#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wpx h ASN 502 N 0.00 0.59 0.59 7.83 -1.24 -2.07 -2.81 115.58 118.47 1wpx h ASN 502 Ca 0.00 -0.12 0.00 0.00 0.71 0.00 0.00 56.30 56.89 1wpx h ASN 502 Cb 0.00 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 38.90 1wpx h ASN 502 CO 0.00 0.65 -0.02 0.00 -1.29 0.00 0.00 177.43 176.77 1wpx n GLN 503 N -4.26 0.41 -0.28 6.67 1.13 -1.26 -3.74 117.38 116.05 1wpx n GLN 503 Ca 0.02 -0.03 0.07 0.00 -1.94 0.00 0.00 57.00 55.12 1wpx n GLN 503 Cb 0.26 -1.50 0.21 0.00 0.11 0.00 0.00 30.24 29.32 1wpx n GLN 503 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1wpx n ALA 504 N -1.27 2.57 -0.07 -1.58 0.00 -1.06 -4.41 120.51 114.68 1wpx n ALA 504 Ca 0.13 -0.86 -0.09 0.00 0.00 0.00 0.00 53.44 52.62 1wpx n ALA 504 Cb 0.26 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 1wpx n ALA 504 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1wpx h ILE 505 N 2.65 0.72 -3.03 0.00 1.08 -1.74 -3.44 117.51 113.75 1wpx h ILE 505 Ca 0.00 -1.63 -0.72 0.00 -0.39 0.00 0.00 64.86 62.11 1wpx h ILE 505 Cb 0.73 1.46 -0.21 0.00 -3.07 0.00 0.00 36.82 35.73 1wpx h ILE 505 CO 0.05 0.25 0.14 -0.62 -0.69 0.00 0.00 178.15 177.27 1wpx s ASP 506 N -6.03 6.33 0.55 1.72 -1.08 -1.26 -4.91 116.67 111.99 1wpx s ASP 506 Ca -0.14 -1.77 0.37 0.00 -0.52 0.00 0.00 52.55 50.49 1wpx s ASP 506 Cb 0.01 -2.28 1.87 0.00 -1.46 0.00 0.00 42.92 41.06 1wpx s ASP 506 CO 0.36 -0.98 2.12 -0.26 0.52 0.00 0.00 175.17 176.93 1wpx h PHE 507 N 8.87 0.00 0.12 -5.34 -1.00 -1.89 -1.47 116.94 116.22 1wpx h PHE 507 Ca -0.18 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.60 1wpx h PHE 507 Cb 1.07 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.64 1wpx h PHE 507 CO 0.89 0.00 -0.06 0.00 -1.61 0.00 0.00 178.31 177.53 1wpx h ALA 508 N 2.02 -0.16 -0.93 2.45 0.00 -1.94 -2.26 119.26 118.44 1wpx h ALA 508 Ca 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1wpx h ALA 508 Cb 0.14 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1wpx h ALA 508 CO 0.00 -0.23 0.57 0.37 0.00 0.00 0.00 179.25 179.96 1wpx h GLN 509 N -0.88 1.25 -0.98 0.00 5.75 -1.90 -1.34 115.11 117.01 1wpx h GLN 509 Ca -0.02 -0.10 0.04 0.00 -0.15 0.00 0.00 58.65 58.42 1wpx h GLN 509 Cb 0.54 -0.27 -0.06 0.00 1.07 0.00 0.00 27.48 28.77 1wpx h GLN 509 CO 0.03 0.86 0.64 0.00 -2.65 0.00 0.00 178.83 177.71 1wpx h ALA 510 N 1.36 1.31 -0.19 3.38 0.00 -1.33 -0.61 119.26 123.18 1wpx h ALA 510 Ca 0.33 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1wpx h ALA 510 Cb -0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1wpx h ALA 510 CO -0.06 0.52 0.00 0.77 0.00 0.00 0.00 179.25 180.47 1wpx h SER 511 N 1.23 0.32 -0.22 0.00 0.02 -0.65 -2.57 113.55 111.68 1wpx h SER 511 Ca 0.39 -0.31 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1wpx h SER 511 Cb 0.02 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1wpx h SER 511 CO -0.13 0.55 0.07 0.40 -1.14 0.00 0.00 176.83 176.58 1wpx h ILE 512 N 0.09 0.94 -0.75 3.27 1.08 -0.85 -1.40 117.51 119.89 1wpx h ILE 512 Ca 0.05 -0.06 0.10 0.00 -0.39 0.00 0.00 64.86 64.56 1wpx h ILE 512 Cb 0.38 0.75 -0.07 0.00 -3.07 0.00 0.00 36.82 34.82 1wpx h ILE 512 CO 0.01 0.03 0.38 0.44 -0.69 0.00 0.00 178.15 178.32 1wpx h ASP 513 N 0.17 0.51 -0.03 1.72 3.32 -1.08 -0.48 116.42 120.55 1wpx h ASP 513 Ca 0.10 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1wpx h ASP 513 Cb 0.07 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 1wpx h ASP 513 CO -0.11 0.28 0.01 -1.28 -1.72 0.00 0.00 179.24 176.43 1wpx h SER 514 N 0.64 0.04 -0.94 6.45 0.87 -1.02 -1.46 113.55 118.13 1wpx h SER 514 Ca 0.37 -0.20 0.10 0.00 -1.23 0.00 0.00 61.79 60.83 1wpx h SER 514 Cb 0.39 -0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.27 1wpx h SER 514 CO -0.27 0.23 0.60 1.88 -0.53 0.00 0.00 176.83 178.74 1wpx h TYR 515 N -0.15 1.04 0.50 2.24 0.99 -0.65 -1.98 116.97 118.95 1wpx h TYR 515 Ca 0.01 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 1wpx h TYR 515 Cb 0.21 -0.33 0.00 0.00 1.00 0.00 0.00 36.73 37.61 1wpx h TYR 515 CO -0.01 0.46 -0.24 0.87 -0.00 0.00 0.00 178.16 179.24 1wpx h LYS 516 N 0.95 -0.65 -0.78 4.88 1.57 -0.95 0.22 116.57 121.80 1wpx h LYS 516 Ca 0.44 0.04 0.20 0.00 -1.87 0.00 0.00 60.65 59.47 1wpx h LYS 516 Cb 0.42 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 1wpx h LYS 516 CO -0.20 -0.36 0.54 -0.22 -0.57 0.00 0.00 179.45 178.64 1wpx h LYS 517 N -1.08 0.17 -0.46 3.15 3.64 -1.06 -0.83 116.57 120.09 1wpx h LYS 517 Ca -0.07 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.25 1wpx h LYS 517 Cb 0.58 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 1wpx h LYS 517 CO 0.11 0.11 0.04 0.72 -2.27 0.00 0.00 179.45 178.17 1wpx n HIS 518 N -4.39 1.63 -2.19 1.91 8.25 -0.76 -4.97 115.22 114.70 1wpx n HIS 518 Ca 0.16 -0.93 -0.13 0.00 -0.26 0.00 0.00 57.72 56.57 1wpx n HIS 518 Cb 0.74 -0.46 -0.02 0.00 1.12 0.00 0.00 29.99 31.36 1wpx n HIS 518 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wpx n GLY 519 N -0.09 -0.10 0.14 -1.41 0.00 -0.32 -4.85 105.19 98.56 1wpx n GLY 519 Ca 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.30 1wpx n GLY 519 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wpx h ILE 520 N 0.00 1.33 0.00 -0.61 1.08 -0.82 -0.92 117.51 117.56 1wpx h ILE 520 Ca -0.29 -2.10 -0.09 0.00 -0.39 0.00 0.00 64.86 61.99 1wpx h ILE 520 Cb 1.13 2.16 -0.01 0.00 -3.07 0.00 0.00 36.82 37.03 1wpx h ILE 520 CO 0.36 0.58 -0.43 -0.07 -0.69 0.00 0.00 178.15 177.90 1wpx h LEU 521 N 0.00 0.00 0.00 1.44 3.38 -1.88 -1.26 115.31 116.99 1wpx h LEU 521 Ca -0.01 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 1wpx h LEU 521 Cb 1.11 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1wpx h LEU 521 CO 0.08 0.43 -2.22 -1.84 0.09 0.00 0.00 178.44 174.97 1wpx n GLU 522 N -3.42 0.53 0.08 1.13 0.00 -1.19 -0.60 120.64 117.18 1wpx n GLU 522 Ca 0.00 0.13 -0.11 0.00 0.00 0.00 0.00 57.16 57.19 1wpx n GLU 522 Cb 0.59 -1.42 -0.04 0.00 0.00 0.00 0.00 31.44 30.57 1wpx n GLU 522 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1wpx h ASP 523 N -0.08 0.33 0.00 -1.84 3.45 -1.32 -3.37 116.42 113.60 1wpx h ASP 523 Ca -0.49 -0.29 -0.01 0.00 0.43 0.00 0.00 57.03 56.68 1wpx h ASP 523 Cb 1.72 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 40.38 1wpx h ASP 523 CO -0.10 1.11 -0.35 0.52 -1.57 0.00 0.00 179.24 178.85 1wpx n VAL 524 N -3.65 1.29 0.18 -1.35 0.31 -1.11 -4.81 118.33 109.19 1wpx n VAL 524 Ca -0.05 0.31 0.04 0.00 -0.01 0.00 0.00 64.34 64.63 1wpx n VAL 524 Cb 0.85 -1.82 0.29 0.00 -0.91 0.00 0.00 33.84 32.26 1wpx n VAL 524 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1wpx h ILE 525 N -0.31 1.02 -3.60 2.52 2.04 -1.38 -3.35 117.51 114.45 1wpx h ILE 525 Ca -0.01 -1.67 -0.37 0.00 1.00 0.00 0.00 64.86 63.82 1wpx h ILE 525 Cb 0.34 1.