 119.27 2wrh h SER 651 Ca 0.33 -0.59 -0.05 0.00 -0.47 0.00 0.00 61.79 61.01 2wrh h SER 651 Cb 0.98 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 2wrh h SER 651 CO -0.07 1.39 0.26 0.58 -0.87 0.00 0.00 176.83 178.12 2wrh h VAL 652 N 0.58 1.26 -0.28 0.95 2.07 -0.45 0.47 116.25 120.85 2wrh h VAL 652 Ca -0.03 -0.87 -0.08 0.00 0.82 0.00 0.00 66.70 66.54 2wrh h VAL 652 Cb 1.34 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2wrh h VAL 652 CO 0.15 0.35 -0.13 0.11 0.02 0.00 0.00 177.57 178.06 2wrh h LYS 653 N 1.11 0.58 -0.25 1.57 1.57 -1.08 -2.73 116.57 117.33 2wrh h LYS 653 Ca 0.25 -0.25 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 2wrh h LYS 653 Cb 0.27 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2wrh h LYS 653 CO -0.01 0.82 0.21 -0.91 -0.57 0.00 0.00 179.45 178.99 2wrh h ASN 654 N 0.32 0.00 -0.25 0.86 4.21 -0.50 -3.46 115.58 116.75 2wrh h ASN 654 Ca 0.06 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.57 2wrh h ASN 654 Cb 0.65 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.85 2wrh h ASN 654 CO 0.04 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.79 2wrh n GLY 655 N -1.51 0.67 0.03 2.83 0.00 -0.16 -4.98 105.19 102.06 2wrh n GLY 655 Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2wrh n GLY 655 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wrh n THR 656 N -3.26 0.50 -0.40 2.61 -1.04 0.15 -4.93 114.28 107.90 2wrh n THR 656 Ca 0.00 -0.75 -0.09 0.00 -2.04 0.00 0.00 64.05 61.17 2wrh n THR 656 Cb 0.45 0.76 -0.08 0.00 -1.82 0.00 0.00 70.33 69.64 2wrh n THR 656 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wrh n TYR 657 N -0.20 -0.36 -2.84 -1.42 9.36 -1.13 -4.91 117.16 115.67 2wrh n TYR 657 Ca 0.01 1.21 -0.06 0.00 3.32 0.00 0.00 57.90 62.38 2wrh n TYR 657 Cb 0.14 -0.62 0.01 0.00 -0.63 0.00 0.00 39.34 38.24 2wrh n TYR 657 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2wrh n ASP 658 N -5.25 -7.89 -3.65 2.98 8.00 -1.26 -4.94 116.55 104.54 2wrh n ASP 658 Ca 0.03 0.81 0.00 0.00 0.71 0.00 0.00 54.79 56.34 2wrh n ASP 658 Cb 0.27 -5.19 -0.06 0.00 -0.02 0.00 0.00 41.12 36.12 2wrh n ASP 658 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2wrh s TYR 659 N -2.23 -0.23 -0.82 1.24 6.04 -1.26 -5.20 117.35 114.89 2wrh s TYR 659 Ca 0.17 0.47 0.00 0.00 0.04 0.00 0.00 57.07 57.75 2wrh s TYR 659 Cb -0.05 0.16 0.00 0.00 -1.04 0.00 0.00 41.96 41.03 2wrh s TYR 659 CO 0.77 -0.12 0.20 -2.30 -1.54 0.00 0.00 175.55 172.56