#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2juh s VAL 562 N 0.00 -0.12 -0.05 0.52 0.11 -1.26 -5.18 120.40 114.42 2juh s VAL 562 Ca 0.00 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 58.89 2juh s VAL 562 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 2juh s VAL 562 CO 0.00 0.00 0.37 0.21 -3.33 0.00 0.00 175.10 172.35 2juh s ASN 563 N 1.66 -0.29 0.18 3.54 2.47 -1.26 -5.17 114.94 116.06 2juh s ASN 563 Ca -0.05 0.34 -0.24 0.00 0.42 0.00 0.00 52.86 53.32 2juh s ASN 563 Cb -0.03 0.47 0.05 0.00 -1.45 0.00 0.00 41.25 40.29 2juh s ASN 563 CO -0.14 -0.38 0.87 -1.58 -3.72 0.00 0.00 177.10 172.15 2juh s GLN 564 N -0.90 1.34 -0.13 0.43 0.74 -1.26 -5.05 119.66 114.82 2juh s GLN 564 Ca -0.10 -0.72 0.15 0.00 0.05 0.00 0.00 55.36 54.74 2juh s GLN 564 Cb -0.04 0.47 0.34 0.00 1.10 0.00 0.00 33.01 34.88 2juh s GLN 564 CO 0.04 -0.61 1.17 0.36 -0.55 0.00 0.00 175.29 175.70 2juh n LYS 565 N -0.45 1.10 -3.82 1.67 -0.00 -1.26 -5.05 118.16 110.35 2juh n LYS 565 Ca -0.06 -2.67 -0.33 0.00 -0.00 0.00 0.00 58.31 55.26 2juh n LYS 565 Cb 0.60 -1.23 -0.05 0.00 -0.00 0.00 0.00 35.03 34.36 2juh n LYS 565 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2juh s SER 566 N -2.73 6.43 -0.05 -5.58 0.01 -1.26 -5.00 113.70 105.52 2juh s SER 566 Ca 0.32 0.43 0.07 0.00 1.31 0.00 0.00 55.95 58.09 2juh s SER 566 Cb 0.31 -2.03 -0.11 0.00 0.21 0.00 0.00 66.02 64.40 2juh s SER 566 CO -0.05 0.19 0.09 2.29 0.41 0.00 0.00 173.24 176.17 2juh n LYS 567 N 0.62 1.79 -2.55 12.44 2.85 -1.26 -4.99 118.16 127.05 2juh n LYS 567 Ca -0.07 -0.03 -0.41 0.00 -1.05 0.00 0.00 58.31 56.74 2juh n LYS 567 Cb 0.52 -1.20 -0.04 0.00 -0.65 0.00 0.00 35.03 33.66 2juh n LYS 567 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 2juh s ARG 568 N -2.34 4.55 0.14 -1.58 3.52 -1.26 -5.05 118.95 116.94 2juh s ARG 568 Ca -0.04 1.64 0.10 0.00 -0.13 0.00 0.00 55.73 57.30 2juh s ARG 568 Cb 0.03 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 30.04 2juh s ARG 568 CO 0.33 -0.03 -0.18 -1.12 -0.81 0.00 0.00 175.30 173.49 2juh s SER 569 N 0.47 3.83 0.58 -2.12 0.01 -1.26 -5.12 113.70 110.09 2juh s SER 569 Ca 0.52 -0.63 -0.19 0.00 1.31 0.00 0.00 55.95 56.96 2juh s SER 569 Cb -0.27 -0.50 -0.04 0.00 0.21 0.00 0.00 66.02 65.42 2juh s SER 569 CO 0.31 0.15 1.16 -1.83 0.41 0.00 0.00 173.24 173.45 2juh s GLU 570 N -2.36 3.11 0.26 12.44 -1.05 -1.26 -5.04 118.70 124.80 2juh s GLU 570 Ca 0.19 1.69 -0.06 0.00 -0.15 0.00 0.00 54.97 56.65 2juh s GLU 570 Cb -0.10 -1.96 0.02 0.00 -0.44 0.00 0.00 34.13 31.65 2juh s GLU 570 CO 0.11 -1.06 0.44 1.28 0.95 0.00 0.00 175.26 176.97 2juh n LEU 571 N -1.55 0.00 -4.49 1.83 4.77 -1.26 -5.19 117.00 111.11 2juh n LEU 571 Ca 0.12 -1.86 -0.23 0.00 -0.03 0.00 0.00 56.01 54.01 2juh n LEU 571 Cb 0.50 2.18 -0.10 0.00 -2.33 0.00 0.00 