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1wpx h ILE 525 CO -0.00 0.43 -0.50 1.41 0.00 0.00 0.00 178.15 179.48 1wpx n HIS 526 N -3.60 -1.32 -3.37 1.37 8.25 0.24 -4.90 115.22 111.88 1wpx n HIS 526 Ca -0.00 0.12 -0.12 0.00 -0.26 0.00 0.00 57.72 57.45 1wpx n HIS 526 Cb 0.53 -3.71 -0.08 0.00 1.12 0.00 0.00 29.99 27.85 1wpx n HIS 526 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1wpx s ASP 527 N -2.19 0.76 0.00 0.41 3.68 -0.41 -4.99 116.67 113.93 1wpx s ASP 527 Ca 0.07 -0.22 0.30 0.00 2.13 0.00 0.00 52.55 54.83 1wpx s ASP 527 Cb -0.03 0.88 1.77 0.00 -1.45 0.00 0.00 42.92 44.09 1wpx s ASP 527 CO 0.09 -0.34 2.12 0.35 0.13 0.00 0.00 175.17 177.52 1wpx n THR 528 N 5.34 0.00 0.80 1.71 -2.24 -1.26 -2.78 114.28 115.85 1wpx n THR 528 Ca -0.02 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.85 1wpx n THR 528 Cb 0.49 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1wpx n THR 528 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1wpx n SER 529 N -1.02 1.81 -4.57 3.42 3.41 -1.26 -5.01 113.62 110.40 1wpx n SER 529 Ca 0.22 -1.40 -0.51 0.00 -0.26 0.00 0.00 58.87 56.92 1wpx n SER 529 Cb 0.11 0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 64.45 1wpx n SER 529 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1wpx n PHE 530 N -0.01 1.23 -4.16 7.33 -0.00 -1.12 -4.98 117.46 115.75 1wpx n PHE 530 Ca 0.08 0.72 -0.30 0.00 -0.00 0.00 0.00 57.45 57.94 1wpx n PHE 530 Cb 0.38 -2.26 -0.16 0.00 -0.00 0.00 0.00 39.48 37.44 1wpx n PHE 530 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 1wpx s GLN 531 N -0.05 2.34 0.36 -4.13 -1.52 -1.26 -5.00 119.66 110.41 1wpx s GLN 531 Ca 0.79 -0.58 -0.27 0.00 -1.95 0.00 0.00 55.36 53.34 1wpx s GLN 531 Cb -0.94 -2.09 -0.09 0.00 -0.22 0.00 0.00 33.01 29.67 1wpx s GLN 531 CO 0.51 -0.18 1.20 -2.14 -0.25 0.00 0.00 175.29 174.42 1wpx s PRO 532 N 1.32 4.24 0.04 2.91 0.02 -1.26 -4.93 135.00 137.34 1wpx s PRO 532 Ca 0.02 1.94 0.22 0.00 0.02 0.00 0.00 61.00 63.20 1wpx s PRO 532 Cb -0.13 -2.88 -0.11 0.00 0.02 0.00 0.00 34.50 31.40 1wpx s PRO 532 CO -0.08 -0.19 0.85 0.43 -0.33 0.00 0.00 177.00 177.68 1wpx n SER 533 N 0.47 0.51 -0.59 2.53 7.64 -0.84 -4.62 113.62 118.73 1wpx n SER 533 Ca 0.02 -0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.72 1wpx n SER 533 Cb 0.45 1.13 0.00 0.00 -1.01 0.00 0.00 64.21 64.78 1wpx n SER 533 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wpx n GLY 534 N 1.33 2.20 3.11 0.23 0.00 -1.25 -3.58 105.19 107.23 1wpx n GLY 534 Ca 0.00 -0.89 -0.22 0.00 0.00 0.00 0.00 46.02 44.92 1wpx n GLY 534 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wpx s ILE 535 N -2.89 1.09 -0.41 -0.61 -5.25 -0.52 -4.78 121.20 107.83 1wpx s ILE 535 Ca 0.00 -0.67 -0.14 0.00 -0.99 0.00 0.00 60.65 58.85 1wpx s ILE 535 Cb 0.00 -0.92 0.02 0.00 2.95 0.00 0.00 42.46 44.51 1wpx s ILE 535 CO 0.00 0.24 0.29 -0.22 -1.79 0.00 0.00 174.94 173.47 1wpx s LEU 536 N -0.49 5.08 -0.14 0.37 2.96 -1.26 -1.86 118.68 123.34 1wpx s LEU 536 Ca 0.05 -0.93 -0.20 0.00 -0.22 0.00 0.00 54.13 52.82 1wpx s LEU 536 Cb -0.06 -2.14 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 1wpx s LEU 536 CO -0.00 -0.45 0.58 0.00 -1.32 0.00 0.00 176.35 175.16 1wpx s ALA 537 N 1.66 3.48 0.00 5.97 0.00 -0.18 -4.64 121.76 128.05 1wpx s ALA 537 Ca 0.05 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1wpx s ALA 537 Cb -0.19 -2.84 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 1wpx s ALA 537 CO 0.09 -0.26 -0.14 0.08 0.00 0.00 0.00 175.76 175.54 1wpx s VAL 538 N 1.20 1.08 -0.14 0.00 1.01 -1.26 -1.11 120.40 121.18 1wpx s VAL 538 Ca 0.29 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.43 1wpx s VAL 538 Cb -0.16 -0.92 0.04 0.00 0.00 0.00 0.00 36.38 35.34 1wpx s VAL 538 CO 0.12 0.23 0.42 -0.70 0.00 0.00 0.00 175.10 175.17 1wpx s GLU 539 N -0.53 0.53 -0.17 2.72 2.12 -0.80 -1.37 118.70 121.19 1wpx s GLU 539 Ca 0.04 0.51 -0.00 0.00 0.36 0.00 0.00 54.97 55.89 1wpx s GLU 539 Cb -0.06 0.26 -0.22 0.00 0.26 0.00 0.00 34.13 34.36 1wpx s GLU 539 CO -0.00 -0.08 0.14 0.66 -0.54 0.00 0.00 175.26 175.44 1wpx n TYR 540 N 2.65 0.67 -3.52 5.30 4.01 0.66 -0.58 117.16 126.36 1wpx n TYR 540 Ca -0.14 0.15 -0.09 0.00 -0.16 0.00 0.00 57.90 57.66 1wpx n TYR 540 Cb 0.57 -1.09 -0.02 0.00 -0.31 0.00 0.00 39.34 38.49 1wpx n TYR 540 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1wpx s SER 541 N -6.67 -0.42 0.62 7.72 1.04 -1.20 -4.84 113.70 109.95 1wpx s SER 541 Ca -0.25 -0.08 0.24 0.00 0.48 0.00 0.00 55.95 56.33 1wpx s SER 541 Cb 0.08 0.50 1.11 0.00 0.10 0.00 0.00 66.02 67.80 1wpx s SER 541 CO 0.71 -0.83 1.58 0.77 0.98 0.00 0.00 173.24 176.45 1wpx h SER 542 N 2.00 0.00 -0.02 7.02 4.64 -2.03 1.43 113.55 126.59 1wpx h SER 542 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1wpx h SER 542 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1wpx h SER 542 CO 0.32 0.00 -0.00 -1.54 -0.87 0.00 0.00 176.83 174.74 1wpx n SER 543 N -3.21 2.49 -3.28 4.97 3.41 -1.26 -4.68 113.62 112.06 1wpx n SER 543 Ca 0.09 -1.74 -0.25 0.00 -0.26 0.00 0.00 58.87 56.71 1wpx n SER 543 Cb 0.92 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.80 1wpx n SER 543 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wpx n ALA 544 N 1.00 3.29 -2.44 7.33 0.00 0.49 -5.08 120.51 125.10 1wpx n ALA 544 Ca 0.10 -4.11 -0.33 0.00 0.00 0.00 0.00 53.44 49.11 1wpx n ALA 544 Cb 0.45 -0.85 -0.05 0.00 0.00 0.00 0.00 19.45 18.99 1wpx n ALA 544 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1wpx s PRO 545 N -2.00 3.81 -0.35 0.00 0.04 -1.24 -0.25 135.00 135.02 1wpx s PRO 545 Ca 0.38 0.27 -0.15 0.00 0.04 0.00 0.00 61.00 61.54 1wpx s PRO 545 Cb 0.18 -2.74 -0.01 0.00 0.04 0.00 0.00 34.50 31.97 1wpx s PRO 545 CO -0.07 0.38 0.37 0.14 0.04 0.00 0.00 177.00 177.86 1wpx s VAL 546 N -1.71 5.16 -0.59 -0.36 -7.23 -0.47 -4.94 120.40 110.26 1wpx s VAL 546 Ca 0.44 0.02 0.05 0.00 -1.81 0.00 0.00 61.98 60.68 1wpx s VAL 546 Cb -0.12 -3.84 0.31 0.00 0.56 0.00 0.00 36.38 33.29 1wpx s VAL 546 CO 0.21 -0.12 0.88 0.00 -0.31 0.00 0.00 175.10 175.76 1wpx n ALA 547 N 5.41 4.43 -3.42 1.32 0.00 -1.26 -4.36 120.51 122.63 1wpx n ALA 547 Ca -0.09 -4.68 -0.14 0.00 0.00 0.00 0.00 53.44 48.53 1wpx n ALA 547 Cb 0.49 -0.78 0.01 0.00 0.00 0.00 0.00 19.45 19.17 1wpx n ALA 547 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1wpx n MET 548 N 0.09 -1.41 0.00 0.00 2.81 -1.16 -3.97 117.12 113.49 1wpx n MET 548 Ca 0.30 1.07 0.00 0.00 -1.81 0.00 0.00 57.70 57.26 1wpx n MET 548 Cb 0.40 -4.30 0.00 0.00 -0.71 0.00 0.00 33.22 28.62 1wpx n MET 548 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1wpx n GLY 549 N -1.70 0.39 3.73 3.03 0.00 0.37 -4.96 105.19 106.05 1wpx n GLY 549 Ca -0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1wpx n GLY 549 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wpx s ASN 550 N -2.72 3.50 -0.11 1.61 4.22 -1.25 -4.48 114.94 115.71 1wpx s ASN 550 Ca 0.00 1.34 -0.05 0.00 -2.14 0.00 0.00 52.86 52.01 1wpx s ASN 550 Cb 0.00 -2.02 -0.04 0.00 1.28 0.00 0.00 41.25 40.48 1wpx s ASN 550 CO 0.00 -2.60 0.08 -0.89 -2.04 0.00 0.00 177.10 171.65 1wpx s THR 551 N -3.02 5.02 -0.02 0.54 2.01 -1.26 -0.61 115.64 118.30 1wpx s THR 551 Ca 0.63 0.02 0.04 0.00 0.31 0.00 0.00 61.69 62.70 1wpx s THR 551 Cb -0.17 -3.17 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 1wpx s THR 551 CO 0.56 0.60 -0.15 -0.76 -0.69 0.00 0.00 174.62 174.18 1wpx s LEU 552 N -0.85 1.99 0.10 4.42 1.43 0.02 -4.92 118.68 120.86 1wpx s LEU 552 Ca 0.13 -0.29 -0.31 0.00 -1.03 0.00 0.00 54.13 52.64 1wpx s LEU 552 Cb -0.12 -0.81 -0.08 0.00 0.03 0.00 0.00 46.19 45.21 1wpx s LEU 552 CO 0.03 0.17 1.41 -2.16 0.23 0.00 0.00 176.35 176.03 1wpx s PRO 553 N -0.24 4.30 0.25 1.29 0.04 -1.26 -4.48 135.00 134.90 1wpx s PRO 553 Ca 0.03 2.08 -0.03 0.00 0.04 0.00 0.00 61.00 63.12 1wpx s PRO 553 Cb -0.07 -3.31 0.50 0.00 0.04 0.00 0.00 34.50 31.67 1wpx s PRO 553 CO 0.00 -0.48 1.36 2.41 0.04 0.00 0.00 177.00 180.33 1wpx n THR 554 N 4.09 -0.36 0.32 1.26 -1.04 -1.26 -0.36 114.28 116.92 1wpx n THR 554 Ca 0.12 1.95 0.19 0.00 -2.04 0.00 0.00 64.05 64.28 1wpx n THR 554 Cb 0.42 -2.76 1.07 0.00 -1.82 0.00 0.00 70.33 67.24 1wpx n THR 554 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 1wpx h GLU 555 N 0.00 0.00 0.00 -2.82 9.09 -1.92 -1.37 114.58 117.56 1wpx h GLU 555 Ca 0.46 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 59.75 1wpx h GLU 555 Cb 0.81 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.90 1wpx h GLU 555 CO -0.86 0.00 -0.58 0.87 0.05 0.00 0.00 179.01 178.49 1wpx h LYS 556 N 0.00 0.00 -1.01 1.06 1.57 -1.07 -3.17 116.57 113.95 1wpx h LYS 556 Ca -0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 1wpx h LYS 556 Cb 0.02 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.10 1wpx h LYS 556 CO 0.00 0.58 0.51 0.00 -0.57 0.00 0.00 179.45 179.97 1wpx n ALA 557 N -2.26 4.90 -0.06 3.86 0.00 -0.52 -4.50 120.51 121.93 1wpx n ALA 557 Ca 0.01 -2.22 -0.15 0.00 0.00 0.00 0.00 53.44 51.08 1wpx n ALA 557 Cb 0.74 -1.35 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 1wpx n ALA 557 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1wpx h ARG 558 N 0.79 0.66 -6.34 0.00 2.43 -1.58 -3.36 114.38 106.99 1wpx h ARG 558 Ca 0.49 -0.44 -0.50 0.00 -0.81 0.00 0.00 59.98 58.72 1wpx h ARG 558 Cb 2.38 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 31.98 1wpx h ARG 558 CO 0.86 1.06 -0.24 -1.12 -1.51 0.00 0.00 179.97 179.02 1wpx s SER 559 N -6.70 5.08 0.20 -3.80 0.01 -1.26 -4.24 113.70 102.99 1wpx s SER 559 Ca -0.12 -0.84 -0.30 0.00 1.31 0.00 0.00 55.95 56.00 1wpx s SER 559 Cb 0.08 -0.04 -0.08 0.00 0.21 0.00 0.00 66.02 66.19 1wpx s SER 559 CO 0.84 -1.03 1.25 -0.75 0.41 0.00 0.00 173.24 173.96 1wpx s LYS 560 N -4.40 4.44 0.71 12.44 2.20 -1.26 -4.91 119.74 128.96 1wpx s LYS 560 Ca 0.51 1.97 -0.09 0.00 -0.36 0.00 0.00 55.97 58.00 1wpx s LYS 560 Cb -0.05 -3.21 0.04 0.00 -1.51 0.00 0.00 37.83 33.10 1wpx s LYS 560 CO 0.31 -0.16 1.05 -1.25 -0.36 0.00 0.00 175.35 174.94 1wpx s PRO 561 N -0.23 2.44 0.18 4.03 0.04 -1.26 -4.97 135.00 135.23 1wpx s PRO 561 Ca 0.54 0.05 -0.03 0.00 0.04 0.00 0.00 61.00 61.61 1wpx s PRO 561 Cb -0.35 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 1wpx s PRO 561 CO 0.38 -1.17 0.40 -0.65 0.04 0.00 0.00 177.00 175.99 1wpx s GLN 562 N -5.31 3.57 0.14 4.56 -0.21 0.26 -4.92 119.66 117.75 1wpx s GLN 562 Ca 0.59 -0.19 0.06 0.00 0.02 0.00 0.00 55.36 55.84 1wpx s GLN 562 Cb -0.11 -2.82 -0.04 0.00 1.00 0.00 0.00 33.01 31.04 1wpx s GLN 562 CO 0.47 0.41 -0.14 -0.06 -2.12 0.00 0.00 175.29 173.85 1wpx s PHE 563 N -1.80 1.48 -0.12 0.91 0.08 -1.26 -1.91 117.98 115.37 1wpx s PHE 563 Ca 0.40 -0.56 -0.11 0.00 0.12 0.00 0.00 56.93 56.78 1wpx s PHE 563 Cb -0.11 -0.76 0.03 0.00 -0.57 0.00 0.00 43.02 41.61 1wpx s PHE 563 CO 0.27 0.19 0.32 -1.14 -0.10 0.00 0.00 175.22 174.76 1wpx s GLN 564 N -2.88 0.38 -0.14 0.44 0.74 -0.27 -4.27 119.66 113.67 1wpx s GLN 564 Ca 0.12 0.42 0.02 0.00 0.05 0.00 0.00 55.36 55.96 1wpx s GLN 564 Cb -0.04 0.19 0.00 0.00 1.10 0.00 0.00 33.01 34.26 1wpx s GLN 564 CO 0.04 -0.05 -0.20 0.12 -0.55 0.00 0.00 175.29 174.65 1wpx s PHE 565 N 0.11 2.70 -0.26 1.67 5.36 0.11 -1.01 117.98 126.65 1wpx s PHE 565 Ca -0.01 -1.20 -0.04 0.00 -0.96 0.00 0.00 56.93 54.73 1wpx s PHE 565 Cb -0.02 -1.83 0.01 0.00 -0.34 0.00 0.00 43.02 40.84 1wpx s PHE 565 CO 0.01 -0.54 -0.01 0.99 -1.46 0.00 0.00 175.22 174.21 1wpx s THR 566 N 0.74 3.33 -0.12 0.12 2.01 -0.78 -0.56 115.64 120.39 1wpx s THR 566 Ca -0.08 -0.80 -0.09 0.00 0.31 0.00 0.00 61.69 61.03 1wpx s THR 566 Cb -0.16 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 1wpx s THR 566 CO 0.00 0.21 0.18 0.12 -0.69 0.00 0.00 174.62 174.45 1wpx s PHE 567 N 1.42 3.57 -0.29 4.92 2.19 0.96 -1.43 117.98 129.32 1wpx s PHE 567 Ca 0.02 0.56 -0.03 0.00 0.33 0.00 0.00 56.93 57.81 1wpx s PHE 567 Cb -0.16 -2.06 0.10 0.00 -1.31 0.00 0.00 43.02 39.59 1wpx s PHE 567 CO -0.02 0.61 0.11 1.21 1.83 0.00 0.00 175.22 178.96 1wpx s ASN 568 N -0.67 3.62 -0.90 6.13 2.47 -1.23 -1.71 114.94 122.65 1wpx s ASN 568 Ca 0.15 -1.35 -0.25 0.00 0.42 0.00 0.00 52.86 51.83 1wpx s ASN 568 Cb -0.12 -0.52 -0.09 0.00 -1.45 0.00 0.00 41.25 39.07 1wpx s ASN 568 CO 0.04 -0.42 2.10 -0.75 -3.72 0.00 0.00 177.10 174.35 1wpx s LYS 569 N 1.94 2.18 0.00 0.43 2.20 0.36 -2.03 119.74 124.81 1wpx s LYS 569 Ca 0.09 -0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.58 1wpx s LYS 569 Cb -0.16 -4.98 0.00 0.00 -1.51 0.00 0.00 37.83 31.17 1wpx s LYS 569 CO -0.31 -3.87 0.00 0.94 -0.36 0.00 0.00 175.35 171.75 1wpx n GLN 570 N 8.77 0.00 0.00 4.03 0.00 -1.26 -3.20 117.38 125.72 1wpx n GLN 570 Ca 0.43 0.00 0.01 0.00 -0.00 0.00 0.00 57.00 57.44 1wpx n GLN 570 Cb 0.46 0.00 0.07 0.00 0.00 0.00 0.00 30.24 30.76 1wpx n GLN 570 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1wpx n MET 571 N 0.00 0.18 -0.95 3.69 2.81 -0.86 -5.13 117.12 116.86 1wpx n MET 571 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1wpx n MET 571 Cb 0.00 -1.19 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 1wpx n MET 571 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1wpx n GLN 572 N -0.69 2.38 0.00 0.03 6.02 -1.26 -4.70 117.38 119.16 1wpx n GLN 572 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1wpx n GLN 572 Cb 0.01 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.27 1wpx n GLN 572 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1wpx n ASN 579 N -0.68 0.00 -4.77 1.08 6.94 -1.26 -5.11 115.26 111.46 1wpx n ASN 579 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 54.58 54.17 1wpx n ASN 579 Cb 0.00 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.38 1wpx n ASN 579 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wpx s ALA 580 N -0.51 3.27 -0.24 -2.53 0.00 -1.26 -5.02 121.76 115.47 1wpx s ALA 580 Ca 0.00 0.84 -0.16 0.00 0.00 0.00 0.00 51.96 52.64 1wpx s ALA 580 Cb 0.00 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 1wpx s ALA 580 CO 0.00 -0.22 0.44 -0.47 0.00 0.00 0.00 175.76 175.50 1wpx s TYR 581 N -1.35 3.29 -0.29 0.00 5.04 -1.26 -5.04 117.35 117.74 1wpx s TYR 581 Ca 0.50 0.56 0.01 0.00 -2.44 0.00 0.00 57.07 55.70 1wpx s TYR 581 Cb -0.29 -2.62 0.06 0.00 0.35 0.00 0.00 41.96 39.47 1wpx s TYR 581 CO 0.36 -0.18 -0.03 0.08 -1.34 0.00 0.00 175.55 174.44 1wpx s VAL 