#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r4g h PRO 517 N 0.00 -0.10 0.00 -1.58 0.13 -2.05 -3.50 132.00 124.90 1r4g h PRO 517 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1r4g h PRO 517 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1r4g h PRO 517 CO 0.00 0.29 0.00 0.25 -0.23 0.00 0.00 178.00 178.31 1r4g n THR 518 N -4.95 0.00 0.13 1.56 -2.24 -1.26 -4.90 114.28 102.62 1r4g n THR 518 Ca -0.08 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.67 1r4g n THR 518 Cb 0.23 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.62 1r4g n THR 518 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1r4g h MET 519 N 0.00 0.06 -0.16 -0.78 4.05 -2.02 -3.04 114.93 113.05 1r4g h MET 519 Ca 0.00 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 1r4g h MET 519 Cb 0.00 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 1r4g h MET 519 CO 0.00 0.65 -0.01 0.45 0.23 0.00 0.00 176.91 178.22 1r4g h HIS 520 N 0.04 0.23 -0.14 1.39 3.86 -2.00 -2.49 115.15 116.04 1r4g h HIS 520 Ca -0.01 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1r4g h HIS 520 Cb 1.08 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.47 1r4g h HIS 520 CO 0.01 0.26 0.07 1.03 0.86 0.00 0.00 177.93 180.15 1r4g h SER 521 N 0.23 0.11 -0.65 2.45 0.87 -1.88 0.17 113.55 114.85 1r4g h SER 521 Ca 0.05 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.66 1r4g h SER 521 Cb 0.18 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.08 1r4g h SER 521 CO 0.00 0.09 0.38 0.25 -0.53 0.00 0.00 176.83 177.02 1r4g h LEU 522 N 0.16 0.59 -0.80 2.23 5.85 -1.57 0.18 115.31 121.96 1r4g h LEU 522 Ca 0.06 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.82 1r4g h LEU 522 Cb 0.01 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 1r4g h LEU 522 CO -0.04 0.40 0.51 -0.09 -0.34 0.00 0.00 178.44 178.88 1r4g h ARG 523 N 0.72 0.98 -0.75 1.25 2.43 -1.17 -1.15 114.38 116.70 1r4g h ARG 523 Ca 0.28 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.37 1r4g h ARG 523 Cb 0.11 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 1r4g h ARG 523 CO -0.15 0.65 0.37 1.25 -1.51 0.00 0.00 179.97 180.59 1r4g h LEU 524 N 1.01 0.96 -0.60 3.80 7.12 0.85 -0.04 115.31 128.42 1r4g h LEU 524 Ca 0.31 -0.10 -0.00 0.00 0.13 0.00 0.00 57.88 58.22 1r4g h LEU 524 Cb -0.02 -0.24 -0.03 0.00 -0.53 0.00 0.00 40.66 39.83 1r4g h LEU 524 CO -0.10 0.80 0.36 0.58 -0.13 0.00 0.00 178.44 179.95 1r4g h VAL 525 N 1.06 1.17 -0.09 1.05 2.07 0.44 -2.29 116.25 119.66 1r4g h VAL 525 Ca 0.26 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 1r4g h VAL 525 Cb 0.08 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1r4g h VAL 525 CO -0.04 0.18 0.05 0.40 0.02 0.00 0.00 177.57 178.18 1r4g h ILE 526 N 0.81 1.10 0.00 4.57 2.04 -0.63 -3.09 117.51 122.32 1r4g h ILE 526 Ca 0.21 -0.30 -0.49 0.00 1.00 0.00 0.00 64.86 65.28 1r4g h ILE 526 Cb -0.03 1.14 0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1r4g h ILE 526 CO -0.04 0.09 2.61 -0.62 0.00 0.00 0.00 178.15 180.19 1r4g n GLU 527 N -4.96 2.91 0.00 2.37 1.02 -0.09 -2.96 120.64 118.93 1r4g n GLU 527 Ca -0.06 -1.73 0.00 0.00 -0.02 0.00 0.00 57.16 55.35 1r4g n GLU 527 Cb 0.08 -2.52 0.00 0.00 -0.02 0.00 0.00 31.44 28.98 1r4g n GLU 527 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1r4g n SER 528 N 3.46 0.00 -4.01 1.62 2.88 -1.17 -4.85 113.62 111.55 1r4g n SER 528 Ca 0.62 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.84 1r4g n SER 528 Cb 0.35 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.69 1r4g n SER 528 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1r4g s SER 529 N -3.26 4.70 -0.45 -3.46 0.01 -1.16 -5.07 113.70 105.02 1r4g s SER 529 Ca 