43.42 43.67 2juh n LEU 571 CO 0.44 -0.52 -0.26 -0.44 -1.33 0.00 0.00 177.39 175.28 2juh s SER 572 N -2.45 2.66 0.24 -1.43 0.01 -1.26 -4.74 113.70 106.73 2juh s SER 572 Ca 0.15 -1.43 -0.04 0.00 1.31 0.00 0.00 55.95 55.94 2juh s SER 572 Cb -0.02 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.22 2juh s SER 572 CO 0.11 -0.65 0.38 0.00 0.41 0.00 0.00 173.24 173.50 2juh n GLN 573 N -0.77 0.55 0.00 12.44 1.13 -1.26 -5.13 117.38 124.35 2juh n GLN 573 Ca -0.04 -1.69 0.00 0.00 -1.94 0.00 0.00 57.00 53.34 2juh n GLN 573 Cb 0.66 1.77 0.00 0.00 0.11 0.00 0.00 30.24 32.78 2juh n GLN 573 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 2juh n ARG 574 N -0.37 0.00 -3.61 -1.09 3.00 -1.26 -4.84 116.66 108.49 2juh n ARG 574 Ca -0.02 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.56 2juh n ARG 574 Cb 0.38 -0.23 0.05 0.00 0.00 0.00 0.00 32.46 32.66 2juh n ARG 574 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2juh n ARG 575 N -2.01 -1.77 -2.91 -0.14 3.00 -1.26 -4.95 116.66 106.62 2juh n ARG 575 Ca 0.00 0.54 -0.35 0.00 -0.01 0.00 0.00 57.85 58.03 2juh n ARG 575 Cb 0.00 -4.53 -0.06 0.00 0.00 0.00 0.00 32.46 27.86 2juh n ARG 575 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2juh s ILE 576 N -3.48 4.40 0.24 0.55 2.07 -1.26 -4.98 121.20 118.73 2juh s ILE 576 Ca 0.42 1.51 0.03 0.00 -1.41 0.00 0.00 60.65 61.19 2juh s ILE 576 Cb -0.13 -3.83 -0.01 0.00 0.13 0.00 0.00 42.46 38.62 2juh s ILE 576 CO 0.84 0.00 0.11 0.54 -1.91 0.00 0.00 174.94 174.52 2juh n ARG 577 N 0.19 0.62 -4.31 3.50 1.74 -1.26 -5.09 116.66 112.05 2juh n ARG 577 Ca 0.02 -2.07 -0.23 0.00 -0.77 0.00 0.00 57.85 54.80 2juh n ARG 577 Cb 0.52 1.24 -0.07 0.00 -1.02 0.00 0.00 32.46 33.12 2juh n ARG 577 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2juh s ARG 578 N -2.91 2.23 -0.52 5.56 3.00 -1.26 -5.07 118.95 119.98 2juh s ARG 578 Ca 0.15 -1.45 -0.27 0.00 0.00 0.00 0.00 55.73 54.15 2juh s ARG 578 Cb 0.01 -2.12 -0.02 0.00 0.00 0.00 0.00 34.95 32.82 2juh s ARG 578 CO 0.11 0.36 1.81 -1.25 0.00 0.00 0.00 175.30 176.32 2juh s PRO 579 N -3.66 2.89 0.09 3.54 0.04 -1.26 -4.98 135.00 131.66 2juh s PRO 579 Ca 0.31 0.84 -0.13 0.00 0.04 0.00 0.00 61.00 62.07 2juh s PRO 579 Cb -0.06 -4.31 -0.06 0.00 0.04 0.00 0.00 34.50 30.11 2juh s PRO 579 CO 0.19 -2.41 0.47 -0.06 0.04 0.00 0.00 177.00 175.23 2juh s PHE 580 N 8.21 3.62 0.70 0.56 0.40 -1.26 -5.08 117.98 125.13 2juh s PHE 580 Ca 0.70 0.95 -0.12 0.00 -0.60 0.00 0.00 56.93 57.85 2juh s PHE 580 Cb -0.15 -2.27 0.02 0.00 0.51 0.00 0.00 43.02 41.12 2juh s PHE 580 CO 0.25 0.50 1.08 -1.12 0.70 0.00 0.00 175.22 176.63 2juh s SER 581 N -1.62 5.10 0.47 1.36 0.01 -1.26 -4.73 113.70 113.03 2juh s SER 581 Ca 0.33 1.76 0.19 0.00 1.31 0.00 0.00 55.95 59.54 2juh s SER 581 Cb -0.15 -2.52 1.17 0.00 0.21 0.00 