582 N 1.92 2.60 0.38 3.14 1.01 -1.26 -5.08 120.40 123.12 1wpx s VAL 582 Ca 0.19 -1.59 -0.25 0.00 0.00 0.00 0.00 61.98 60.32 1wpx s VAL 582 Cb -0.15 -2.55 -0.12 0.00 0.00 0.00 0.00 36.38 33.55 1wpx s VAL 582 CO 0.09 -0.14 0.92 -0.81 0.00 0.00 0.00 175.10 175.17 1wpx n PRO 583 N 4.51 1.19 -4.05 2.72 -0.04 -1.26 -5.02 135.00 133.06 1wpx n PRO 583 Ca -0.12 0.43 -0.11 0.00 -0.04 0.00 0.00 63.50 63.66 1wpx n PRO 583 Cb 0.43 -1.88 -0.06 0.00 -0.04 0.00 0.00 33.50 31.95 1wpx n PRO 583 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1wpx s GLN 584 N -1.81 1.61 0.09 0.54 -0.21 -1.26 -5.08 119.66 113.54 1wpx s GLN 584 Ca 0.62 -1.47 0.01 0.00 0.02 0.00 0.00 55.36 54.55 1wpx s GLN 584 Cb -0.61 0.43 -0.25 0.00 1.00 0.00 0.00 33.01 33.59 1wpx s GLN 584 CO 0.58 -0.65 1.19 -0.44 -2.12 0.00 0.00 175.29 173.84 1wpx h ASP 585 N 2.27 0.22 0.45 5.90 3.45 -2.01 -3.29 116.42 123.40 1wpx h ASP 585 Ca -0.28 -0.24 -0.10 0.00 0.43 0.00 0.00 57.03 56.84 1wpx h ASP 585 Cb 1.25 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 39.93 1wpx h ASP 585 CO 0.39 1.19 -0.46 0.44 -1.57 0.00 0.00 179.24 179.23 1wpx h ASP 586 N 0.04 0.02 -0.74 6.45 3.32 -2.01 -3.47 116.42 120.03 1wpx h ASP 586 Ca -0.08 -0.01 -0.60 0.00 0.02 0.00 0.00 57.03 56.36 1wpx h ASP 586 Cb 1.88 -0.00 0.03 0.00 0.22 0.00 0.00 39.33 41.46 1wpx h ASP 586 CO 0.17 0.47 0.14 0.47 -1.72 0.00 0.00 179.24 178.77 1wpx n ASP 587 N -3.99 0.17 -4.20 6.45 8.00 -1.24 -4.90 116.55 116.83 1wpx n ASP 587 Ca -0.02 0.86 -0.27 0.00 0.71 0.00 0.00 54.79 56.07 1wpx n ASP 587 Cb 0.48 -0.67 -0.16 0.00 -0.02 0.00 0.00 41.12 40.75 1wpx n ASP 587 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1wpx s LEU 588 N 0.44 2.01 0.30 0.64 1.43 -1.26 -4.64 118.68 117.60 1wpx s LEU 588 Ca 0.69 -0.39 0.11 0.00 -1.03 0.00 0.00 54.13 53.51 1wpx s LEU 588 Cb -0.97 -1.08 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 1wpx s LEU 588 CO 0.46 0.22 -0.10 -0.36 0.23 0.00 0.00 176.35 176.80 1wpx s PHE 589 N -0.28 2.44 -0.08 0.29 0.40 0.21 -0.64 117.98 120.32 1wpx s PHE 589 Ca 0.03 -0.36 0.02 0.00 -0.60 0.00 0.00 56.93 56.02 1wpx s PHE 589 Cb -0.10 -1.19 0.01 0.00 0.51 0.00 0.00 43.02 42.25 1wpx s PHE 589 CO 0.01 0.63 -0.15 0.99 0.70 0.00 0.00 175.22 177.40 1wpx s THR 590 N -2.49 1.42 -0.22 0.64 2.01 0.40 -1.71 115.64 115.68 1wpx s THR 590 Ca 0.32 -0.63 -0.05 0.00 0.31 0.00 0.00 61.69 61.64 1wpx s THR 590 Cb -0.03 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 1wpx s THR 590 CO 0.17 0.42 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.29 1wpx s LEU 591 N 0.69 3.08 0.13 4.42 2.96 0.20 -0.17 118.68 129.99 1wpx s LEU 591 Ca -0.13 -0.32 0.09 0.00 -0.22 0.00 0.00 54.13 53.56 1wpx s LEU 591 Cb -0.16 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 1wpx s LEU 591 CO 0.03 -0.01 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.18 1wpx s VAL 592 N 1.41 2.75 -0.08 1.68 1.01 -0.04 -1.11 120.40 126.02 1wpx s VAL 592 Ca 0.05 -1.60 -0.02 0.00 0.00 0.00 0.00 61.98 60.41 1wpx s VAL 592 Cb -0.14 -2.27 0.03 0.00 0.00 0.00 0.00 36.38 33.99 1wpx s VAL 592 CO -0.01 0.06 0.02 -0.32 0.00 0.00 0.00 175.10 174.85 1wpx s MET 593 N -2.25 0.48 0.06 2.72 1.75 -0.45 -1.09 119.30 120.52 1wpx s MET 593 Ca 0.18 0.12 0.00 0.00 -1.25 0.00 0.00 55.69 54.75 1wpx s MET 593 Cb -0.10 -0.98 -0.03 0.00 2.84 0.00 0.00 34.83 36.55 1wpx s MET 593 CO 0.10 -0.34 -0.05 -0.08 -0.65 0.00 0.00 175.02 174.00 1wpx s THR 594 N 2.00 0.39 -0.24 10.11 -1.32 -0.59 -1.14 115.64 124.85 1wpx s THR 594 Ca 0.05 -1.56 0.02 0.00 -1.21 0.00 0.00 61.69 58.99 1wpx s THR 594 Cb -0.13 -1.19 0.05 0.00 -1.51 0.00 0.00 72.50 69.72 1wpx s THR 594 CO -0.05 -0.77 -0.13 -0.62 -2.21 0.00 0.00 174.62 170.84 1wpx s ASP 595 N -2.47 4.12 0.00 8.08 2.15 -0.99 -0.99 116.67 126.57 1wpx s ASP 595 Ca 0.01 -1.19 0.21 0.00 0.43 0.00 0.00 52.55 52.01 1wpx s ASP 595 Cb 0.01 -1.54 0.75 0.00 -0.30 0.00 0.00 42.92 41.84 1wpx s ASP 595 CO -0.05 -0.14 1.54 -0.81 -0.17 0.00 0.00 175.17 175.54 1wpx n PRO 596 N 4.49 1.72 -2.61 4.34 -0.04 -1.25 -0.97 135.00 140.68 1wpx n PRO 596 Ca -0.16 -1.09 -0.29 0.00 -0.04 0.00 0.00 63.50 61.92 1wpx n PRO 596 Cb 0.44 -1.39 -0.01 0.00 -0.04 0.00 0.00 33.50 32.50 1wpx n PRO 596 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wpx n ASP 597 N 0.32 5.10 -4.21 3.54 8.00 -1.26 -4.33 116.55 123.71 1wpx n ASP 597 Ca 0.16 -3.72 -0.32 0.00 0.71 0.00 0.00 54.79 51.62 1wpx n ASP 597 Cb 0.33 -0.61 -0.16 0.00 -0.02 0.00 0.00 41.12 40.66 1wpx n ASP 597 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wpx s ALA 598 N -3.63 2.27 -1.11 2.24 0.00 -1.26 -1.94 121.76 118.33 1wpx s ALA 598 Ca 0.48 -1.04 0.24 0.00 0.00 0.00 0.00 51.96 51.64 1wpx s ALA 598 Cb 0.34 -0.96 1.06 0.00 0.00 0.00 0.00 23.12 23.57 1wpx s ALA 598 CO -0.19 0.10 1.77 -0.35 0.00 0.00 0.00 175.76 177.09 1wpx n PRO 599 N 3.85 0.09 -3.90 0.00 -0.04 -1.01 -0.93 135.00 133.06 1wpx n PRO 599 Ca -0.19 0.08 -0.09 0.00 -0.04 0.00 0.00 63.50 63.26 1wpx n PRO 599 Cb 0.52 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.47 1wpx n PRO 599 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wpx s SER 600 N -2.89 0.03 0.00 3.54 1.04 -0.82 -4.53 113.70 110.07 1wpx s SER 600 Ca 0.14 -0.98 0.12 0.00 0.48 0.00 0.00 55.95 55.71 1wpx s SER 600 Cb 0.16 0.73 0.52 0.00 0.10 0.00 0.00 66.02 67.53 1wpx s SER 600 CO 0.41 -1.42 1.36 1.17 0.98 0.00 0.00 173.24 175.75 1wpx n LYS 601 N -0.48 0.03 -0.03 4.02 4.81 -1.26 -3.59 118.16 121.66 1wpx n LYS 601 Ca -0.04 0.28 -0.06 0.00 -0.87 0.00 0.00 58.31 57.61 1wpx n LYS 601 Cb 0.60 -1.50 -0.02 0.00 0.02 0.00 0.00 35.03 34.13 1wpx n LYS 601 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1wpx n THR 602 N -1.46 0.35 -2.83 3.15 -1.04 -1.26 -4.94 114.28 106.24 1wpx n THR 602 Ca 0.03 -0.10 -0.43 0.00 -2.04 0.00 0.00 64.05 61.51 1wpx n THR 602 Cb 0.13 -1.35 -0.04 0.00 -1.82 0.00 0.00 70.33 67.25 1wpx n THR 602 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1wpx s ASP 603 N -5.31 6.57 -0.34 8.00 -1.08 -1.24 -4.92 116.67 118.36 1wpx s ASP 603 Ca -0.09 0.31 0.08 0.00 -0.52 0.00 0.00 52.55 52.34 1wpx s ASP 603 Cb 0.03 -2.45 0.63 0.00 -1.46 0.00 0.00 42.92 39.67 1wpx s ASP 603 CO 0.12 -0.94 1.70 1.41 0.52 0.00 0.00 175.17 177.98 1wpx n HIS 604 N 6.93 2.09 -0.01 -5.34 8.25 -1.26 -2.39 115.22 123.49 1wpx n HIS 604 Ca 0.06 -1.51 0.23 0.00 -0.26 0.00 0.00 57.72 56.24 1wpx n HIS 604 Cb 0.48 -0.68 0.72 0.00 1.12 0.00 0.00 29.99 31.64 1wpx n HIS 604 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1wpx h LYS 605 N 1.50 0.00 0.00 -0.41 1.63 -1.92 -0.96 116.57 116.42 1wpx h LYS 605 Ca 0.35 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.15 1wpx h LYS 605 Cb 2.22 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.85 1wpx h LYS 605 CO 0.70 0.00 -0.07 0.91 -3.45 0.00 0.00 179.45 177.54 1wpx n TRP 606 N -4.04 0.00 -1.36 1.91 8.01 -1.05 -4.80 117.44 116.12 1wpx n TRP 606 Ca 0.11 -0.51 -0.53 0.00 -1.31 0.00 0.00 57.50 55.26 1wpx n TRP 606 Cb 0.73 -0.07 -0.07 0.00 -2.01 0.00 0.00 31.31 29.88 