0.00 -2.70 -0.42 0.00 1.31 0.00 0.00 55.95 54.14 1r4g s SER 529 Cb 0.00 -1.70 -0.17 0.00 0.21 0.00 0.00 66.02 64.36 1r4g s SER 529 CO 0.00 -0.32 2.09 -2.65 0.41 0.00 0.00 173.24 172.77 1r4g n PRO 530 N 3.58 0.33 -3.16 12.44 -0.02 -1.26 -4.96 135.00 141.95 1r4g n PRO 530 Ca 0.05 0.09 -0.23 0.00 -2.02 0.00 0.00 63.50 61.39 1r4g n PRO 530 Cb 0.36 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 1r4g n PRO 530 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1r4g s LEU 531 N 5.98 3.81 0.00 2.45 1.43 -1.26 -5.11 118.68 125.97 1r4g s LEU 531 Ca 1.15 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.57 1r4g s LEU 531 Cb -1.32 -3.20 0.00 0.00 0.03 0.00 0.00 46.19 41.70 1r4g s LEU 531 CO 0.63 -0.53 0.00 -0.24 0.23 0.00 0.00 176.35 176.44 1r4g n SER 532 N -1.94 -0.04 -0.08 2.29 2.88 -1.26 -4.72 113.62 110.75 1r4g n SER 532 Ca -0.01 -0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.43 1r4g n SER 532 Cb 0.57 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.98 1r4g n SER 532 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1r4g h ARG 533 N 0.00 0.00 -0.25 -1.46 3.08 -1.99 -3.31 114.38 110.44 1r4g h ARG 533 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 1r4g h ARG 533 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 1r4g h ARG 533 CO 0.00 0.32 -0.33 0.00 -1.07 0.00 0.00 179.97 178.89 1r4g h ALA 534 N -0.82 0.38 0.06 0.04 0.00 -1.98 -2.06 119.26 114.88 1r4g h ALA 534 Ca -0.10 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 1r4g h ALA 534 Cb 0.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1r4g h ALA 534 CO -0.06 0.43 -0.03 0.93 0.00 0.00 0.00 179.25 180.51 1r4g h GLU 535 N 0.39 -0.08 0.04 0.00 4.39 -1.95 0.13 114.58 117.49 1r4g h GLU 535 Ca 0.03 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.75 1r4g h GLU 535 Cb 0.91 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.55 1r4g h GLU 535 CO 0.08 0.16 -0.15 -0.22 -1.16 0.00 0.00 179.01 177.72 1r4g h LYS 536 N -0.32 -0.26 0.28 2.33 3.64 -1.65 -1.61 116.57 118.99 1r4g h LYS 536 Ca -0.01 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1r4g h LYS 536 Cb 0.28 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1r4g h LYS 536 CO 0.01 -0.17 -0.32 0.00 -2.27 0.00 0.00 179.45 176.71 1r4g h ALA 537 N 0.65 -0.65 -0.22 5.00 0.00 -1.31 -0.09 119.26 122.64 1r4g h ALA 537 Ca 0.04 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1r4g h ALA 537 Cb 0.31 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 18.49 1r4g h ALA 537 CO -0.12 -0.91 -0.40 0.00 0.00 0.00 0.00 179.25 177.83 1r4g h ALA 538 N -0.09 -0.48 0.13 0.00 0.00 -0.55 0.68 119.26 118.94 1r4g h ALA 538 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1r4g h ALA 538 Cb 0.60 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1r4g h ALA 538 CO -0.08 -0.87 -0.06 -0.92 0.00 0.00 0.00 179.25 177.31 1r4g h TYR 539 N -0.42 -0.16 -0.46 0.00 3.20 -1.24 -2.66 116.97 115.23 1r4g h TYR 539 Ca 0.10 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.05 1r4g h TYR 539 Cb 0.60 0.05 -0.07 0.00 1.54 0.00 0.00 36.73 38.85 1r4g h TYR 539 CO -0.51 0.13 0.06 0.28 -1.64 0.00 0.00 178.16 176.47 1r4g h VAL 540 N -0.45 0.71 -0.70 1.81 2.07 -0.73 0.21 116.25 119.16 1r4g h VAL 540 Ca -0.02 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1r4g h VAL 540 Cb 0.36 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1r4g h VAL 540 CO 0.03 0.03 0.23 0.07 0.02 0.00 0.00 177.57 177.95 1r4g h LYS 541 N 0.18 1.08 -0.91 1.57 2.10 -0.92 0.16 116.57 119.83 1r4g h LYS 541 Ca 0.23 -0.23 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1r4g h LYS 541 Cb 0.32 -0.16 -0.04 0.00 -0.90 0.00 0.00 32.23 31.44 1r4g h LYS 541 CO -0.33 0.92 0.56 0.77 -2.00 0.00 0.00 179.45 179.37 1r4g h SER 542 N 1.02 1.08 -0.15 7.07 0.02 -0.92 0.39 113.55 122.06 1r4g h SER 542 Ca 0.23 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1r4g h SER 542 Cb 0.28 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1r4g h SER 542 CO -0.01 0.82 0.00 0.25 -1.14 0.00 0.00 176.83 176.76 1r4g h LEU 543 N 1.25 0.26 -1.92 5.07 5.85 -0.13 -2.55 115.31 123.14 1r4g h LEU 543 Ca 0.33 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1r4g h LEU 543 Cb -0.07 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1r4g h LEU 543 CO -0.06 0.50 -0.04 0.77 -0.34 0.00 0.00 178.44 179.27 1r4g h SER 544 N 0.02 0.00 0.00 1.25 4.64 -0.47 -2.01 113.55 116.98 1r4g h SER 544 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1r4g h SER 544 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1r4g h SER 544 CO 0.01 0.04 0.00 1.17 -0.87 0.00 0.00 176.83 177.18 1r4g n LYS 545 N -4.47 0.39 -0.29 4.77 4.81 0.08 -4.85 118.16 118.61 1r4g n LYS 545 Ca -0.03 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.12 1r4g n LYS 545 Cb 0.13 -1.08 0.28 0.00 0.02 0.00 0.00 35.03 34.38 1r4g n LYS 545 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1r4g n LYS 547 N -5.30 0.00 0.00 0.00 4.81 -1.26 -5.10 118.16 111.31 1r4g n LYS 547 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.55 1r4g n LYS 547 Cb 0.57 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.62 1r4g n LYS 547 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1r4g n THR 548 N -3.03 0.00 -0.01 3.15 5.66 -1.26 -5.11 114.28 113.68 1r4g n THR 548 Ca 0.00 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 60.96 1r4g n THR 548 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1r4g n THR 548 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1r4g n ASP 549 N 0.00 0.80 -0.33 1.09 8.00 -1.26 -4.54 116.55 120.31 1r4g n ASP 549 Ca 0.00 0.12 0.16 0.00 0.71 0.00 0.00 54.79 55.78 1r4g n ASP 549 Cb 0.00 -0.28 0.39 0.00 -0.02 0.00 0.00 41.12 41.20 1r4g n ASP 549 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1r4g h GLN 550 N -0.21 0.61 0.44 -1.24 4.20 -1.99 0.48 115.11 117.40 1r4g h GLN 550 Ca -0.08 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 1r4g h GLN 550 Cb 0.72 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1r4g h GLN 550 CO -0.05 0.41 -0.21 1.49 -0.67 0.00 0.00 178.83 179.79 1r4g h GLU 551 N 0.63 -0.57 -0.93 1.46 4.81 -2.01 -2.63 114.58 115.35 1r4g h GLU 551 Ca 0.58 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.89 1r4g h GLU 551 Cb 1.08 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.54 1r4g h GLU 551 CO -0.36 -0.26 0.61 0.28 -0.73 0.00 0.00 179.01 178.55 1r4g h VAL 552 N -0.94 1.15 -0.56 0.32 2.07 -1.62 -1.26 116.25 115.40 1r4g h VAL 552 Ca -0.06 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.09 1r4g h VAL 552 Cb 0.57 -0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 1r4g h VAL 552 CO 0.10 0.21 0.34 0.50 0.02 0.00 0.00 177.57 178.74 1r4g h LYS 553 N 1.15 0.65 -0.73 1.57 3.11 -0.95 0.12 116.57 121.50 1r4g h LYS 553 Ca 0.38 -0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 58.17 1r4g h LYS 553 Cb 0.04 -0.15 -0.04 0.00 -1.00 0.00 0.00 32.23 31.09 1r4g h LYS 553 CO -0.12 0.43 0.44 0.00 -2.81 0.00 0.00 179.45 177.39 1r4g h ALA 554 N 1.25 0.93 -0.15 5.00 0.00 -0.85 0.60 119.26 126.04 1r4g h ALA 554 Ca 0.23 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 1r4g h ALA 554 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1r4g h ALA 554 CO -0.10 0.40 -0.51 -0.24 0.00 0.00 0.00 179.25 178.80 1r4g h VAL 555 N 1.00 1.33 -0.60 0.00 3.04 -0.93 -2.29 116.25 117.80 1r4g h VAL 555 Ca 0.26 -1.76 -0.01 0.00 -1.01 0.00 0.00 66.70 64.18 1r4g h VAL 555 Cb -0.03 1.78 -0.03 0.00 -2.01 0.00 0.00 31.29 31.00 1r4g h VAL 555 CO -0.05 0.54 0.32 0.24 -1.01 0.00 0.00 177.57 177.61 1r4g h MET 556 N 0.33 0.84 -0.77 4.17 2.86 -0.25 -1.07 114.93 121.03 1r4g h MET 556 Ca 0.01 -0.10 0.09 0.00 -2.06 0.00 0.00 59.70 57.64 1r4g h MET 556 Cb 1.02 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.46 1r4g h MET 556 CO 0.09 0.64 0.51 1.49 1.06 0.00 0.00 176.91 180.70 1r4g h GLU 557 N 0.81 0.71 -0.43 1.72 4.57 -0.62 -0.31 114.58 121.03 1r4g h GLU 557 Ca 0.21 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.38 1r4g h GLU 557 Cb 0.05 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.45 1r4g h GLU 557 CO -0.03 0.47 0.22 1.25 -1.18 0.00 0.00 179.01 179.74 1r4g h LEU 558 N 0.73 0.33 -0.75 1.64 6.46 -0.63 -1.51 115.31 121.59 1r4g h LEU 558 Ca 0.35 0.02 0.15 0.00 -0.12 0.00 0.00 57.88 58.28 1r4g h LEU 558 Cb 0.40 -0.05 -0.10 0.00 -0.73 0.00 0.00 40.66 40.19 1r4g h LEU 558 CO -0.13 0.24 0.27 0.58 -0.62 0.00 0.00 178.44 178.78 1r4g h VAL 559 N 0.45 0.62 0.33 1.05 2.07 -0.67 0.15 116.25 120.25 1r4g h VAL 559 Ca 0.18 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1r4g h VAL 559 Cb 0.07 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 1r4g h VAL 559 CO -0.11 0.07 -0.20 -0.33 0.02 0.00 0.00 177.57 177.01 1r4g h GLU 560 N 0.39 -0.49 -0.81 1.57 4.39 -1.04 -2.50 114.58 116.10 1r4g h GLU 560 Ca 0.41 0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.11 1r4g h GLU 560 Cb 0.66 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.38 1r4g h GLU 560 CO -0.43 -0.33 0.36 0.93 -1.16 0.00 0.00 179.01 178.38 1r4g h GLU 561 N -0.51 1.18 -0.61 2.33 4.39 -0.86 -2.79 114.58 117.70 1r4g h GLU 561 Ca -0.03 -0.19 0.10 0.00 0.34 0.00 0.00 59.36 59.58 1r4g h GLU 561 Cb 0.43 -0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 28.80 1r4g h GLU 561 CO 0.03 0.92 0.22 0.22 -1.16 0.00 0.00 179.01 179.24 1r4g h ASP 562 N 1.16 0.20 -0.12 1.42 3.58 -0.53 -0.45 116.42 121.67 1r4g h ASP 562 Ca 0.27 0.08 -0.02 0.00 0.42 0.00 0.00 57.03 57.79 1r4g h ASP 562 Cb 0.16 0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.27 1r4g h ASP 562 CO -0.03 0.12 0.02 0.40 -2.88 0.00 0.00 179.24 176.87 1r4g h ILE 563 N 0.39 1.22 0.00 2.25 2.04 -1.20 0.77 117.51 122.99 1r4g h ILE 563 Ca 0.31 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1r4g h ILE 563 Cb 0.39 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1r4g h ILE 563 CO -0.32 0.21 0.00 -0.62 0.00 0.00 0.00 178.15 177.42 1r4g n GLU 564 N -4.82 0.06 -0.12 2.37 -0.58 -0.71 -0.40 120.64 116.44 1r4g n GLU 564 Ca -0.06 0.54 -0.25 0.00 -0.42 0.00 0.00 57.16 56.97 1r4g n GLU 564 Cb 0.18 -1.68 -0.11 0.00 -0.57 0.00 0.00 31.44 29.26 1r4g n GLU 564 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1r4g n SER 565 N -1.81 1.92 -0.09 1.62 7.64 -0.26 -3.15 113.62 119.49 1r4g n SER 565 Ca -0.00 0.36 0.07 0.00 1.01 0.00 0.00 58.87 60.31 1r4g n SER 565 Cb 0.03 -0.88 0.42 0.00 -1.01 0.00 0.00 64.21 62.77 1r4g n SER 565 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1r4g h LEU 566 N -0.92 0.51 0.18 -3.43 5.85 -0.07 -2.89 115.31 114.54 1r4g h LEU 566 Ca -0.52 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 1r4g h LEU 566 Cb 1.50 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.42 1r4g h LEU 566 CO -0.29 0.34 -0.08 0.71 -0.34 0.00 0.00 178.44 178.77 1r4g h THR 567 N 0.58 0.61 0.00 1.05 1.35 -0.90 -3.51 112.91 112.09 1r4g h THR 567 Ca 0.25 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1r4g h THR 567 Cb 0.24 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1r4g h THR 567 CO -0.07 0.17 0.00 -3.20 -0.25 0.00 0.00 175.52 172.17