0.00 66.02 64.74 2juh s SER 581 CO 0.18 -1.63 1.97 -0.37 0.41 0.00 0.00 173.24 173.80 2juh h VAL 582 N -0.60 0.81 -0.36 3.43 -1.51 -1.98 0.27 116.25 116.31 2juh h VAL 582 Ca -0.44 -0.09 -0.13 0.00 -1.23 0.00 0.00 66.70 64.81 2juh h VAL 582 Cb 1.22 0.53 -0.01 0.00 -2.13 0.00 0.00 31.29 30.91 2juh h VAL 582 CO 0.55 0.05 -0.29 0.00 -1.23 0.00 0.00 177.57 176.65 2juh h ALA 583 N 1.70 0.52 -0.05 5.19 0.00 -2.00 -2.04 119.26 122.58 2juh h ALA 583 Ca 0.29 -0.41 -0.22 0.00 0.00 0.00 0.00 54.91 54.57 2juh h ALA 583 Cb 0.80 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.49 2juh h ALA 583 CO -0.06 0.54 -0.83 0.93 0.00 0.00 0.00 179.25 179.83 2juh h GLU 584 N 0.62 0.65 -0.52 0.00 4.39 -1.52 -3.24 114.58 114.97 2juh h GLU 584 Ca 0.07 -0.63 -0.01 0.00 0.34 0.00 0.00 59.36 59.12 2juh h GLU 584 Cb 0.86 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.65 2juh h GLU 584 CO 0.07 1.24 0.27 0.28 -1.16 0.00 0.00 179.01 179.71 2juh h VAL 585 N 0.31 1.17 -0.87 3.13 2.07 -0.55 -1.99 116.25 119.51 2juh h VAL 585 Ca -0.09 -0.44 0.24 0.00 0.82 0.00 0.00 66.70 67.23 2juh h VAL 585 Cb 1.49 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 2juh h VAL 585 CO 0.17 0.19 0.62 1.05 0.02 0.00 0.00 177.57 179.61 2juh h GLU 586 N 0.73 0.05 -0.14 1.57 4.11 -1.38 -0.05 114.58 119.46 2juh h GLU 586 Ca 0.19 -0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.58 2juh h GLU 586 Cb 0.04 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2juh h GLU 586 CO -0.03 0.03 -0.03 0.00 0.07 0.00 0.00 179.01 179.05 2juh h ALA 587 N 1.58 0.20 -0.42 1.06 0.00 -1.50 0.36 119.26 120.53 2juh h ALA 587 Ca 0.42 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.15 2juh h ALA 587 Cb 1.59 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.28 2juh h ALA 587 CO -0.03 -0.05 0.15 1.25 0.00 0.00 0.00 179.25 180.57 2juh h LEU 588 N -0.03 0.17 0.42 0.00 7.12 -1.11 0.31 115.31 122.19 2juh h LEU 588 Ca 0.04 0.05 -0.02 0.00 0.13 0.00 0.00 57.88 58.07 2juh h LEU 588 Cb 0.46 0.03 0.00 0.00 -0.53 0.00 0.00 40.66 40.62 2juh h LEU 588 CO 0.01 0.13 -0.20 0.58 -0.13 0.00 0.00 178.44 178.83 2juh h VAL 589 N 0.32 0.42 -0.38 1.05 2.07 -1.46 -1.62 116.25 116.66 2juh h VAL 589 Ca 0.19 -0.56 0.11 0.00 0.82 0.00 0.00 66.70 67.26 2juh h VAL 589 Cb 0.18 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2juh h VAL 589 CO -0.19 0.08 0.33 -0.33 0.02 0.00 0.00 177.57 177.48 2juh h GLU 590 N -0.96 0.00 -0.00 1.57 4.39 -0.83 0.50 114.58 119.25 2juh h GLU 590 Ca -0.06 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.55 2juh h GLU 590 Cb 0.56 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2juh h GLU 590 CO 0.09 0.00 -0.37 0.00 -1.16 0.00 0.00 179.01 177.58 2juh h ALA 591 N 1.69 0.05 0.00 3.43 0.00 -0.28 -2.58 119.26 121.58 2juh h ALA 591 Ca 0.18 