1wpx n TRP 606 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 1wpx n SER 607 N -0.65 -0.01 -1.88 -0.99 2.88 -0.10 -3.26 113.62 109.60 1wpx n SER 607 Ca 0.05 1.05 -0.02 0.00 -1.33 0.00 0.00 58.87 58.62 1wpx n SER 607 Cb 0.48 -0.83 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 1wpx n SER 607 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1wpx n GLU 608 N 1.35 -0.75 -3.52 -1.46 -0.58 -0.28 -3.69 120.64 111.71 1wpx n GLU 608 Ca 0.18 1.01 -0.38 0.00 -0.42 0.00 0.00 57.16 57.55 1wpx n GLU 608 Cb 0.07 -2.63 -0.09 0.00 -0.57 0.00 0.00 31.44 28.22 1wpx n GLU 608 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1wpx s PHE 609 N -1.28 3.28 -0.36 -0.32 2.19 -0.15 -1.82 117.98 119.54 1wpx s PHE 609 Ca 0.06 0.32 -0.29 0.00 0.33 0.00 0.00 56.93 57.35 1wpx s PHE 609 Cb -0.02 -2.43 0.01 0.00 -1.31 0.00 0.00 43.02 39.27 1wpx s PHE 609 CO 0.22 -0.08 1.33 0.00 1.83 0.00 0.00 175.22 178.52 1wpx n HIS 611 N 8.10 0.16 -3.59 0.00 8.25 -0.29 -4.76 115.22 123.09 1wpx n HIS 611 Ca 0.15 0.06 -0.12 0.00 -0.26 0.00 0.00 57.72 57.55 1wpx n HIS 611 Cb 0.47 -0.98 -0.06 0.00 1.12 0.00 0.00 29.99 30.54 1wpx n HIS 611 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1wpx s LEU 612 N -5.49 -0.47 -0.29 2.41 1.98 -1.06 -1.75 118.68 114.00 1wpx s LEU 612 Ca -0.09 0.67 0.03 0.00 -2.89 0.00 0.00 54.13 51.86 1wpx s LEU 612 Cb 0.07 2.04 0.18 0.00 0.66 0.00 0.00 46.19 49.14 1wpx s LEU 612 CO 0.84 -0.33 0.50 -0.69 -1.89 0.00 0.00 176.35 174.77 1wpx s VAL 613 N -0.64 -0.82 -0.13 1.68 1.01 -0.99 -1.34 120.40 119.18 1wpx s VAL 613 Ca -0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 61.80 1wpx s VAL 613 Cb -0.02 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1wpx s VAL 613 CO 0.01 -0.14 -0.06 -1.61 0.00 0.00 0.00 175.10 173.30 1wpx s GLU 614 N 2.69 3.37 0.37 2.72 2.02 -0.27 -1.24 118.70 128.35 1wpx s GLU 614 Ca 0.11 -0.56 0.05 0.00 0.02 0.00 0.00 54.97 54.58 1wpx s GLU 614 Cb -0.12 -2.77 -0.06 0.00 0.10 0.00 0.00 34.13 31.28 1wpx s GLU 614 CO -0.27 0.35 0.05 0.00 0.02 0.00 0.00 175.26 175.41 1wpx n ASP 616 N -0.85 -3.03 -4.82 0.00 8.00 -1.04 -0.81 116.55 114.00 1wpx n ASP 616 Ca -0.04 -0.70 -0.37 0.00 0.71 0.00 0.00 54.79 54.39 1wpx n ASP 616 Cb 0.67 -4.54 -0.06 0.00 -0.02 0.00 0.00 41.12 37.16 1wpx n ASP 616 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1wpx s LEU 617 N -6.80 4.38 0.12 0.64 1.43 -0.69 -3.79 118.68 113.97 1wpx s LEU 617 Ca 0.22 0.65 0.09 0.00 -1.03 0.00 0.00 54.13 54.07 1wpx s LEU 617 Cb -0.11 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 1wpx s LEU 617 CO 0.77 0.30 -0.22 -1.59 0.23 0.00 0.00 176.35 175.84 1wpx s LYS 618 N -0.65 1.24 0.20 1.70 -2.85 -1.25 0.67 119.74 118.80 1wpx s LYS 618 Ca 0.18 -1.27 -0.30 0.00 -1.00 0.00 0.00 55.97 53.59 1wpx s LYS 618 Cb -0.14 -1.55 -0.08 0.00 -2.06 0.00 0.00 37.83 34.00 1wpx s LYS 618 CO 0.07 0.35 1.00 -0.51 0.10 0.00 0.00 175.35 176.36 1wpx s LEU 619 N -2.10 4.57 0.19 2.77 1.43 -1.26 -0.03 118.68 124.24 1wpx s LEU 619 Ca 0.11 1.99 -0.05 0.00 -1.03 0.00 0.00 54.13 55.15 1wpx s LEU 619 Cb -0.09 -3.61 0.11 0.00 0.03 0.00 0.00 46.19 42.63 1wpx s LEU 619 CO 0.05 -0.01 1.53 -0.07 0.23 0.00 0.00 176.35 178.09 1wpx h LEU 620 N 4.61 0.73 -0.35 1.79 3.38 -1.73 -3.45 115.31 120.29 1wpx h LEU 620 Ca -0.45 -0.35 0.24 0.00 0.09 0.00 0.00 57.88 57.41 1wpx h LEU 620 Cb 1.21 -0.21 -0.11 0.00 0.09 0.00 0.00 40.66 41.64 1wpx h LEU 620 CO 0.70 1.07 -0.72 -3.20 0.09 0.00 0.00 178.44 176.37 1wpx n ASN 621 N -4.02 -5.44 0.00 -0.43 2.85 -1.26 -5.05 115.26 101.92 1wpx n ASN 621 Ca -0.02 0.83 0.00 0.00 -0.11 0.00 0.00 54.58 55.27 1wpx n ASN 621 Cb 0.55 -3.72 0.00 0.00 1.24 0.00 0.00 39.78 37.85 1wpx n ASN 621 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1wpx n THR 631 N -3.71 0.00 -3.02 -0.44 5.66 -1.19 -4.87 114.28 106.70 1wpx n THR 631 Ca -0.04 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.56 1wpx n THR 631 Cb 0.54 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.26 1wpx n THR 631 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1wpx s GLU 632 N -0.28 4.50 -0.27 1.09 0.41 -1.26 -4.97 118.70 117.92 1wpx s GLU 632 Ca 0.00 1.07 -0.25 0.00 -0.41 0.00 0.00 54.97 55.38 1wpx s GLU 632 Cb 0.00 -3.30 0.09 0.00 -1.78 0.00 0.00 34.13 29.14 1wpx s GLU 632 CO 0.00 0.47 0.84 0.12 -0.49 0.00 0.00 175.26 176.20 1wpx s PHE 633 N -0.74 -0.67 -0.25 1.61 5.36 -1.26 -0.49 117.98 121.54 1wpx s PHE 633 Ca 0.36 1.62 -0.28 0.00 -0.96 0.00 0.00 56.93 57.67 1wpx s PHE 633 Cb -0.22 0.31 0.16 0.00 -0.34 0.00 0.00 43.02 42.93 1wpx s PHE 633 CO 0.24 -0.32 1.23 -0.59 -1.46 0.00 0.00 175.22 174.32 1wpx s PHE 634 N 0.30 -0.19 -0.12 10.12 -0.12 -0.69 -4.99 117.98 122.28 1wpx s PHE 634 Ca 0.01 0.38 0.03 0.00 -0.05 0.00 0.00 56.93 57.30 1wpx s PHE 634 Cb -0.05 0.46 0.00 0.00 -0.63 0.00 0.00 43.02 42.80 1wpx s PHE 634 CO -0.02 -0.15 -0.21 0.00 -0.05 0.00 0.00 175.22 174.80 1wpx s ALA 635 N -0.67 2.29 -0.00 1.99 0.00 -1.26 -0.03 121.76 124.08 1wpx s ALA 635 Ca 0.05 -1.00 -0.11 0.00 0.00 0.00 0.00 51.96 50.90 1wpx s ALA 635 Cb -0.02 -0.96 0.01 0.00 0.00 0.00 0.00 23.12 22.15 1wpx s ALA 635 CO -0.06 0.16 0.21 0.45 0.00 0.00 0.00 175.76 176.51 1wpx s SER 636 N 0.53 -0.07 0.63 0.00 0.15 0.27 -4.89 113.70 110.33 1wpx s SER 636 Ca -0.13 -0.08 0.03 0.00 0.70 0.00 0.00 55.95 56.46 1wpx s SER 636 Cb -0.17 0.25 0.09 0.00 -1.71 0.00 0.00 66.02 64.48 1wpx s SER 636 CO 0.04 -0.41 0.87 -1.61 1.20 0.00 0.00 173.24 173.34 1wpx s GLU 637 N -1.37 2.08 0.15 5.44 2.02 -1.26 0.07 118.70 125.83 1wpx s GLU 637 Ca -0.14 -1.17 0.02 0.00 0.02 0.00 0.00 54.97 53.69 1wpx s GLU 637 Cb -0.07 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.66 1wpx s GLU 637 CO 0.03 -1.08 0.29 -0.06 0.02 0.00 0.00 175.26 174.46 1wpx s PHE 638 N -2.90 3.49 -0.48 1.61 0.08 -1.26 -2.12 117.98 116.39 1wpx s PHE 638 Ca 0.63 0.17 -0.18 0.00 0.12 0.00 0.00 56.93 57.66 1wpx s PHE 638 Cb -0.07 -1.70 0.05 0.00 -0.57 0.00 0.00 43.02 40.73 1wpx s PHE 638 CO 0.41 0.51 0.57 1.21 -0.10 0.00 0.00 175.22 177.81 1wpx s ASN 639 N -3.13 6.22 0.51 1.36 3.04 0.95 -4.78 114.94 119.10 1wpx s ASN 639 Ca 0.35 -0.90 0.30 0.00 0.04 0.00 0.00 52.86 52.65 1wpx s ASN 639 Cb -0.11 -2.27 1.12 0.00 -1.54 0.00 0.00 41.25 38.45 1wpx s ASN 639 CO 0.28 -0.81 1.90 0.00 -3.04 0.00 0.00 177.10 175.44 1wpx h THR 640 N 5.83 0.15 0.00 -5.21 1.03 -1.97 -3.33 112.91 109.41 1wpx h THR 640 Ca -0.27 -0.74 0.00 0.00 -0.01 0.00 0.00 66.41 65.39 1wpx h THR 640 Cb 1.10 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.82 1wpx h THR 640 CO 0.92 0.06 0.00 0.29 -0.01 0.00 0.00 175.52 176.78 1wpx n LYS 641 N -3.17 0.00 0.00 0.00 4.76 -1.26 -2.58 118.16 115.91 1wpx n LYS 641 Ca 0.01 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1wpx n LYS 641 Cb 0.37 -0.45 0.00 0.00 -1.84 0.00 0.00 35.03 33.11 1wpx n LYS 641 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wpx n GLY 642 N -0.06 1.03 3.91 0.72 0.00 -1.26 -4.87 105.19 104.66 1wpx n GLY 642 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1wpx