#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 -2.97 0.99 5.85 -1.93 -2.51 115.31 114.73 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 0.06 0.00 0.49 -0.34 0.00 0.00 178.44 178.65 2wrh n PHE 503 N -3.24 0.33 -1.21 1.25 3.01 -1.26 -5.01 117.46 111.32 2wrh n PHE 503 Ca -0.00 -0.58 -0.09 0.00 1.01 0.00 0.00 57.45 57.79 2wrh n PHE 503 Cb 0.28 -0.08 -0.04 0.00 -0.01 0.00 0.00 39.48 39.63 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 -0.08 0.82 0.03 1.37 0.00 -0.95 -4.85 105.19 101.54 2wrh n GLY 504 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 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 1.07 0.26 -1.92 4.61 0.00 -1.26 -1.49 120.51 121.78 2wrh n ALA 505 Ca -0.09 -0.37 -0.42 0.00 0.00 0.00 0.00 53.44 52.56 2wrh n ALA 505 Cb 0.55 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.59 2.91 -0.11 0.00 1.09 -1.26 -1.26 121.20 120.98 2wrh s ILE 506 Ca -0.08 0.45 0.00 0.00 -1.10 0.00 0.00 60.65 59.92 2wrh s ILE 506 Cb 0.01 -3.29 0.00 0.00 -1.06 0.00 0.00 42.46 38.12 2wrh s ILE 506 CO 0.12 0.01 0.00 0.00 -0.10 0.00 0.00 174.94 174.97 2wrh n ALA 507 N 5.20 -0.02 -2.00 9.38 0.00 -1.17 -4.57 120.51 127.33 2wrh n ALA 507 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2wrh n ALA 507 Cb 0.40 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 0.17 0.97 0.18 0.00 0.00 -0.39 -4.88 105.19 101.23 2wrh n GLY 508 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.77 1.61 -5.15 -1.27 -3.28 116.94 106.08 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 0.36 0.41 0.42 -2.00 0.00 0.00 178.31 177.51 2wrh s ILE 510 N -3.35 4.69 0.37 0.88 1.09 -1.05 -3.12 121.20 120.70 2wrh s ILE 510 Ca 0.02 -1.01 0.04 0.00 -1.10 0.00 0.00 60.65 58.60 2wrh s ILE 510 Cb 0.09 -4.62 0.24 0.00 -1.06 0.00 0.00 42.46 37.11 2wrh s ILE 510 CO 0.69 -1.31 1.99 -0.33 -0.10 0.00 0.00 174.94 175.88 2wrh h GLU 511 N 9.15 0.66 -4.81 2.79 5.08 -1.82 -3.10 114.58 122.54 2wrh h GLU 511 Ca -0.17 -0.06 -0.44 0.00 -1.00 0.00 0.00 59.36 57.69 2wrh h GLU 511 Cb 1.06 -0.14 -0.13 0.00 0.50 0.00 0.00 28.75 30.05 2wrh h GLU 511 CO 1.11 0.49 -0.46 0.20 -1.00 0.00 0.00 179.01 179.35 2wrh s GLY 512 N -3.63 2.22 0.35 -3.84 0.00 -1.26 -4.41 107.32 96.75 2wrh s GLY 512 Ca -0.09 -2.01 0.07 0.00 0.00 0.00 0.00 44.72 42.69 2wrh s GLY 512 CO 0.75 -1.42 0.39 -0.32 0.00 0.00 0.00 173.10 172.51 2wrh s GLY 513 N -3.35 1.74 -0.34 0.20 0.00 -1.26 -4.90 107.32 99.42 2wrh s GLY 513 Ca 0.40 -1.59 -0.08 0.00 0.00 0.00 0.00 44.72 43.45 2wrh s GLY 513 CO 0.27 -1.50 0.13 -0.98 0.00 0.00 0.00 173.10 171.01 2wrh s TRP 514 N -2.27 3.22 -0.55 1.90 0.51 -1.26 -4.91 118.94 115.59 2wrh s TRP 514 Ca 0.44 -1.17 0.25 0.00 -2.12 0.00 0.00 56.10 53.50 2wrh s TRP 514 Cb -0.07 -2.31 0.93 0.00 -0.81 0.00 0.00 33.47 31.20 2wrh s TRP 514 CO 0.29 -0.66 1.74 0.25 -0.51 0.00 0.00 176.95 178.06 2wrh n THR 515 N 4.88 0.74 0.25 2.01 -2.24 -1.26 -2.89 114.28 115.77 2wrh n THR 515 Ca -0.13 0.03 0.13 0.00 -2.27 0.00 0.00 64.05 61.82 2wrh n THR 515 Cb 0.46 -0.95 0.29 0.00 -2.10 0.00 0.00 70.33 68.03 2wrh n THR 515 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2wrh h GLY 516 N 3.09 0.00 -7.55 3.38 0.00 -2.03 -3.39 103.07 96.56 2wrh h GLY 516 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 47.33 46.61 2wrh h GLY 516 CO 0.00 0.00 0.65 -0.29 0.00 0.00 0.00 176.54 176.90 2wrh s MET 517 N -3.30 3.60 0.07 4.80 0.00 -1.14 -4.82 119.30 118.50 2wrh s MET 517 Ca 0.06 -1.94 0.24 0.00 0.00 0.00 0.00 55.69 54.04 2wrh s MET 517 Cb 0.06 -4.79 0.25 0.00 0.00 0.00 0.00 34.83 30.35 2wrh s MET 517 CO 0.64 -1.65 1.21 0.44 0.00 0.00 0.00 175.02 175.66 2wrh n ILE 518 N 5.10 0.21 -0.89 10.11 -0.00 -1.26 -4.37 119.36 128.26 2wrh n ILE 518 Ca 0.21 -0.20 -0.04 0.00 -0.00 0.00 0.00 62.75 62.72 2wrh n ILE 518 Cb 0.49 0.10 0.31 0.00 -0.00 0.00 0.00 39.64 40.53 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 -1.92 4.86 0.00 7.28 5.75 -1.26 -5.00 116.55 126.26 2wrh n ASP 519 Ca 0.03 -3.10 0.00 0.00 -0.01 0.00 0.00 54.79 51.71 2wrh n ASP 519 Cb 0.42 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 39.78 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 0.02 -0.54 0.12 6.12 0.00 -1.26 -4.71 105.19 104.94 2wrh n GLY 520 Ca 0.37 -1.23 -0.21 0.00 0.00 0.00 0.00 46.02 44.95 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 0.35 -3.56 1.61 6.55 -1.90 -3.47 115.95 115.53 2wrh h TRP 521 Ca 0.00 -0.25 -0.66 0.00 0.95 0.00 0.00 58.89 58.93 2wrh h TRP 521 Cb 0.00 -0.01 -0.20 0.00 -0.86 0.00 0.00 29.16 28.08 2wrh h TRP 521 CO 0.00 1.51 -0.84 0.71 -1.05 0.00 0.00 178.44 178.76 2wrh s TYR 522 N -2.44 2.24 0.00 0.49 1.51 -1.26 -5.07 117.35 112.82 2wrh s TYR 522 Ca -0.21 -0.38 0.00 0.00 -1.01 0.00 0.00 57.07 55.47 2wrh s TYR 522 Cb 0.04 -1.16 0.00 0.00 -0.11 0.00 0.00 41.96 40.73 2wrh s TYR 522 CO 0.74 0.40 0.00 0.41 -1.11 0.00 0.00 175.55 175.99 2wrh n GLY 523 N 0.60 0.96 3.43 0.71 0.00 -1.26 -0.86 105.19 108.76 2wrh n GLY 523 Ca -0.15 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.16 1.95 -0.00 1.61 1.51 0.45 -4.87 117.35 115.83 2wrh s TYR 524 Ca 0.00 -0.70 -0.00 0.00 -1.01 0.00 0.00 57.07 55.35 2wrh s TYR 524 Cb 0.00 -1.12 -0.00 0.00 -0.11 0.00 0.00 41.96 40.73 2wrh s TYR 524 CO 0.00 0.27 -0.01 1.58 -1.11 