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 2juh h ALA 591 Cb 0.84 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2juh h ALA 591 CO -0.00 0.18 -0.41 -0.24 0.00 0.00 0.00 179.25 178.77 2juh h VAL 592 N -0.35 0.86 -0.14 0.00 3.04 -0.23 0.20 116.25 119.63 2juh h VAL 592 Ca -0.04 -1.74 -0.16 0.00 -1.01 0.00 0.00 66.70 63.74 2juh h VAL 592 Cb 1.11 2.09 0.01 0.00 -2.01 0.00 0.00 31.29 32.48 2juh h VAL 592 CO 0.07 0.41 -0.55 -0.33 -1.01 0.00 0.00 177.57 176.16 2juh h GLU 593 N 0.00 0.62 0.06 4.17 4.39 -0.12 0.51 114.58 124.21 2juh h GLU 593 Ca -0.00 -0.48 -0.18 0.00 0.34 0.00 0.00 59.36 59.04 2juh h GLU 593 Cb 1.06 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 2juh h GLU 593 CO 0.05 1.10 -0.90 0.45 -1.16 0.00 0.00 179.01 178.55 2juh h HIS 594 N 0.28 0.22 0.00 4.33 3.86 -1.46 -3.34 115.15 119.04 2juh h HIS 594 Ca -0.03 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2juh h HIS 594 Cb 1.18 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.65 2juh h HIS 594 CO 0.10 1.35 0.00 1.28 0.86 0.00 0.00 177.93 181.52 2juh n LEU 595 N -4.27 0.65 0.00 2.43 4.77 0.70 -5.04 117.00 116.25 2juh n LEU 595 Ca -0.21 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 2juh n LEU 595 Cb 0.72 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2juh n LEU 595 CO 0.34 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 2juh n GLY 596 N 1.33 -0.97 0.65 -0.72 0.00 0.18 -4.05 105.19 101.61 2juh n GLY 596 Ca 0.06 -1.66 0.05 0.00 0.00 0.00 0.00 46.02 44.47 2juh n GLY 596 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2juh n THR 597 N -1.09 0.53 -0.47 2.61 -2.24 -1.21 -3.61 114.28 108.80 2juh n THR 597 Ca 0.00 -0.43 0.04 0.00 -2.27 0.00 0.00 64.05 61.39 2juh n THR 597 Cb 0.00 0.10 0.06 0.00 -2.10 0.00 0.00 70.33 68.39 2juh n THR 597 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2juh n GLY 598 N 0.86 3.80 2.34 3.38 0.00 -1.26 -4.81 105.19 109.49 2juh n GLY 598 Ca 0.10 -0.49 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 2juh n GLY 598 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2juh n ARG 599 N -0.90 1.84 0.05 1.61 1.74 -1.24 -4.94 116.66 114.83 2juh n ARG 599 Ca 0.07 -4.11 -0.12 0.00 -0.77 0.00 0.00 57.85 52.92 2juh n ARG 599 Cb 0.42 -1.85 -0.07 0.00 -1.02 0.00 0.00 32.46 29.94 2juh n ARG 599 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 2juh h TRP 600 N 4.06 -0.05 -0.51 -1.55 6.55 -1.87 0.01 115.95 122.60 2juh h TRP 600 Ca 0.15 -0.00 0.09 0.00 0.95 0.00 0.00 58.89 60.08 2juh h TRP 600 Cb 0.74 0.02 -0.08 0.00 -0.86 0.00 0.00 29.16 28.98 2juh h TRP 600 CO 0.59 -0.03 0.06 0.00 -1.05 0.00 0.00 178.44 178.01 2juh h ARG 601 N -0.05 0.18 -0.48 0.49 3.08 -1.95 0.24 114.38 115.89 2juh h ARG 601 Ca -0.00 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2juh h ARG 