n GLY 642 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wpx s SER 643 N 0.26 5.01 -0.10 1.61 1.04 -1.06 -4.85 113.70 115.61 1wpx s SER 643 Ca 0.00 0.74 -0.01 0.00 0.48 0.00 0.00 55.95 57.16 1wpx s SER 643 Cb 0.00 -1.44 0.03 0.00 0.10 0.00 0.00 66.02 64.71 1wpx s SER 643 CO 0.00 -1.53 -0.02 0.20 0.98 0.00 0.00 173.24 172.87 1wpx s ASN 644 N -4.46 1.97 -0.43 7.02 -0.87 0.01 -4.98 114.94 113.20 1wpx s ASN 644 Ca 0.59 -0.26 -0.23 0.00 -1.57 0.00 0.00 52.86 51.39 1wpx s ASN 644 Cb -0.11 -0.59 0.02 0.00 -0.02 0.00 0.00 41.25 40.55 1wpx s ASN 644 CO 0.47 -0.19 0.78 -0.89 -2.57 0.00 0.00 177.10 174.70 1wpx s THR 645 N 1.87 4.68 0.09 1.60 2.01 -1.26 -0.66 115.64 123.96 1wpx s THR 645 Ca 0.04 0.52 -0.03 0.00 0.31 0.00 0.00 61.69 62.53 1wpx s THR 645 Cb -0.13 -4.29 -0.27 0.00 0.01 0.00 0.00 72.50 67.82 1wpx s THR 645 CO -0.06 -0.65 1.17 -0.07 -0.69 0.00 0.00 174.62 174.32 1wpx h LEU 646 N 10.03 0.40 -7.07 4.42 3.38 -1.56 -3.42 115.31 121.48 1wpx h LEU 646 Ca -0.25 -0.41 -0.56 0.00 0.09 0.00 0.00 57.88 56.76 1wpx h LEU 646 Cb 1.09 -0.13 -0.40 0.00 0.09 0.00 0.00 40.66 41.31 1wpx h LEU 646 CO 0.95 1.31 -0.76 -0.63 0.09 0.00 0.00 178.44 179.39 1wpx s ILE 647 N -2.73 0.55 0.64 1.22 -1.09 -1.14 -4.99 121.20 113.65 1wpx s ILE 647 Ca -0.04 -1.06 -0.17 0.00 -2.23 0.00 0.00 60.65 57.15 1wpx s ILE 647 Cb 0.08 -1.36 -0.06 0.00 -1.58 0.00 0.00 42.46 39.54 1wpx s ILE 647 CO 0.88 -0.60 0.58 -1.84 -1.23 0.00 0.00 174.94 172.72 1wpx n GLU 648 N 5.00 0.46 -2.05 2.79 0.00 -1.26 -2.35 120.64 123.22 1wpx n GLU 648 Ca -0.04 0.19 -0.41 0.00 0.00 0.00 0.00 57.16 56.90 1wpx n GLU 648 Cb 0.43 -1.81 -0.02 0.00 0.00 0.00 0.00 31.44 30.04 1wpx n GLU 648 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 1wpx s TYR 649 N -1.78 2.94 -0.12 -1.84 5.04 -1.25 -4.48 117.35 115.85 1wpx s TYR 649 Ca 0.68 1.37 -0.04 0.00 -2.44 0.00 0.00 57.07 56.65 1wpx s TYR 649 Cb -0.40 -3.74 0.06 0.00 0.35 0.00 0.00 41.96 38.23 1wpx s TYR 649 CO 0.55 -2.08 0.16 1.41 -1.34 0.00 0.00 175.55 174.25 1wpx s MET 650 N -1.90 0.07 1.19 4.97 -2.45 -0.72 -4.99 119.30 115.46 1wpx s MET 650 Ca 0.51 0.38 -0.15 0.00 -1.25 0.00 0.00 55.69 55.18 1wpx s MET 650 Cb -0.41 -0.72 0.29 0.00 1.25 0.00 0.00 34.83 35.23 1wpx s MET 650 CO 0.54 -0.44 1.03 0.20 1.05 0.00 0.00 175.02 177.40 1wpx s GLY 651 N 2.27 1.52 0.46 2.11 0.00 -1.26 -4.79 107.32 107.64 1wpx s GLY 651 Ca 0.04 -0.38 -0.25 0.00 0.00 0.00 0.00 44.72 44.13 1wpx s GLY 651 CO -0.08 0.39 1.44 -4.14 0.00 0.00 0.00 173.10 170.72 1wpx s PRO 652 N -4.73 3.65 -0.37 2.90 0.02 -1.26 -4.95 135.00 130.26 1wpx s PRO 652 Ca 0.68 2.44 0.12 0.00 0.02 0.00 0.00 61.00 64.26 1wpx s PRO 652 Cb -0.21 -2.64 0.41 0.00 0.02 0.00 0.00 34.50 32.09 1wpx s PRO 652 CO 0.62 -0.86 1.22 0.00 -0.33 0.00 0.00 177.00 177.65 1wpx n ALA 653 N -0.24 1.99 -1.76 -1.55 0.00 -1.26 -4.94 120.51 112.74 1wpx n ALA 653 Ca 0.05 -1.92 -0.39 0.00 0.00 0.00 0.00 53.44 51.18 1wpx n ALA 653 Cb 0.42 -0.98 0.02 0.00 0.00 0.00 0.00 19.45 18.91 1wpx n ALA 653 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1wpx s PRO 654 N -0.95 3.63 0.16 0.00 0.04 -1.26 -4.93 135.00 131.69 1wpx s PRO 654 Ca 0.24 2.32 -0.31 0.00 0.04 0.00 0.00 61.00 63.28 1wpx s PRO 654 Cb 0.42 -2.59 -0.10 0.00 0.04 0.00 0.00 34.50 32.27 1wpx s PRO 654 CO -0.05 -0.83 1.59 -2.14 0.04 0.00 0.00 177.00 175.62 1wpx s PRO 655 N -2.51 4.21 0.02 0.56 0.02 -1.26 -4.58 135.00 131.44 1wpx s PRO 655 Ca 0.62 2.38 -0.37 0.00 0.02 0.00 0.00 61.00 63.65 1wpx s PRO 655 Cb -0.42 -3.21 -0.16 0.00 0.02 0.00 0.00 34.50 30.73 1wpx s PRO 655 CO 0.53 -0.64 1.44 1.17 -0.33 0.00 0.00 177.00 179.17 1wpx n LYS 656 N 4.19 1.21 0.00 5.54 4.81 -1.26 -0.77 118.16 131.88 1wpx n LYS 656 Ca 0.14 0.44 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 1wpx n LYS 656 Cb 0.38 -2.10 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1wpx n LYS 656 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wpx n GLY 657 N 2.92 2.20 0.02 3.14 0.00 -0.56 -4.88 105.19 108.02 1wpx n GLY 657 Ca 0.20 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.30 1wpx n GLY 657 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wpx n SER 658 N 0.00 0.13 0.00 1.61 3.41 0.05 -5.00 113.62 113.82 1wpx n SER 658 Ca 0.00 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1wpx n SER 658 Cb 0.00 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 1wpx n SER 658 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wpx n GLY 659 N 0.10 -2.80 3.82 5.00 0.00 -1.26 -4.45 105.19 105.59 1wpx n GLY 659 Ca 0.03 -1.90 -0.32 0.00 0.00 0.00 0.00 46.02 43.83 1wpx n GLY 659 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wpx s PRO 660 N -0.51 3.58 0.13 1.61 0.04 -1.26 -4.49 135.00 134.09 1wpx s PRO 660 Ca 0.00 1.11 0.09 0.00 0.04 0.00 0.00 61.00 62.24 1wpx s PRO 660 Cb 0.00 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1wpx s PRO 660 CO 0.00 -0.59 -0.22 -1.01 0.04 0.00 0.00 177.00 175.22 1wpx s HIS 661 N -2.50 1.97 -0.17 0.56 3.76 -0.37 -4.61 115.29 113.93 1wpx s HIS 661 Ca 0.62 -0.41 -0.19 0.00 -0.15 0.00 0.00 55.06 54.92 1wpx s HIS 661 Cb -0.14 -1.05 -0.03 0.00 1.11 0.00 0.00 32.58 32.47 1wpx s HIS 661 CO 0.34 0.29 0.55 1.03 -0.85 0.00 0.00 174.74 176.10 1wpx s ARG 662 N -2.16 4.25 -0.40 1.40 0.52 -1.26 -2.92 118.95 118.37 1wpx s ARG 662 Ca 0.11 0.51 -0.04 0.00 -0.52 0.00 0.00 55.73 55.79 1wpx s ARG 662 Cb -0.09 -3.53 0.10 0.00 0.52 0.00 0.00 34.95 31.95 1wpx s ARG 662 CO 0.06 -0.09 0.20 0.71 0.02 0.00 0.00 175.30 176.19 1wpx s TYR 663 N 1.42 3.49 -0.25 -0.53 2.02 -0.49 -3.90 117.35 119.12 1wpx s TYR 663 Ca 0.27 -2.16 -0.10 0.00 -0.37 0.00 0.00 57.07 54.70 1wpx s TYR 663 Cb -0.16 -3.06 -0.05 0.00 -0.40 0.00 0.00 41.96 38.30 1wpx s TYR 663 CO 0.11 -0.93 0.16 0.08 -1.57 0.00 0.00 175.55 173.39 1wpx s VAL 664 N 1.22 5.23 -0.12 0.71 1.01 -0.16 -2.24 120.40 126.05 1wpx s VAL 664 Ca 0.05 0.14 -0.13 0.00 0.00 0.00 0.00 61.98 62.05 1wpx s VAL 664 Cb -0.23 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1wpx s VAL 664 CO -0.03 0.32 0.28 -0.36 0.00 0.00 0.00 175.10 175.32 1wpx s PHE 665 N 1.32 3.55 -0.04 5.22 0.40 -0.04 -1.54 117.98 126.85 1wpx s PHE 665 Ca 0.07 0.67 0.01 0.00 -0.60 0.00 0.00 56.93 57.08 1wpx s PHE 665 Cb -0.14 -2.24 0.02 0.00 0.51 0.00 0.00 43.02 41.16 1wpx s PHE 665 CO 0.07 0.43 -0.06 -0.51 0.70 0.00 0.00 175.22 175.85 1wpx s LEU 666 N -0.19 1.51 -0.23 -0.37 1.02 -0.25 -2.15 118.68 118.01 1wpx s LEU 666 Ca 0.18 -0.14 -0.07 0.00 0.02 0.00 0.00 54.13 54.12 1wpx s LEU 666 Cb -0.14 -0.45 -0.03 0.00 0.02 0.00 0.00 46.19 45.59 1wpx s LEU 666 CO 0.06 -0.01 0.05 -0.22 0.02 0.00 0.00 176.35 176.25 1wpx s LEU 667 N 0.63 3.43 0.07 1.79 2.96 -0.19 -0.86 118.68 126.51 1wpx s LEU 667 Ca -0.09 -0.18 0.08 0.00 -0.22 0.00 0.00 54.13 53.72 1wpx s LEU 667 Cb -0.12 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 1wpx s LEU 667 CO 0.00 0.01 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.56 1wpx s TYR 668 N 1.34 2.56 -0.19 5.38 1.51 0.75 -0.13 117.35 128.58 1wpx s