0.00 0.00 175.55 176.29 2wrh n HIS 525 N -0.58 0.00 -0.78 2.71 -0.00 -1.26 -2.31 115.22 112.99 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 0.63 -0.01 0.00 0.00 -0.12 0.00 0.00 29.99 30.49 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 -2.57 -2.17 -3.70 1.57 -0.00 -1.26 -3.69 115.22 103.40 2wrh n HIS 526 Ca -0.00 1.16 -0.15 0.00 -0.00 0.00 0.00 57.72 58.72 2wrh n HIS 526 Cb 0.01 -2.24 -0.15 0.00 -0.00 0.00 0.00 29.99 27.61 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 -4.91 0.06 0.26 -1.40 0.74 -1.26 -3.29 119.66 109.87 2wrh s GLN 527 Ca 0.00 0.49 0.01 0.00 0.05 0.00 0.00 55.36 55.91 2wrh s GLN 527 Cb 0.00 -0.23 0.01 0.00 1.10 0.00 0.00 33.01 33.89 2wrh s GLN 527 CO 0.00 -0.25 0.09 0.09 -0.55 0.00 0.00 175.29 174.67 2wrh n ASN 528 N 4.85 2.34 -0.24 6.67 3.02 0.26 -4.99 115.26 127.17 2wrh n ASN 528 Ca -0.14 -2.03 0.13 0.00 -0.03 0.00 0.00 54.58 52.51 2wrh n ASN 528 Cb 0.51 0.09 0.38 0.00 -0.61 0.00 0.00 39.78 40.15 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 -0.85 0.83 -0.24 3.52 0.28 -1.26 -3.61 120.64 119.31 2wrh n GLU 529 Ca -0.06 -0.49 0.10 0.00 -0.16 0.00 0.00 57.16 56.55 2wrh n GLU 529 Cb 0.32 -1.49 0.26 0.00 1.43 0.00 0.00 31.44 31.95 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 -0.66 2.24 0.00 3.44 6.02 -1.26 -5.07 117.38 122.09 2wrh n GLN 530 Ca 0.12 -1.91 0.00 0.00 -0.01 0.00 0.00 57.00 55.20 2wrh n GLN 530 Cb 0.35 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 30.17 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 1.36 0.16 3.25 1.08 0.00 -1.24 -5.10 105.19 104.70 2wrh n GLY 531 Ca 0.18 -2.25 -0.12 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.53 0.00 1.61 3.41 -1.26 0.90 113.62 116.75 2wrh n SER 532 Ca 0.00 -2.68 0.00 0.00 -0.26 0.00 0.00 58.87 55.93 2wrh n SER 532 Cb 0.00 2.73 0.00 0.00 -0.26 0.00 0.00 64.21 66.68 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 -0.53 1.72 3.94 5.00 0.00 -1.21 -5.03 105.19 109.09 2wrh n GLY 533 Ca -0.02 -1.52 -0.24 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.80 3.49 -0.28 1.61 1.51 -1.26 -4.30 117.35 116.32 2wrh s TYR 534 Ca 0.00 0.32 -0.16 0.00 -1.01 0.00 0.00 57.07 56.22 2wrh s TYR 534 Cb 0.00 -1.86 0.08 0.00 -0.11 0.00 0.00 41.96 40.07 2wrh s TYR 534 CO 0.00 0.18 0.69 0.00 -1.11 0.00 0.00 175.55 175.31 2wrh s ALA 535 N -2.23 -1.87 0.44 3.71 0.00 -0.98 -5.01 121.76 115.83 2wrh s ALA 535 Ca 0.39 2.41 -0.21 0.00 0.00 0.00 0.00 51.96 54.55 2wrh s ALA 535 Cb -0.10 -1.42 -0.10 0.00 0.00 0.00 0.00 23.12 21.50 2wrh s ALA 535 CO 0.34 -0.38 0.97 0.00 0.00 0.00 0.00 175.76 176.69 2wrh s ALA 536 N 1.59 3.01 -0.45 0.00 0.00 -1.26 -0.42 121.76 124.24 2wrh s ALA 536 Ca -0.10 0.43 -0.24 0.00 0.00 0.00 0.00 51.96 52.05 2wrh s ALA 536 Cb -0.05 -3.17 0.03 0.00 0.00 0.00 0.00 23.12 19.93 2wrh s ALA 536 CO -0.19 0.04 0.84 0.34 0.00 0.00 0.00 175.76 176.79 2wrh s ASP 537 N -2.18 6.45 0.20 0.00 -1.08 -0.04 -4.86 116.67 115.16 2wrh s ASP 537 Ca 0.63 -0.01 -0.08 0.00 -0.52 0.00 0.00 52.55 52.57 2wrh s ASP 537 Cb -0.10 -2.41 0.11 0.00 -1.46 0.00 0.00 42.92 39.06 2wrh s ASP 537 CO 0.15 -0.96 1.65 1.56 0.52 0.00 0.00 175.17 178.09 2wrh h GLN 538 N 9.00 1.01 0.78 4.34 1.08 -1.95 -2.62 115.11 126.75 2wrh h GLN 538 Ca -0.24 -0.33 -0.04 0.00 -1.45 0.00 0.00 58.65 56.59 2wrh h GLN 538 Cb 1.08 -0.09 0.01 0.00 -0.05 0.00 0.00 27.48 28.43 2wrh h GLN 538 CO 0.98 1.01 -0.37 -0.22 -0.95 0.00 0.00 178.83 179.28 2wrh h LYS 539 N 0.92 -1.01 -0.47 1.46 3.64 -1.98 0.06 116.57 119.19 2wrh h LYS 539 Ca 0.16 0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.51 2wrh h LYS 539 Cb 0.58 0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 2wrh h LYS 539 CO 0.03 -0.67 -0.09 0.66 -2.27 0.00 0.00 179.45 177.12 2wrh h SER 540 N -1.05 0.89 -0.16 4.20 4.64 -1.97 -0.25 113.55 119.86 2wrh h SER 540 Ca -0.11 -0.35 0.03 0.00 -0.47 0.00 0.00 61.79 60.89 2wrh h SER 540 Cb 0.80 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.62 2wrh h SER 540 CO 0.18 1.03 -0.02 0.74 -0.87 0.00 0.00 176.83 177.89 2wrh h THR 541 N 0.74 0.86 -0.86 2.95 2.02 -1.40 0.17 112.91 117.39 2wrh h THR 541 Ca 0.12 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 2wrh h THR 541 Cb 0.63 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 2wrh h THR 541 CO 0.04 0.00 0.41 -0.61 0.37 0.00 0.00 175.52 175.74 2wrh h GLN 542 N 0.03 1.23 -0.34 6.66 5.75 -0.86 0.22 115.11 127.79 2wrh h GLN 542 Ca 0.08 -0.18 -0.00 0.00 -0.15 0.00 0.00 58.65 58.39 2wrh h GLN 542 Cb 0.11 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 2wrh h GLN 542 CO -0.15 0.94 0.21 -0.91 -2.65 0.00 0.00 178.83 176.27 2wrh h ASN 543 N 1.22 0.41 -0.12 -0.69 2.35 -0.30 0.02 115.58 118.48 2wrh h ASN 543 Ca 0.29 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.99 2wrh h ASN 543 Cb 0.11 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2wrh h ASN 543 CO -0.04 0.34 0.06 0.00 -1.65 0.00 0.00 177.43 176.14 2wrh h ALA 544 N 1.09 0.15 -0.88 -0.83 0.00 -0.32 -0.05 119.26 118.42 2wrh h ALA 544 Ca 0.12 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.09 2wrh h ALA 544 Cb 0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.66 2wrh h ALA 544 CO -0.02 -0.28 0.50 0.82 0.00 0.00 0.00 179.25 180.26 2wrh h ILE 545 N 0.06 0.81 -0.07 0.00 5.03 -0.37 0.14 117.51 123.10 2wrh h ILE 545 Ca 0.04 -0.26 -0.01 0.00 -0.12 0.00 0.00 64.86 64.51 2wrh h ILE 545 Cb 0.13 -0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 33.91 2wrh h ILE 545 CO -0.00 0.14 0.00 0.44 -0.68 0.00 0.00 178.15 178.05 2wrh h ASP 546 N 0.74 0.13 0.19 1.72 3.32 -0.64 -1.26 116.42 120.62 2wrh h ASP 546 Ca 0.46 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 2wrh h ASP 546 Cb 0.57 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2wrh h ASP 546 CO -0.32 0.39 -0.09 1.23 -1.72 0.00 0.00 179.24 178.73 2wrh h GLY 547 N -0.14 -0.27 1.25 2.75 0.00 -0.38 -1.09 103.07 105.20 2wrh h GLY 547 Ca 0.02 0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 2wrh h GLY 547 CO 0.00 -0.10 0.34 -2.22 0.00 0.00 0.00 176.54 174.57 2wrh h ILE 548 N -0.30 1.22 -0.62 2.60 5.03 -0.79 -0.97 117.51 123.67 2wrh h ILE 548 Ca -0.03 -0.60 0.01 0.00 -0.12 0.00 0.00 64.86 64.13 2wrh h ILE 548 Cb 0.23 0.32 -0.03 0.00 -3.03 0.00 0.00 36.82 34.31 2wrh h ILE 548 CO 0.04 0.25 0.41 0.74 -0.68 0.00 0.00 178.15 178.92 2wrh h THR 549 N 0.97 1.15 -0.77 -0.27 2.02 -0.98 -0.89 112.91 114.15 2wrh h THR 549 Ca 0.24 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 2wrh h THR 549 Cb 0.08 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 66.70 2wrh h THR 549 CO -0.03 0.15 0.41 -1.28 0.37 0.00 0.00 175.52 175.13 2wrh h SER 550 N 0.83 0.97 0.19 4.18 0.87 -0.26 -0.42 113.55 119.91 2wrh h SER 550 Ca 0.23 -0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2wrh h SER 550 Cb -0.08 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.63 2wrh h SER 550 CO -0.06 0.79 -0.09 0.50 -0.53 0.00 0.00 176.83 177.45 2wrh h LYS 551 N 1.08 -0.25 -0.35 2.24 3.64 -0.70 -0.09 116.57 122.14 2wrh h LYS 551 Ca 0.27 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2wrh h LYS 551 Cb 0.05 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2wrh h LYS 551 CO -0.04 -0.14 0.22 0.28 -2.27 0.00 0.00 179.45 177.50 2wrh h VAL 552 N -0.29 1.12 -0.51 2.00 2.07 -0.87 -2.03 116.25 117.74 2wrh h VAL 552 Ca -0.03 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.29 2wrh h VAL 552 Cb 0.22 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 2wrh h VAL 552 CO 0.04 0.11 0.24 0.78 0.02 0.00 0.00 177.57 178.76 2wrh h ASN 553 N 0.46 0.31 -0.06 0.57 2.35 -0.86 -1.27 115.58 117.08 2wrh h ASN 553 Ca 0.13 0.04 0.03 0.00 -0.55 0.00 0.00 56.30 55.95 2wrh h ASN 553 Cb -0.00 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 2wrh h ASN 553 CO -0.02 0.21 -0.14 0.28 -1.65 0.00 0.00 177.43 176.11 2wrh h SER 554 N 0.46 -0.43 -0.65 5.81 0.02 -0.68 0.33 113.55 118.41 2wrh h SER 554 Ca 0.23 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.23 2wrh h SER 554 Cb 0.18 0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 2wrh h SER 554 CO -0.19 -0.19 0.32 0.58 -1.14 0.00 0.00 176.83 176.21 2wrh h VAL 555 N -0.21 1.22 -0.12 2.27 2.07 -1.08 -1.93 116.25 118.47 2wrh h VAL 555 Ca 0.07 -0.60 -0.19 0.00 0.82 0.00 0.00 66.70 66.80 2wrh h VAL 555 Cb 0.31 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2wrh h VAL 555 CO -0.19 0.25 -0.71 0.40 0.02 0.00 0.00 177.57 177.35 2wrh h ILE 556 N 0.89 1.34 0.00 4.57 2.04 -0.96 -3.41 117.51 121.98 2wrh h ILE 556 Ca 0.22 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 64.06 2wrh h ILE 556 Cb 0.10 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2wrh h ILE 556 CO -0.03 0.62 -1.17 1.21 0.00 0.00 0.00 178.15 178.78 2wrh n GLU 557 N -3.89 1.27 0.03 2.37 2.13 0.11 -4.22 120.64 118.44 2wrh n GLU 557 Ca -0.05 -0.06 0.10 0.00 0.66 0.00 0.00 57.16 57.81 2wrh n GLU 557 Cb 0.70 -1.15 0.43 0.00 0.27 0.00 0.00 31.44 31.69 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 -1.67 0.05 -1.87 5.31 4.76 -0.73 -4.67 118.16 119.34 2wrh n LYS 558 Ca -0.01 0.21 -0.43 0.00 -2.87 0.00 0.00 58.31 55.21 2wrh n LYS 558 Cb 0.22 -1.58 -0.03 0.00 -1.84 0.00 0.00 35.03 31.80 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 -3.06 3.34 0.30 1.97 -2.45 -1.26 -4.99 119.30 113.15 2wrh s MET 559 Ca 0.09 1.69 -0.22 0.00 -1.25 0.00 0.00 55.69 56.00 2wrh s MET 559 Cb 0.12 -4.24 -0.09 0.00 1.25 0.00 0.00 34.83 31.87 2wrh s MET 559 CO 0.38 -1.85 0.86 1.21 1.05 0.00 0.00 175.02 176.66 2wrh s ASN 560 N 6.59 7.16 -0.03 1.11 2.47 -1.26 -5.07 114.94 125.90 2wrh s ASN 560 Ca 0.86 1.64 -0.01 0.00 0.42 0.00 0.00 52.86 55.77 2wrh s ASN 560 Cb -0.27 -2.51 0.03 0.00 -1.45 0.00 0.00 41.25 37.06 2wrh s ASN 560 CO 0.34 -0.08 0.05 0.28 -3.72 0.00 0.00 177.10 173.97 2wrh s THR 561 N -1.68 -0.09 -0.10 -5.21 -1.32 -1.26 -5.14 115.64 100.84 2wrh s THR 561 Ca 0.49 0.35 -0.03 0.00 -1.21 0.00 0.00 61.69 61.30 2wrh s THR 561 Cb -0.16 -0.12 -0.03 0.00 -1.51 0.00 0.00 72.50 70.67 2wrh s THR 561 CO 0.21 0.15 0.03 -1.10 -2.21 0.00 0.00 174.62 171.69 2wrh s GLN 562 N 1.77 3.15 0.06 7.08 -1.52 -1.26 -5.06 119.66 123.88 2wrh s GLN 562 Ca -0.00 -0.37 -0.30 0.00 -1.95 0.00 0.00 55.36 52.74 2wrh s GLN 562 Cb -0.12 -2.89 -0.09 0.00 -0.22 0.00 0.00 33.01 29.69 2wrh s GLN 562 CO -0.03 0.66 1.82 0.12 -0.25 0.00 0.00 175.29 177.61 2wrh s PHE 563 N -0.76 1.87 -0.10 0.91 5.36 -1.26 -4.97 117.98 119.02 2wrh s PHE 563 Ca 0.12 -0.08 -0.11 0.00 -0.96 0.00 0.00 56.93 55.90 2wrh s PHE 563 Cb -0.12 -4.12 0.03 0.00 -0.34 0.00 0.00 43.02 38.47 2wrh s PHE 563 CO 0.02 -4.78 0.31 0.99 -1.46 0.00 0.00 175.22 170.30 2wrh s THR 564 N 3.50 0.01 -0.17 0.12 2.01 -1.26 -5.06 115.64 114.79 2wrh s THR 564 Ca 0.81 -0.06 0.21 0.00 0.31 0.00 0.00 61.69 62.96 2wrh s THR 564 Cb -0.42 -0.46 -0.10 0.00 0.01 0.00 0.00 72.50 71.53 2wrh s THR 564 CO 0.36 -0.03 0.86 0.00 -0.69 0.00 0.00 174.62 175.12 2wrh n ALA 565 N 2.72 2.36 0.00 7.40 0.00 -1.26 -4.97 120.51 126.76 2wrh n ALA 565 Ca -0.14 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2wrh n ALA 565 Cb 0.58 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.05 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 -2.68 0.00 -1.67 0.00 0.31 -1.26 -4.85 118.33 108.19 2wrh n VAL 566 Ca -0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.85 2wrh n VAL 566 Cb 0.66 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.58 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 0.35 3.19 2.92 0.00 -1.26 -5.02 105.19 105.38 2wrh n GLY 567 Ca 0.00 0.33 -0.16 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.71 0.88 -0.17 1.61 -0.14 -1.26 -5.14 119.74 113.82 2wrh s LYS 568 Ca 0.57 -1.11 0.01 0.00 -1.36 0.00 0.00 55.97 54.07 2wrh s LYS 568 Cb -0.61 -0.71 0.03 0.00 -1.68 0.00 0.00 37.83 34.85 2wrh s LYS 568 CO 0.61 0.13 -0.15 -1.21 -0.76 0.00 0.00 175.35 173.97 2wrh s GLU 569 N -2.44 2.42 0.03 1.68 2.02 -1.26 -5.12 118.70 116.03 2wrh s GLU 569 Ca 0.04 -0.68 0.07 0.00 0.02 0.00 0.00 54.97 54.42 2wrh s GLU 569 Cb -0.06 -2.27 -0.02 0.00 0.10 0.00 0.00 34.13 31.88 2wrh s GLU 569 CO 0.02 -0.26 -0.21 -0.06 0.02 0.00 0.00 175.26 174.76 2wrh s PHE 570 N 1.42 1.82 0.92 1.61 0.08 -1.26 -5.13 117.98 117.45 2wrh s PHE 570 Ca 0.04 -0.37 -0.15 0.00 0.12 0.00 0.00 56.93 56.57 2wrh s PHE 570 Cb -0.13 -1.10 0.17 0.00 -0.57 0.00 0.00 43.02 41.38 2wrh s PHE 570 CO -0.11 0.07 1.29 0.54 -0.10 0.00 0.00 175.22 176.90 2wrh s ASN 571 N -1.04 3.46 0.00 1.36 2.20 -1.26 -4.92 114.94 114.75 2wrh s ASN 571 Ca 0.08 0.39 0.02 0.00 -0.94 0.00 0.00 52.86 52.40 2wrh s ASN 571 Cb -0.09 -0.54 0.14 0.00 -2.00 0.00 0.00 41.25 38.76 2wrh s ASN 571 CO 0.01 -2.53 0.95 -0.46 -2.94 0.00 0.00 177.10 172.14 2wrh n ASN 572 N -3.65 0.00 -0.08 3.54 2.04 -1.26 -1.60 115.26 114.25 2wrh n ASN 572 Ca 0.13 -1.65 0.07 0.00 -0.44 0.00 0.00 54.58 52.70 2wrh n ASN 572 Cb 0.60 0.00 0.10 0.00 -2.53 0.00 0.00 39.78 37.95 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 -0.54 2.30 -0.85 -4.53 4.77 -1.26 -4.64 117.00 112.25 2wrh n LEU 573 Ca 0.02 -2.76 0.04 0.00 -0.03 0.00 0.00 56.01 53.28 2wrh n LEU 573 Cb 0.01 -0.31 0.17 0.00 -2.33 0.00 0.00 43.42 40.96 2wrh n LEU 573 CO 0.01 0.65 0.30 -0.62 -1.33 0.00 0.00 177.39 176.40 2wrh n GLU 574 N -1.12 1.43 -0.36 3.23 1.02 -0.63 -4.85 120.64 119.36 2wrh n GLU 574 Ca 0.11 -3.14 -0.03 0.00 -0.02 0.00 0.00 57.16 54.09 2wrh n GLU 574 Cb 0.53 -1.38 0.10 0.00 -0.02 0.00 0.00 31.44 30.67 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 1.08 1.29 -0.06 3.49 9.65 -1.82 -0.54 114.38 127.46 2wrh h ARG 575 Ca -0.02 -0.10 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 2wrh h ARG 575 Cb 1.18 -0.28 -0.00 0.00 -1.39 0.00 0.00 29.97 29.48 2wrh h ARG 575 CO 0.06 0.88 0.04 0.00 2.80 0.00 0.00 179.97 183.75 2wrh h ARG 576 N 1.32 0.08 0.00 0.20 3.08 -1.95 -0.99 114.38 116.12 2wrh h ARG 576 Ca 0.35 -0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.32 2wrh h ARG 576 Cb -0.11 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2wrh h ARG 576 CO -0.07 0.05 -0.36 0.97 -1.07 0.00 0.00 179.97 179.49 2wrh h ILE 577 N 0.08 0.95 -0.33 2.04 6.09 -1.85 -1.34 117.51 123.16 2wrh h ILE 577 Ca 0.02 -1.38 -0.06 0.00 -1.37 0.00 0.00 64.86 62.07 2wrh h ILE 577 Cb -0.01 1.82 -0.02 0.00 0.47 0.00 0.00 36.82 39.09 2wrh h ILE 577 CO -0.01 0.35 -0.05 -0.08 -3.07 0.00 0.00 178.15 175.29 2wrh h GLU 578 N 0.00 0.53 0.02 2.19 4.81 -0.52 -2.33 114.58 119.28 2wrh h GLU 578 Ca -0.00 -0.13 -0.24 0.00 -0.13 0.00 0.00 59.36 58.86 2wrh h GLU 578 Cb 0.79 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 2wrh h GLU 578 CO 0.05 0.59 -1.17 -0.91 -0.73 0.00 0.00 179.01 176.84 2wrh h ASN 579 N 0.50 0.08 -0.67 1.04 2.35 -0.67 -1.93 115.58 116.28 2wrh h ASN 579 Ca 0.10 -0.09 0.04 0.00 -0.55 0.00 0.00 56.30 55.79 2wrh h ASN 579 Cb 0.41 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 2wrh h ASN 579 CO 0.02 1.08 0.41 0.25 -1.65 0.00 0.00 177.43 177.53 2wrh h LEU 580 N 0.01 0.65 -0.20 1.61 6.46 -1.19 0.20 115.31 122.86 2wrh h LEU 580 Ca -0.08 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.67 2wrh h LEU 580 Cb 1.85 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 41.64 2wrh h LEU 580 CO 0.13 0.45 0.06 -1.13 -0.62 0.00 0.00 178.44 177.33 2wrh h ASN 581 N 0.79 0.29 -0.82 1.25 -1.24 -1.30 -0.97 115.58 113.58 2wrh h ASN 581 Ca 0.28 -0.20 0.05 0.00 0.71 0.00 0.00 56.30 57.13 2wrh h ASN 581 Cb 0.06 -0.08 -0.05 0.00 0.73 0.00 0.00 38.32 38.98 2wrh h ASN 581 CO -0.12 0.41 0.54 0.50 -1.29 0.00 0.00 177.43 177.47 2wrh h LYS 582 N 0.15 0.92 -0.46 6.67 3.64 -1.06 -1.14 116.57 125.29 2wrh h LYS 582 Ca 0.06 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 2wrh h LYS 582 Cb 0.23 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2wrh h LYS 582 CO -0.00 0.61 0.17 -0.22 -2.27 0.00 0.00 179.45 177.73 2wrh h LYS 583 N 0.95 0.69 0.30 1.90 3.64 -0.03 0.87 116.57 124.89 2wrh h LYS 583 Ca 0.34 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2wrh h LYS 583 Cb 0.15 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2wrh h LYS 583 CO -0.11 0.64 -0.15 0.28 -2.27 0.00 0.00 179.45 177.84 2wrh h VAL 584 N 0.60 0.68 -0.59 2.00 2.07 -0.68 0.16 116.25 120.49 2wrh h VAL 584 Ca 0.15 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.68 2wrh h VAL 584 Cb 0.22 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 2wrh h VAL 584 CO -0.01 0.00 0.38 0.44 0.02 0.00 0.00 177.57 178.40 2wrh h ASP 585 N -0.42 0.65 -0.01 0.57 3.32 -1.05 -2.07 116.42 117.41 2wrh h ASP 585 Ca -0.04 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.88 2wrh h ASP 585 Cb 0.33 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2wrh h ASP 585 CO 0.06 0.46 -0.36 0.44 -1.72 0.00 0.00 179.24 178.12 2wrh h ASP 586 N 0.77 0.51 -0.20 6.45 3.32 -0.78 -2.04 116.42 124.45 2wrh h ASP 586 Ca 0.22 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2wrh h ASP 586 Cb -0.05 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 2wrh h ASP 586 CO -0.06 0.83 0.11 1.23 -1.72 0.00 0.00 179.24 179.63 2wrh h GLY 587 N 1.08 0.30 1.63 2.75 0.00 -0.23 -2.04 103.07 106.56 2wrh h GLY 587 Ca 0.04 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.14 2wrh h GLY 587 CO 0.07 0.13 -0.29 0.74 0.00 0.00 0.00 176.54 177.19 2wrh h PHE 588 N 0.22 0.48 -0.71 5.60 0.05 -1.30 -1.73 116.94 119.54 2wrh h PHE 588 Ca 0.07 -0.11 0.05 0.00 3.82 0.00 0.00 57.97 61.81 2wrh h PHE 588 Cb 0.07 -0.12 -0.05 0.00 2.00 0.00 0.00 35.95 37.85 2wrh h PHE 588 CO -0.04 0.68 0.42 1.25 -0.18 0.00 0.00 178.31 180.44 2wrh h LEU 589 N 0.37 0.65 -0.15 1.54 5.85 -1.17 0.12 115.31 122.52 2wrh h LEU 589 Ca 0.05 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.72 2wrh h LEU 589 Cb 0.70 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 2wrh h LEU 589 CO 0.05 0.42 -0.19 0.44 -0.34 0.00 0.00 178.44 178.83 2wrh h ASP 590 N 0.78 0.42 0.38 1.25 3.32 -0.89 -1.21 116.42 120.46 2wrh h ASP 590 Ca 0.31 -0.51 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 2wrh h ASP 590 Cb 0.15 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2wrh h ASP 590 CO -0.17 0.84 -0.18 0.58 -1.72 0.00 0.00 179.24 178.60 2wrh h VAL 591 N 0.00 0.63 -0.50 -1.35 2.07 -1.16 -2.41 116.25 113.54 2wrh h VAL 591 Ca 0.02 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 2wrh h VAL 591 Cb 0.74 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 2wrh h VAL 591 CO 0.04 0.01 0.06 -0.50 0.02 0.00 0.00 177.57 177.21 2wrh h TRP 592 N -0.52 0.90 -0.41 1.57 4.06 -0.82 -1.55 115.95 119.18 2wrh h TRP 592 Ca -0.05 -0.13 0.03 0.00 2.06 0.00 0.00 58.89 60.79 2wrh h TRP 592 Cb 0.40 -0.24 -0.03 0.00 -1.00 0.00 0.00 29.16 28.28 2wrh h TRP 592 CO -0.05 0.82 0.22 1.15 -3.56 0.00 0.00 178.44 177.03 2wrh h THR 593 N 0.71 1.01 0.35 1.49 2.02 -1.23 -0.71 112.91 116.54 2wrh h THR 593 Ca 0.15 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2wrh h THR 593 Cb 0.42 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2wrh h THR 593 CO 0.01 0.08 -0.17 0.22 0.37 0.00 0.00 175.52 176.04 2wrh h TYR 594 N 0.45 -0.43 0.00 3.16 3.20 -1.34 -1.89 116.97 120.12 2wrh h TYR 594 Ca 0.17 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 2wrh h TYR 594 Cb 0.05 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.46 2wrh h TYR 594 CO -0.09 -0.11 -0.06 -0.91 -1.64 0.00 0.00 178.16 175.35 2wrh h ASN 595 N -0.77 0.00 0.00 -2.11 2.35 -1.27 -1.29 115.58 112.49 2wrh h ASN 595 Ca -0.05 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2wrh h ASN 595 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2wrh h ASN 595 CO 0.08 0.06 -0.00 0.00 -1.65 0.00 0.00 177.43 175.91 2wrh h ALA 596 N 1.94 -0.01 -0.37 -0.83 0.00 -1.14 -1.64 119.26 117.23 2wrh h ALA 596 Ca -0.00 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 54.58 2wrh h ALA 596 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 2wrh h ALA 596 CO 0.01 -0.10 0.02 0.93 0.00 0.00 0.00 179.25 180.11 2wrh h GLU 597 N -0.82 0.12 0.00 0.00 4.39 -1.08 -1.92 114.58 115.27 2wrh h GLU 597 Ca -0.00 -0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.55 2wrh h GLU 597 Cb 0.80 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.40 2wrh h GLU 597 CO 0.00 0.08 -0.66 -0.07 -1.16 0.00 0.00 179.01 177.20 2wrh h LEU 598 N 0.12 0.00 -0.44 1.33 3.38 -1.35 -2.53 115.31 115.82 2wrh h LEU 598 Ca 0.18 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 2wrh h LEU 598 Cb 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2wrh h LEU 598 CO -0.28 0.66 0.09 0.25 0.09 0.00 0.00 178.44 179.25 2wrh h LEU 599 N 0.00 0.69 -0.12 1.67 5.85 -1.00 -0.28 115.31 122.13 2wrh h LEU 599 Ca -0.01 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 2wrh h LEU 599 Cb 1.21 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 2wrh h LEU 599 CO 0.09 0.76 0.02 0.58 -0.34 0.00 0.00 178.44 179.54 2wrh h VAL 600 N 0.59 1.22 -0.26 1.05 2.07 -1.33 -0.90 116.25 118.70 2wrh h VAL 600 Ca 0.14 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 67.00 2wrh h VAL 600 Cb 0.35 1.