601 Cb 0.04 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2juh h ARG 601 CO 0.00 0.12 -0.01 -0.44 -1.07 0.00 0.00 179.97 178.57 2juh h ASP 602 N 0.18 0.77 0.07 7.04 5.19 -1.91 -2.54 116.42 125.22 2juh h ASP 602 Ca 0.26 -0.19 -0.06 0.00 -0.62 0.00 0.00 57.03 56.42 2juh h ASP 602 Cb 0.38 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 2juh h ASP 602 CO -0.38 0.84 -0.18 0.58 -3.12 0.00 0.00 179.24 176.98 2juh h VAL 603 N 0.74 1.20 -0.02 -1.35 2.07 0.48 0.30 116.25 119.67 2juh h VAL 603 Ca 0.14 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 2juh h VAL 603 Cb 0.46 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2juh h VAL 603 CO 0.02 0.28 -0.01 0.11 0.02 0.00 0.00 177.57 177.99 2juh h LYS 604 N 0.21 0.05 -0.02 1.57 1.57 -0.60 0.15 116.57 119.49 2juh h LYS 604 Ca 0.04 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.64 2juh h LYS 604 Cb 0.45 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 2juh h LYS 604 CO 0.03 0.45 -0.69 0.52 -0.57 0.00 0.00 179.45 179.19 2juh h MET 605 N -0.36 0.12 -0.16 3.15 2.86 -1.37 0.25 114.93 119.43 2juh h MET 605 Ca 0.01 -0.10 -0.20 0.00 -2.06 0.00 0.00 59.70 57.35 2juh h MET 605 Cb 0.44 0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.13 2juh h MET 605 CO 0.00 0.76 -0.67 -0.09 1.06 0.00 0.00 176.91 177.98 2juh h ARG 606 N 0.08 0.74 0.00 1.72 9.65 -0.40 -3.41 114.38 122.77 2juh h ARG 606 Ca -0.01 -0.58 0.00 0.00 -1.10 0.00 0.00 59.98 58.29 2juh h ARG 606 Cb 1.23 0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.92 2juh h ARG 606 CO 0.10 1.19 0.00 0.00 2.80 0.00 0.00 179.97 184.06 2juh n ALA 607 N -2.59 0.00 -2.23 2.80 0.00 0.51 -4.89 120.51 114.11 2juh n ALA 607 Ca -0.07 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 2juh n ALA 607 Cb 0.69 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.11 2juh n ALA 607 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2juh s PHE 608 N -0.99 2.87 0.23 0.00 0.40 0.89 -4.91 117.98 116.47 2juh s PHE 608 Ca 0.00 0.83 0.02 0.00 -0.60 0.00 0.00 56.93 57.18 2juh s PHE 608 Cb 0.00 -3.66 0.22 0.00 0.51 0.00 0.00 43.02 40.09 2juh s PHE 608 CO 0.00 -2.42 1.55 0.22 0.70 0.00 0.00 175.22 175.27 2juh h ASP 609 N 7.81 0.39 -2.80 1.36 3.58 -1.82 -3.35 116.42 121.58 2juh h ASP 609 Ca -0.38 -0.21 -0.69 0.00 0.42 0.00 0.00 57.03 56.17 2juh h ASP 609 Cb 1.18 -0.11 -0.36 0.00 1.72 0.00 0.00 39.33 41.75 2juh h ASP 609 CO 0.90 0.87 -0.09 0.59 -2.88 0.00 0.00 179.24 178.63 2juh n ASN 610 N -3.91 4.51 -3.15 2.28 4.13 -1.26 -4.90 115.26 112.94 2juh n ASN 610 Ca -0.03 -3.32 -0.34 0.00 1.68 0.00 0.00 54.58 52.58 2juh n ASN 610 Cb 0.60 -0.95 -0.00 0.00 -1.54 0.00 0.00 39.78 37.89 2juh n ASN 610 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2juh n ALA 611 N 1.51 5.45 -0.01 5.41 0.00 -1.26 -4.79 120.51 