TYR 668 Ca 0.05 -0.25 -0.12 0.00 -1.01 0.00 0.00 57.07 55.73 1wpx s TYR 668 Cb -0.15 -1.42 -0.05 0.00 -0.11 0.00 0.00 41.96 40.24 1wpx s TYR 668 CO 0.03 0.31 0.23 0.21 -1.11 0.00 0.00 175.55 175.22 1wpx s LYS 669 N -1.75 4.20 0.43 -0.62 2.20 0.77 -0.45 119.74 124.51 1wpx s LYS 669 Ca 0.16 -0.05 -0.15 0.00 -0.36 0.00 0.00 55.97 55.57 1wpx s LYS 669 Cb -0.11 -3.45 -0.08 0.00 -1.51 0.00 0.00 37.83 32.68 1wpx s LYS 669 CO 0.08 0.20 0.86 -0.65 -0.36 0.00 0.00 175.35 175.48 1wpx s GLN 670 N 0.61 3.94 0.44 4.03 -0.21 0.19 -1.64 119.66 127.02 1wpx s GLN 670 Ca 0.13 0.76 -0.25 0.00 0.02 0.00 0.00 55.36 56.01 1wpx s GLN 670 Cb -0.13 -2.29 -0.08 0.00 1.00 0.00 0.00 33.01 31.52 1wpx s GLN 670 CO 0.02 -0.07 1.36 -2.14 -2.12 0.00 0.00 175.29 172.34 1wpx s PRO 671 N -3.66 3.78 0.24 2.91 0.02 -1.26 -4.62 135.00 132.41 1wpx s PRO 671 Ca 0.56 2.26 -0.31 0.00 0.02 0.00 0.00 61.00 63.53 1wpx s PRO 671 Cb -0.10 -2.67 -0.13 0.00 0.02 0.00 0.00 34.50 31.62 1wpx s PRO 671 CO 0.26 -0.68 1.43 1.17 -0.33 0.00 0.00 177.00 178.85 1wpx n LYS 672 N -0.11 2.10 0.00 5.54 4.81 -1.26 -2.34 118.16 126.90 1wpx n LYS 672 Ca 0.05 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1wpx n LYS 672 Cb 0.43 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.06 1wpx n LYS 672 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wpx n GLY 673 N 2.23 2.95 3.49 3.14 0.00 -1.26 -5.00 105.19 110.74 1wpx n GLY 673 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1wpx n GLY 673 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wpx s VAL 674 N -2.43 4.85 0.80 1.61 0.11 -0.99 -5.08 120.40 119.28 1wpx s VAL 674 Ca 0.00 -0.21 -0.10 0.00 -2.93 0.00 0.00 61.98 58.74 1wpx s VAL 674 Cb 0.00 -3.41 0.10 0.00 -1.53 0.00 0.00 36.38 31.54 1wpx s VAL 674 CO 0.00 0.13 1.14 1.51 -3.33 0.00 0.00 175.10 174.55 1wpx s ASP 675 N 1.67 4.33 0.47 3.54 1.47 -1.26 -4.64 116.67 122.25 1wpx s ASP 675 Ca 0.06 0.50 0.32 0.00 1.18 0.00 0.00 52.55 54.60 1wpx s ASP 675 Cb -0.17 -0.95 1.53 0.00 -0.34 0.00 0.00 42.92 43.00 1wpx s ASP 675 CO 0.08 -1.96 1.97 0.77 0.68 0.00 0.00 175.17 176.71 1wpx h SER 676 N -0.98 0.00 0.16 2.11 4.64 -1.97 -2.80 113.55 114.71 1wpx h SER 676 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1wpx h SER 676 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1wpx h SER 676 CO 0.57 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.99 1wpx n SER 677 N -2.74 0.00 -0.67 4.97 3.41 -1.26 -1.66 113.62 115.66 1wpx n SER 677 Ca -0.00 0.44 0.08 0.00 -0.26 0.00 0.00 58.87 59.12 1wpx n SER 677 Cb 0.18 -0.45 0.08 0.00 -0.26 0.00 0.00 64.21 63.76 1wpx n SER 677 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wpx n LYS 678 N -1.45 1.41 -3.00 4.33 5.02 -1.06 -4.98 118.16 118.42 1wpx n LYS 678 Ca 0.02 -1.55 -0.34 0.00 -2.02 0.00 0.00 58.31 54.42 1wpx n LYS 678 Cb 0.06 -1.32 -0.06 0.00 -0.02 0.00 0.00 35.03 33.69 1wpx n LYS 678 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1wpx s PHE 679 N -1.31 3.46 0.44 2.13 0.08 -0.67 -5.00 117.98 117.11 1wpx s PHE 679 Ca 0.20 1.43 -0.24 0.00 0.12 0.00 0.00 56.93 58.44 1wpx s PHE 679 Cb 0.14 -2.69 -0.10 0.00 -0.57 0.00 0.00 43.02 39.80 1wpx s PHE 679 CO 0.20 0.11 1.05 -1.13 -0.10 0.00 0.00 175.22 175.35 1wpx n SER 680 N -0.09 1.44 -4.74 1.36 3.41 -1.26 -4.94 113.62 108.79 1wpx n SER 680 Ca 0.03 1.03 -0.31 0.00 -0.26 0.00 0.00 58.87 59.36 1wpx n SER 680 Cb 0.53 -1.38 0.11 0.00 -0.26 0.00 0.00 64.21 63.21 1wpx n SER 680 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1wpx s LYS 681 N -2.11 1.85 -0.45 4.33 2.20 -1.26 -5.02 119.74 119.28 1wpx s LYS 681 Ca 0.64 1.12 0.04 0.00 -0.36 0.00 0.00 55.97 57.41 1wpx s LYS 681 Cb -0.54 -1.85 0.12 0.00 -1.51 0.00 0.00 37.83 34.05 1wpx s LYS 681 CO 0.56 -1.92 0.19 0.42 -0.36 0.00 0.00 175.35 174.25 1wpx s ILE 682 N -2.88 2.34 0.05 5.43 1.01 -1.26 -5.01 121.20 120.89 1wpx s ILE 682 Ca 0.62 -2.91 -0.10 0.00 0.00 0.00 0.00 60.65 58.27 1wpx s ILE 682 Cb -0.18 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 1wpx s ILE 682 CO 0.57 -0.74 0.88 1.17 0.00 0.00 0.00 174.94 176.81 1wpx n LYS 683 N 3.54 -0.14 -2.10 2.79 4.81 -1.26 -4.83 118.16 120.97 1wpx n LYS 683 Ca 0.05 0.87 -0.02 0.00 -0.87 0.00 0.00 58.31 58.33 1wpx n LYS 683 Cb 0.36 -1.29 0.01 0.00 0.02 0.00 0.00 35.03 34.12 1wpx n LYS 683 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1wpx n ASP 684 N -3.67 -0.75 0.29 3.14 5.75 -1.26 -4.95 116.55 115.10 1wpx n ASP 684 Ca 0.01 -1.48 -0.12 0.00 -0.01 0.00 0.00 54.79 53.19 1wpx n ASP 684 Cb 0.08 1.24 -0.05 0.00 -1.03 0.00 0.00 41.12 41.36 1wpx n ASP 684 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1wpx h ARG 685 N 0.00 -0.73 -6.32 0.11 3.08 -1.88 -0.14 114.38 108.51 1wpx h ARG 685 Ca -0.11 0.05 -0.64 0.00 0.07 0.00 0.00 59.98 59.34 1wpx h ARG 685 Cb 0.44 0.16 0.04 0.00 0.08 0.00 0.00 29.97 30.69 1wpx h ARG 685 CO 0.14 -0.48 0.81 -0.35 -1.07 0.00 0.00 179.97 179.02 1wpx n PRO 686 N -4.52 1.72 -1.31 0.04 -0.04 -1.26 0.54 135.00 130.18 1wpx n PRO 686 Ca -0.09 0.63 -0.11 0.00 -0.04 0.00 0.00 63.50 63.89 1wpx n PRO 686 Cb 0.30 -2.37 -0.05 0.00 -0.04 0.00 0.00 33.50 31.34 1wpx n PRO 686 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1wpx n ASN 687 N 4.40 -5.65 -2.31 3.54 4.13 -0.76 -1.23 115.26 117.38 1wpx n ASN 687 Ca 0.21 0.26 -0.20 0.00 1.68 0.00 0.00 54.58 56.53 1wpx n ASN 687 Cb 0.24 -4.09 -0.02 0.00 -1.54 0.00 0.00 39.78 34.36 1wpx n ASN 687 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 1wpx n TRP 688 N -2.24 -0.92 -1.61 3.10 7.02 0.19 -1.35 117.44 121.63 1wpx n TRP 688 Ca -0.11 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.25 1wpx n TRP 688 Cb 0.58 -3.84 -0.04 0.00 -2.42 0.00 0.00 31.31 25.59 1wpx n TRP 688 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1wpx n GLY 689 N -0.93 0.90 0.23 6.99 0.00 -0.07 -4.22 105.19 108.09 1wpx n GLY 689 Ca -0.24 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.47 1wpx n GLY 689 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wpx n TYR 690 N -3.05 0.00 0.00 1.61 4.01 -0.45 -4.59 117.16 114.69 1wpx n TYR 690 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1wpx n TYR 690 Cb 0.46 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1wpx n TYR 690 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wpx n GLY 691 N 1.42 1.45 3.76 2.72 0.00 -1.26 -4.95 105.19 108.33 1wpx n GLY 691 Ca 0.09 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1wpx n GLY 691 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wpx s THR 692 N 0.00 2.92 0.50 2.61 -4.23 -1.26 -5.00 115.64 111.18 1wpx s THR 692 Ca 0.00 0.53 -0.18 0.00 -1.18 0.00 0.00 61.69 60.86 1wpx s THR 692 Cb 0.00 -3.16 -0.08 0.00 1.34 0.00 0.00 72.50 70.60 1wpx s THR 692 CO 0.00 -0.16 0.99 -2.84 -0.54 0.00 0.00 174.62 172.07 1wpx s PRO 693 N -3.51 3.91 -1.24 3.99 0.02 -1.26 -4.19 135.00 132.72 1wpx s PRO 693 Ca 0.73 1.09 -0.05 0.00 0.02 0.00 0.00 61.00 62.80 1wpx s PRO 693 Cb -0.26 -2.13 0.01 0.00 0.02 0.00 0.00 34.50 32.14 1wpx s PRO 693 CO 0.33 -0.31 1.06 0.00 -0.33 