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 2wrh h VAL 600 CO 0.00 0.21 -0.08 -0.07 0.02 0.00 0.00 177.57 177.65 2wrh h LEU 601 N -0.04 -0.29 0.22 2.57 3.38 -1.36 0.05 115.31 119.83 2wrh h LEU 601 Ca 0.04 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2wrh h LEU 601 Cb 0.31 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2wrh h LEU 601 CO 0.00 -0.11 -0.10 -0.07 0.09 0.00 0.00 178.44 178.25 2wrh h LEU 602 N -0.03 -0.24 -1.87 1.67 4.07 -1.02 -2.43 115.31 115.47 2wrh h LEU 602 Ca 0.13 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.90 2wrh h LEU 602 Cb 0.22 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.02 2wrh h LEU 602 CO -0.28 0.07 0.08 -0.33 -1.08 0.00 0.00 178.44 176.89 2wrh h GLU 603 N -0.57 0.17 -0.35 1.13 4.39 -1.08 -1.81 114.58 116.45 2wrh h GLU 603 Ca -0.03 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.61 2wrh h GLU 603 Cb 0.42 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2wrh h GLU 603 CO 0.05 0.11 0.01 -0.91 -1.16 0.00 0.00 179.01 177.11 2wrh h ASN 604 N 0.17 0.60 -0.10 1.42 2.35 -0.85 0.08 115.58 119.25 2wrh h ASN 604 Ca 0.05 -0.30 0.03 0.00 -0.55 0.00 0.00 56.30 55.52 2wrh h ASN 604 Cb -0.01 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 2wrh h ASN 604 CO -0.01 0.75 -0.07 -0.08 -1.65 0.00 0.00 177.43 176.37 2wrh h GLU 605 N 0.43 -0.07 -0.98 0.81 4.57 -0.90 -2.30 114.58 116.14 2wrh h GLU 605 Ca 0.10 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.31 2wrh h GLU 605 Cb 0.44 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.99 2wrh h GLU 605 CO 0.02 -0.05 0.64 0.00 -1.18 0.00 0.00 179.01 178.44 2wrh h ARG 606 N -0.07 1.23 -0.00 1.92 2.47 -1.16 -1.62 114.38 117.16 2wrh h ARG 606 Ca 0.06 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2wrh h ARG 606 Cb 0.16 -0.28 -0.00 0.00 -1.65 0.00 0.00 29.97 28.21 2wrh h ARG 606 CO -0.15 0.81 0.00 1.15 0.56 0.00 0.00 179.97 182.35 2wrh h THR 607 N 1.27 1.22 -0.83 2.04 2.02 -0.76 -0.35 112.91 117.52 2wrh h THR 607 Ca 0.38 -0.64 0.03 0.00 0.77 0.00 0.00 66.41 66.95 2wrh h THR 607 Cb -0.06 1.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.95 2wrh h THR 607 CO -0.11 0.17 0.53 -0.07 0.37 0.00 0.00 175.52 176.41 2wrh h LEU 608 N -0.27 0.87 -1.01 2.58 3.38 -1.29 -1.75 115.31 117.83 2wrh h LEU 608 Ca 0.00 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2wrh h LEU 608 Cb 0.27 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2wrh h LEU 608 CO 0.00 0.60 -0.17 0.44 0.09 0.00 0.00 178.44 179.40 2wrh h ASP 609 N 1.03 0.51 -0.48 -0.43 3.32 -1.16 -1.48 116.42 117.71 2wrh h ASP 609 Ca 0.33 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.25 2wrh h ASP 609 Cb 0.01 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 2wrh h ASP 609 CO -0.12 0.70 0.31 0.15 -1.72 0.00 0.00 179.24 178.56 2wrh h PHE 610 N 0.47 0.58 -0.63 4.55 3.57 -0.38 0.41 116.94 125.50 2wrh h PHE 610 Ca 0.08 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.51 2wrh h PHE 610 Cb 0.57 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2wrh h PHE 610 CO 0.02 0.35 0.07 0.45 -2.23 0.00 0.00 178.31 176.97 2wrh h HIS 611 N 0.62 1.14 -0.11 0.41 3.86 -1.02 -1.90 115.15 118.15 2wrh h HIS 611 Ca 0.18 -0.17 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2wrh h HIS 611 Cb -0.04 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.12 2wrh h HIS 611 CO -0.05 0.98 0.07 0.22 0.86 0.00 0.00 177.93 180.00 2wrh h ASP 612 N 0.99 0.13 -0.58 2.45 -0.00 -0.80 -2.36 116.42 116.25 2wrh h ASP 612 Ca 0.19 -0.03 0.10 0.00 -0.00 0.00 0.00 57.03 57.29 2wrh h ASP 612 Cb 0.48 -0.03 -0.08 0.00 -0.00 0.00 0.00 39.33 39.69 2wrh h ASP 612 CO 0.02 0.12 0.14 -1.28 -0.00 0.00 0.00 179.24 178.24 2wrh h SER 613 N 0.12 0.04 -0.80 2.28 0.87 -0.73 -1.97 113.55 113.37 2wrh h SER 613 Ca 0.04 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2wrh h SER 613 Cb 0.01 0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.07 2wrh h SER 613 CO -0.01 0.03 0.47 0.78 -0.53 0.00 0.00 176.83 177.57 2wrh h ASN 614 N 0.28 0.99 -0.20 6.23 2.35 -0.97 0.11 115.58 124.36 2wrh h ASN 614 Ca 0.30 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.96 2wrh h ASN 614 Cb 0.43 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 2wrh h ASN 614 CO -0.37 0.77 0.03 0.58 -1.65 0.00 0.00 177.43 176.79 2wrh h VAL 615 N 1.12 1.23 -0.49 2.81 2.07 -0.97 -1.34 116.25 120.67 2wrh h VAL 615 Ca 0.29 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2wrh h VAL 615 Cb -0.01 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 2wrh h VAL 615 CO -0.05 0.23 0.29 -0.09 0.02 0.00 0.00 177.57 177.97 2wrh h ARG 616 N 0.13 0.67 -0.84 1.57 2.43 -0.99 0.04 114.38 117.40 2wrh h ARG 616 Ca 0.06 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2wrh h ARG 616 Cb 0.33 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 2wrh h ARG 616 CO 0.00 0.51 0.49 -0.91 -1.51 0.00 0.00 179.97 178.55 2wrh h ASN 617 N 0.65 1.02 -0.27 -3.80 2.35 -0.75 -0.37 115.58 114.41 2wrh h ASN 617 Ca 0.18 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 2wrh h ASN 617 Cb 0.02 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 2wrh h ASN 617 CO -0.03 0.80 0.04 0.25 -1.65 0.00 0.00 177.43 176.84 2wrh h LEU 618 N 1.16 0.44 -1.16 1.61 5.85 -0.89 -1.19 115.31 121.13 2wrh h LEU 618 Ca 0.30 -0.27 0.08 0.00 0.84 0.00 0.00 57.88 58.83 2wrh h LEU 618 Cb -0.01 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 2wrh h LEU 618 CO -0.05 0.60 0.58 0.22 -0.34 0.00 0.00 178.44 179.45 2wrh h TYR 619 N 0.27 1.01 -0.01 1.25 3.20 -0.64 -2.41 116.97 119.65 2wrh h TYR 619 Ca 0.08 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.79 2wrh h TYR 619 Cb 0.35 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 2wrh h TYR 619 CO 0.02 0.50 -0.83 0.93 -1.64 0.00 0.00 178.16 177.14 2wrh h GLU 620 N 0.97 0.22 -0.87 1.82 5.08 -0.75 -1.69 114.58 119.36 2wrh h GLU 620 Ca 0.40 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2wrh h GLU 620 Cb 0.29 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 2wrh h GLU 620 CO -0.16 0.93 0.58 -0.22 -1.00 0.00 0.00 179.01 179.14 2wrh h LYS 621 N 0.13 1.15 0.38 2.33 3.64 -0.75 0.31 116.57 123.77 2wrh h LYS 621 Ca -0.04 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 2wrh h LYS 621 Cb 1.44 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2wrh h LYS 621 CO 0.13 0.76 -0.18 0.28 -2.27 0.00 0.00 179.45 178.17 2wrh h VAL 622 N 1.18 0.35 -0.85 2.00 2.07 -1.39 -2.96 116.25 116.65 2wrh h VAL 622 Ca 0.32 -0.67 0.21 0.00 0.82 0.00 0.00 66.70 67.38 2wrh h VAL 622 Cb -0.14 0.55 -0.14 0.00 -1.52 0.00 0.00 31.29 30.03 2wrh h VAL 622 CO -0.07 0.08 0.10 0.50 0.02 0.00 0.00 177.57 178.19 2wrh h LYS 623 N -1.02 0.12 -0.78 1.57 3.64 -1.13 0.28 116.57 119.26 2wrh h LYS 623 Ca -0.05 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 2wrh h LYS 623 Cb 0.52 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 2wrh h LYS 623 CO 0.09 0.08 0.37 1.03 -2.27 0.00 0.00 179.45 178.74 2wrh h SER 624 N 0.13 1.01 0.03 4.20 0.87 -1.00 -1.35 113.55 117.44 2wrh h SER 624 Ca 0.50 -0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 60.94 2wrh h SER 624 Cb 0.96 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 2wrh h SER 624 CO -0.71 0.86 -0.02 1.56 -0.53 0.00 0.00 176.83 177.99 2wrh h GLN 625 N 1.11 -0.04 -0.28 2.24 4.20 -0.81 -3.32 115.11 118.21 2wrh h GLN 625 Ca 0.27 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.89 2wrh h GLN 625 Cb 0.12 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2wrh h GLN 625 CO -0.03 0.44 -0.21 -0.07 -0.67 0.00 0.00 178.83 178.29 2wrh h LEU 626 N -0.54 0.51 0.00 1.46 3.38 -1.17 -3.45 115.31 115.49 2wrh h LEU 626 Ca -0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2wrh h LEU 626 Cb 0.50 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2wrh h LEU 626 CO 0.01 0.72 0.00 0.54 0.09 0.00 0.00 178.44 179.80 2wrh n ARG 627 N -4.14 0.00 -0.28 1.13 1.74 -0.52 -1.13 116.66 113.46 2wrh n ARG 627 Ca -0.00 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.10 2wrh n ARG 627 Cb 0.38 0.00 0.12 0.00 -1.02 0.00 0.00 32.46 31.94 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 0.82 2.48 -0.07 0.55 6.94 -1.26 -3.71 115.26 121.02 2wrh n ASN 628 Ca 0.00 -2.29 0.13 0.00 -0.02 0.00 0.00 54.58 52.40 2wrh n ASN 628 Cb 0.00 -0.56 0.47 0.00 -2.36 0.00 0.00 39.78 37.33 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 0.19 0.44 -3.91 0.53 5.03 -0.29 -4.89 115.26 112.37 2wrh n ASN 629 Ca 0.09 -0.27 -0.09 0.00 0.87 0.00 0.00 54.58 55.18 2wrh n ASN 629 Cb 0.55 -0.04 -0.08 0.00 -1.02 0.00 0.00 39.78 39.20 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 -2.76 -0.08 -0.13 5.41 0.00 -1.24 -1.02 121.76 121.94 2wrh s ALA 630 Ca 0.19 -0.75 -0.02 0.00 0.00 0.00 0.00 51.96 51.39 2wrh s ALA 630 Cb 0.19 0.52 -0.03 0.00 0.00 0.00 0.00 23.12 23.80 2wrh s ALA 630 CO 0.56 -0.51 -0.06 -1.59 0.00 0.00 0.00 175.76 174.16 2wrh s LYS 631 N -3.89 3.39 -0.45 0.00 -2.85 0.28 -4.86 119.74 111.36 2wrh s LYS 631 Ca 0.07 -0.55 -0.27 0.00 -1.00 0.00 0.00 55.97 54.22 2wrh s LYS 631 Cb 0.05 -2.78 -0.04 0.00 -2.06 0.00 0.00 37.83 33.00 2wrh s LYS 631 CO -0.09 0.34 2.06 -1.21 0.10 0.00 0.00 175.35 176.55 2wrh s GLU 632 N 0.06 2.71 0.00 1.78 2.02 -1.26 -1.08 118.70 122.93 2wrh s GLU 632 Ca -0.01 1.23 0.15 0.00 0.02 0.00 0.00 54.97 56.36 2wrh s GLU 632 Cb -0.14 -4.40 0.44 0.00 0.10 0.00 0.00 34.13 30.13 2wrh s GLU 632 CO 0.03 -2.60 1.36 0.44 0.02 0.00 0.00 175.26 174.51 2wrh n ILE 633 N 7.57 0.63 0.00 -1.63 -0.00 -0.44 -5.00 119.36 120.48 2wrh n ILE 633 Ca 0.27 -0.64 0.00 0.00 -0.00 0.00 0.00 62.75 62.38 2wrh n ILE 633 Cb 0.51 0.34 0.00 0.00 -0.00 0.00 0.00 39.64 40.48 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 1.27 -2.35 2.40 3.28 0.00 -1.24 -4.88 105.19 103.66 2wrh n GLY 634 Ca 0.16 -1.47 -0.15 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.17 -4.78 0.00 1.61 2.85 -1.18 -2.64 115.26 108.95 2wrh n ASN 635 Ca 0.00 0.26 0.00 0.00 -0.11 0.00 0.00 54.58 54.73 2wrh n ASN 635 Cb 0.00 -3.71 0.00 0.00 1.24 0.00 0.00 39.78 37.31 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 -1.07 0.63 3.61 8.20 0.00 -1.26 -4.68 105.19 110.62 2wrh n GLY 636 Ca -0.16 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.91 2.64 -0.27 0.00 0.40 -1.26 -1.33 117.98 117.24 2wrh s PHE 638 Ca 0.15 -0.67 -0.06 0.00 -0.60 0.00 0.00 56.93 55.74 2wrh s PHE 638 Cb -0.11 -1.71 -0.00 0.00 0.51 0.00 0.00 43.02 41.71 2wrh s PHE 638 CO 0.05 -0.19 0.06 -2.00 0.70 0.00 0.00 175.22 173.83 2wrh s GLU 639 N 0.03 3.25 0.37 0.44 2.12 -0.24 -4.89 