0.00 0.00 177.00 177.76 1wpx n ALA 694 N -1.31 -1.57 -2.80 -1.55 0.00 -1.25 -5.00 120.51 107.04 1wpx n ALA 694 Ca 0.07 0.19 -0.17 0.00 0.00 0.00 0.00 53.44 53.54 1wpx n ALA 694 Cb 0.54 -4.01 -0.15 0.00 0.00 0.00 0.00 19.45 15.83 1wpx n ALA 694 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1wpx s THR 695 N -3.33 0.47 0.00 0.00 -4.23 -1.24 -4.99 115.64 102.32 1wpx s THR 695 Ca 0.31 -0.24 0.00 0.00 -1.18 0.00 0.00 61.69 60.58 1wpx s THR 695 Cb -0.14 -0.41 0.00 0.00 1.34 0.00 0.00 72.50 73.30 1wpx s THR 695 CO 0.70 0.14 0.00 0.61 -0.54 0.00 0.00 174.62 175.53 1wpx n GLY 696 N 3.01 0.70 0.38 3.99 0.00 -1.26 -4.28 105.19 107.73 1wpx n GLY 696 Ca -0.14 0.43 0.23 0.00 0.00 0.00 0.00 46.02 46.55 1wpx n GLY 696 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wpx h VAL 697 N 0.00 0.42 0.34 1.61 -1.51 -1.94 -0.81 116.25 114.36 1wpx h VAL 697 Ca 0.00 -0.13 -0.02 0.00 -1.23 0.00 0.00 66.70 65.32 1wpx h VAL 697 Cb 0.00 -0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.16 1wpx h VAL 697 CO 0.00 0.07 -0.16 1.23 -1.23 0.00 0.00 177.57 177.48 1wpx h GLY 698 N 0.39 -0.48 0.99 5.19 0.00 -1.91 0.21 103.07 107.46 1wpx h GLY 698 Ca 0.67 0.18 -0.03 0.00 0.00 0.00 0.00 47.33 48.15 1wpx h GLY 698 CO -0.43 -0.17 -0.29 1.70 0.00 0.00 0.00 176.54 177.34 1wpx h LYS 699 N -0.48 -0.77 -0.92 4.80 1.63 -1.56 -2.67 116.57 116.60 1wpx h LYS 699 Ca -0.05 0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.81 1wpx h LYS 699 Cb 0.37 0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 32.13 1wpx h LYS 699 CO 0.08 -0.51 0.60 2.35 -3.45 0.00 0.00 179.45 178.52 1wpx h TRP 700 N -0.80 1.17 -0.36 1.91 7.01 -1.23 -2.40 115.95 121.25 1wpx h TRP 700 Ca -0.08 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 60.86 1wpx h TRP 700 Cb 0.62 -0.39 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 1wpx h TRP 700 CO -0.04 0.74 -0.13 0.00 -2.79 0.00 0.00 178.44 176.22 1wpx h ALA 701 N 1.33 1.10 -0.06 2.65 0.00 -0.58 -3.04 119.26 120.67 1wpx h ALA 701 Ca 0.34 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1wpx h ALA 701 Cb -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1wpx h ALA 701 CO -0.07 0.56 -0.13 0.87 0.00 0.00 0.00 179.25 180.48 1wpx h LYS 702 N 0.58 0.19 0.00 0.00 1.79 -1.21 -1.26 116.57 116.67 1wpx h LYS 702 Ca 0.10 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1wpx h LYS 702 Cb 0.56 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1wpx h LYS 702 CO 0.04 0.72 0.00 -0.85 -1.08 0.00 0.00 179.45 178.27 1wpx n GLU 703 N -4.63 0.21 -0.01 3.15 0.28 -0.93 -1.84 120.64 116.87 1wpx n GLU 703 Ca -0.08 0.13 0.02 0.00 -0.16 0.00 0.00 57.16 57.07 1wpx n GLU 703 Cb 0.37 -1.50 0.03 0.00 1.43 0.00 0.00 31.44 31.77 1wpx n GLU 703 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1wpx n ASN 704 N -1.21 2.05 -3.95 -1.84 3.02 -1.15 -4.88 115.26 107.30 1wpx n ASN 704 Ca 0.06 -2.19 -0.30 0.00 -0.03 0.00 0.00 54.58 52.11 1wpx n ASN 704 Cb 0.08 -0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.18 1wpx n ASN 704 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1wpx n ASN 705 N -0.67 -4.09 -4.84 6.41 5.03 -0.77 -4.82 115.26 111.51 1wpx n ASN 705 Ca 0.03 -0.83 -0.35 0.00 0.87 0.00 0.00 54.58 54.30 1wpx n ASN 705 Cb 0.32 -3.67 -0.06 0.00 -1.02 0.00 0.00 39.78 35.35 1wpx n ASN 705 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1wpx s LEU 706 N -7.22 4.30 -0.32 3.41 1.43 -0.50 -4.37 118.68 115.41 1wpx s LEU 706 Ca 0.60 1.19 -0.08 0.00 -1.03 0.00 0.00 54.13 54.81 1wpx s LEU 706 Cb -0.31 -3.47 0.01 0.00 0.03 0.00 0.00 46.19 42.45 1wpx s LEU 706 CO 0.85 0.04 0.12 -1.58 0.23 0.00 0.00 176.35 176.01 1wpx s GLN 707 N -2.12 3.02 0.16 1.70 0.74 -0.65 -4.81 119.66 117.71 1wpx s GLN 707 Ca 0.42 -0.92 -0.32 0.00 0.05 0.00 0.00 55.36 54.59 1wpx s GLN 707 Cb -0.15 -3.50 -0.10 0.00 1.10 0.00 0.00 33.01 30.36 1wpx s GLN 707 CO 0.20 -0.52 1.62 -1.17 -0.55 0.00 0.00 175.29 174.86 1wpx s LEU 708 N 1.52 4.37 -0.03 3.68 0.20 -1.26 -0.17 118.68 126.99 1wpx s LEU 708 Ca 0.02 2.66 0.02 0.00 0.69 0.00 0.00 54.13 57.52 1wpx s LEU 708 Cb -0.18 -3.59 -0.03 0.00 -0.43 0.00 0.00 46.19 41.96 1wpx s LEU 708 CO 0.04 -0.87 -0.01 0.52 -0.29 0.00 0.00 176.35 175.75 1wpx n VAL 709 N 4.07 0.22 -3.77 1.68 0.31 0.81 -4.90 118.33 116.75 1wpx n VAL 709 Ca 0.15 -0.11 -0.09 0.00 -0.01 0.00 0.00 64.34 64.28 1wpx n VAL 709 Cb 0.38 -0.82 -0.03 0.00 -0.91 0.00 0.00 33.84 32.47 1wpx n VAL 709 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wpx s ALA 710 N -2.08 -1.14 -0.20 3.52 0.00 -1.14 -1.98 121.76 118.73 1wpx s ALA 710 Ca -0.03 -0.20 -0.27 0.00 0.00 0.00 0.00 51.96 51.46 1wpx s ALA 710 Cb 0.01 0.88 0.09 0.00 0.00 0.00 0.00 23.12 24.10 1wpx s ALA 710 CO 0.11 -0.93 0.80 0.45 0.00 0.00 0.00 175.76 176.19 1wpx s SER 711 N -2.89 -0.63 0.14 0.00 0.15 -1.26 -1.02 113.70 108.19 1wpx s SER 711 Ca 0.10 1.03 -0.02 0.00 0.70 0.00 0.00 55.95 57.76 1wpx s SER 711 Cb -0.04 0.99 -0.03 0.00 -1.71 0.00 0.00 66.02 65.22 1wpx s SER 711 CO 0.02 -0.33 0.10 0.21 1.20 0.00 0.00 173.24 174.43 1wpx s ASN 712 N -0.22 0.25 0.12 5.45 3.84 -0.91 -4.64 114.94 118.84 1wpx s ASN 712 Ca -0.02 -1.17 -0.25 0.00 0.21 0.00 0.00 52.86 51.63 1wpx s ASN 712 Cb -0.03 0.33 0.07 0.00 -0.55 0.00 0.00 41.25 41.06 1wpx s ASN 712 CO 0.02 -0.76 0.84 0.72 -2.79 0.00 0.00 177.10 175.13 1wpx s PHE 713 N -4.04 -0.27 0.24 0.43 -0.12 -1.26 -0.86 117.98 112.09 1wpx s PHE 713 Ca 0.24 0.01 -0.08 0.00 -0.05 0.00 0.00 56.93 57.05 1wpx s PHE 713 Cb 0.07 0.61 -0.01 0.00 -0.63 0.00 0.00 43.02 43.05 1wpx s PHE 713 CO 0.02 -0.80 0.37 -0.59 -0.05 0.00 0.00 175.22 174.17 1wpx s PHE 714 N -3.40 0.70 0.10 3.49 -0.12 -0.95 -0.48 117.98 117.32 1wpx s PHE 714 Ca 0.08 -1.00 0.08 0.00 -0.05 0.00 0.00 56.93 56.04 1wpx s PHE 714 Cb -0.02 -0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 1wpx s PHE 714 CO -0.03 -0.90 -0.16 0.71 -0.05 0.00 0.00 175.22 174.79 1wpx s TYR 715 N -3.95 2.59 -0.01 3.49 1.51 0.22 -1.39 117.35 119.81 1wpx s TYR 715 Ca 0.29 -0.23 -0.09 0.00 -1.01 0.00 0.00 57.07 56.03 1wpx s TYR 715 Cb 0.02 -1.39 0.01 0.00 -0.11 0.00 0.00 41.96 40.49 1wpx s TYR 715 CO 0.11 0.38 0.18 0.00 -1.11 0.00 0.00 175.55 175.10 1wpx s ALA 716 N -1.12 -0.43 0.00 3.71 0.00 -1.15 -0.80 121.76 121.97 1wpx s ALA 716 Ca 0.18 0.03 -0.14 0.00 0.00 0.00 0.00 51.96 52.04 1wpx s ALA 716 Cb -0.11 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.08 1wpx s ALA 716 CO 0.10 -0.20 0.29 -2.00 0.00 0.00 0.00 175.76 173.95 1wpx s GLU 717 N -1.19 0.69 -0.23 0.00 2.12 -1.26 -1.24 118.70 117.60 1wpx s GLU 717 Ca -0.13 -0.30 0.02 0.00 0.36 0.00 0.00 54.97 54.92 1wpx s GLU 717 Cb -0.06 0.30 0.05 0.00 0.26 0.00 0.00 34.13 34.67 1wpx s GLU 717 CO 0.02 -0.20 -0.14 0.99 -0.54 0.00 0.00 175.26 175.39 1wpx s THR 718 N -1.68 2.10 -2.96 -1.70 2.01 -1.26 -4.70 115.64 107.44 1wpx s THR 718 Ca -0.11 -1.36 0.24 0.00 0.31 0.00 0.00 61.69 60.77 1wpx s THR 718 Cb -0.04 -2.10 0.22 0.00 0.01 0.00 0.00 72.50 70.59 1wpx s THR 718 CO 0.02 0.18 1.30 0.29 -0.69 0.00 0.00 174.62 175.71