118.70 119.78 2wrh s GLU 639 Ca -0.07 -0.75 -0.27 0.00 0.36 0.00 0.00 54.97 54.24 2wrh s GLU 639 Cb -0.15 -3.30 -0.10 0.00 0.26 0.00 0.00 34.13 30.85 2wrh s GLU 639 CO 0.05 -0.35 1.32 -0.06 -0.54 0.00 0.00 175.26 175.68 2wrh s PHE 640 N 1.52 2.88 0.05 5.30 0.40 -1.26 -0.56 117.98 126.31 2wrh s PHE 640 Ca 0.04 1.39 0.09 0.00 -0.60 0.00 0.00 56.93 57.85 2wrh s PHE 640 Cb -0.16 -3.71 -0.17 0.00 0.51 0.00 0.00 43.02 39.48 2wrh s PHE 640 CO 0.02 -2.09 1.19 1.88 0.70 0.00 0.00 175.22 176.92 2wrh h TYR 641 N 2.97 0.00 -2.74 0.36 -1.99 -1.43 -3.47 116.97 110.67 2wrh h TYR 641 Ca -0.49 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.24 2wrh h TYR 641 Cb 1.24 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.97 2wrh h TYR 641 CO 0.54 0.92 0.00 -2.39 -0.00 0.00 0.00 178.16 177.23 2wrh n HIS 642 N -3.27 -0.75 -4.01 4.88 1.44 -1.26 -5.09 115.22 107.16 2wrh n HIS 642 Ca -0.03 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.33 2wrh n HIS 642 Cb 0.93 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.91 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 1.22 3.55 -0.50 -1.40 2.47 -1.26 -5.08 119.74 118.75 2wrh s LYS 643 Ca 0.00 -0.55 -0.03 0.00 -1.56 0.00 0.00 55.97 53.83 2wrh s LYS 643 Cb 0.00 -3.08 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 1.40 2.61 0.20 0.00 3.84 -1.26 -4.69 116.67 118.77 2wrh s ASP 645 Ca 0.12 0.63 -0.11 0.00 -0.00 0.00 0.00 52.55 53.19 2wrh s ASP 645 Cb -0.22 -0.92 0.25 0.00 -1.38 0.00 0.00 42.92 40.65 2wrh s ASP 645 CO -0.04 -3.08 1.72 0.44 -0.00 0.00 0.00 175.17 174.21 2wrh h ASP 646 N -1.87 0.08 -0.61 2.11 3.32 -1.99 -1.16 116.42 116.30 2wrh h ASP 646 Ca -0.47 0.09 0.01 0.00 0.02 0.00 0.00 57.03 56.69 2wrh h ASP 646 Cb 1.29 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.92 2wrh h ASP 646 CO 0.46 0.06 0.40 -0.33 -1.72 0.00 0.00 179.24 178.11 2wrh h GLU 647 N 0.30 0.77 -0.13 3.56 5.08 -1.99 -1.24 114.58 120.94 2wrh h GLU 647 Ca 0.29 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.50 2wrh h GLU 647 Cb 0.39 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2wrh h GLU 647 CO -0.34 0.51 -0.31 0.00 -1.00 0.00 0.00 179.01 177.87 2wrh h MET 649 N 0.02 0.15 -0.45 0.00 2.86 -1.11 -0.52 114.93 115.88 2wrh h MET 649 Ca -0.00 -0.01 0.12 0.00 -2.06 0.00 0.00 59.70 57.75 2wrh h MET 649 Cb 0.91 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.52 2wrh h MET 649 CO 0.07 0.10 0.32 1.49 1.06 0.00 0.00 176.91 179.94 2wrh h GLU 650 N 0.15 0.05 -0.11 1.72 4.57 -1.11 0.08 114.58 119.92 2wrh h GLU 650 Ca 0.21 -0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 58.16 2wrh h GLU 650 Cb 0.29 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 28.88 2wrh h GLU 650 CO -0.32 0.03 -0.84 0.66 -1.18 0.00 0.00 179.01 177.36 2wrh h SER 651 N 0.05 0.91 -0.68 1.04 4.64 -0.51 0.12 113.55 119.12 2wrh h SER 651 Ca 0.21 -0.63 -0.05 0.00 -0.47 0.00 0.00 61.79 60.86 2wrh h SER 651 Cb 0.79 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 2wrh h SER 651 CO -0.01 1.43 0.25 0.58 -0.87 0.00 0.00 176.83 178.21 2wrh h VAL 652 N 0.49 1.25 -0.40 0.95 2.07 -0.42 0.40 116.25 120.60 2wrh h VAL 652 Ca -0.07 -0.81 -0.10 0.00 0.82 0.00 0.00 66.70 66.54 2wrh h VAL 652 Cb 1.48 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2wrh h VAL 652 CO 0.17 0.32 -0.14 0.11 0.02 0.00 0.00 177.57 178.05 2wrh h LYS 653 N 0.98 0.80 -0.11 1.57 1.57 -1.19 -2.72 116.57 117.47 2wrh h LYS 653 Ca 0.23 -0.33 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2wrh h LYS 653 Cb 0.25 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 2wrh h LYS 653 CO -0.01 0.95 0.09 -0.91 -0.57 0.00 0.00 179.45 178.99 2wrh h ASN 654 N 0.60 0.00 -0.06 0.86 4.21 -0.68 -3.46 115.58 117.05 2wrh h ASN 654 Ca 0.09 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.60 2wrh h ASN 654 Cb 0.68 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.88 2wrh h ASN 654 CO 0.05 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.80 2wrh n GLY 655 N -1.51 0.68 0.07 2.83 0.00 -0.15 -4.98 105.19 102.14 2wrh n GLY 655 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.31 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 -3.36 0.47 -0.40 2.61 -1.04 0.12 -4.92 114.28 107.76 2wrh n THR 656 Ca 0.00 -0.74 -0.05 0.00 -2.04 0.00 0.00 64.05 61.22 2wrh n THR 656 Cb 0.41 0.78 -0.02 0.00 -1.82 0.00 0.00 70.33 69.68 2wrh n THR 656 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2wrh h TYR 657 N 0.29 -1.44 -5.44 -1.42 3.20 -1.85 -3.47 116.97 106.83 2wrh h TYR 657 Ca 0.00 0.12 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 2wrh h TYR 657 Cb 0.28 0.77 0.00 0.00 1.54 0.00 0.00 36.73 39.32 2wrh h TYR 657 CO 0.01 -0.39 -0.77 -0.25 -1.64 0.00 0.00 178.16 175.13 2wrh n ASP 658 N -5.38 -7.65 -3.65 -2.11 8.00 -1.26 -4.93 116.55 99.58 2wrh n ASP 658 Ca 0.07 0.74 0.00 0.00 0.71 0.00 0.00 54.79 56.31 2wrh n ASP 658 Cb 0.34 -4.75 -0.06 0.00 -0.02 0.00 0.00 41.12 36.63 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 -2.08 -0.26 -0.77 1.24 6.04 -1.26 -5.20 117.35 115.05 2wrh s TYR 659 Ca 0.17 0.53 0.00 0.00 0.04 0.00 0.00 57.07 57.81 2wrh s TYR 659 Cb -0.04 0.17 0.00 0.00 -1.04 0.00 0.00 41.96 41.05 2wrh s TYR 659 CO 0.74 -0.13 0.19 -2.30 -1.54 0.00 0.00 175.55 172.51