126.82 2juh n ALA 611 Ca 0.26 -4.57 -0.00 0.00 0.00 0.00 0.00 53.44 49.13 2juh n ALA 611 Cb 0.37 -1.40 -0.00 0.00 0.00 0.00 0.00 19.45 18.43 2juh n ALA 611 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2juh h ASP 612 N 3.41 -0.01 -0.42 0.00 3.58 -1.95 -3.40 116.42 117.63 2juh h ASP 612 Ca 0.35 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.59 2juh h ASP 612 Cb 0.43 0.00 -0.13 0.00 1.72 0.00 0.00 39.33 41.35 2juh h ASP 612 CO 1.03 0.16 -0.00 1.57 -2.88 0.00 0.00 179.24 179.12 2juh n HIS 613 N -2.97 1.30 -2.39 0.28 -0.00 -1.26 -5.02 115.22 105.16 2juh n HIS 613 Ca -0.00 -1.63 -0.32 0.00 0.46 0.00 0.00 57.72 56.24 2juh n HIS 613 Cb 0.00 -0.54 -0.03 0.00 -0.12 0.00 0.00 29.99 29.31 2juh n HIS 613 CO 0.00 0.00 0.00 0.50 0.46 0.00 0.00 176.34 177.30 2juh s ARG 614 N -3.25 3.86 0.53 1.57 3.52 -1.26 -5.06 118.95 118.85 2juh s ARG 614 Ca 0.46 0.83 -0.08 0.00 -0.13 0.00 0.00 55.73 56.81 2juh s ARG 614 Cb 0.41 -2.17 -0.04 0.00 -1.56 0.00 0.00 34.95 31.59 2juh s ARG 614 CO 0.01 -0.28 0.89 -0.08 -0.81 0.00 0.00 175.30 175.03 2juh s THR 615 N -2.67 4.81 -0.31 4.11 -1.32 -1.26 -4.99 115.64 114.01 2juh s THR 615 Ca 0.57 0.52 0.23 0.00 -1.21 0.00 0.00 61.69 61.80 2juh s THR 615 Cb -0.10 -3.86 0.10 0.00 -1.51 0.00 0.00 72.50 67.13 2juh s THR 615 CO 0.35 -0.95 1.21 0.10 -2.21 0.00 0.00 174.62 173.13 2juh h TYR 616 N 0.09 0.00 -0.09 9.09 -0.00 -1.97 -3.32 116.97 120.76 2juh h TYR 616 Ca -0.46 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.13 2juh h TYR 616 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.92 2juh h TYR 616 CO 0.62 0.00 -0.56 -0.24 -0.00 0.00 0.00 178.16 177.98 2juh h VAL 617 N 0.00 1.36 -0.35 -0.90 3.04 -1.98 -2.87 116.25 114.55 2juh h VAL 617 Ca 0.00 -1.86 0.07 0.00 -1.01 0.00 0.00 66.70 63.90 2juh h VAL 617 Cb 0.99 1.91 -0.07 0.00 -2.01 0.00 0.00 31.29 32.10 2juh h VAL 617 CO 0.00 0.56 -0.13 0.44 -1.01 0.00 0.00 177.57 177.42 2juh h ASP 618 N 0.22 -0.46 0.45 3.17 5.19 -1.99 0.99 116.42 123.99 2juh h ASP 618 Ca 0.00 0.12 -0.12 0.00 -0.62 0.00 0.00 57.03 56.41 2juh h ASP 618 Cb 1.05 0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.81 2juh h ASP 618 CO 0.09 -0.17 -0.55 0.17 -3.12 0.00 0.00 179.24 175.67 2juh h LEU 619 N -0.06 0.12 -0.91 1.55 8.10 -1.76 -2.72 115.31 119.63 2juh h LEU 619 Ca 0.18 -0.06 -0.07 0.00 0.11 0.00 0.00 57.88 58.04 2juh h LEU 619 Cb 0.33 -0.03 -0.02 0.00 -0.44 0.00 0.00 40.66 40.49 2juh h LEU 619 CO -0.40 0.64 0.07 0.50 -4.11 0.00 0.00 178.44 175.14 2juh h LYS 620 N 0.08 0.87 -0.11 0.17 3.11 -0.95 -2.31 116.57 117.44 2juh h LYS 620 Ca -0.00 -0.21 -0.08 0.00 -2.81 0.00 0.00 60.65 57.54 2juh h LYS 620 Cb 0.99 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 32.11 2juh h LYS 620 CO 0.08 0.83 -0.25 0.22 -2.81 0.00 0.00 179.45 177.51 2juh h ASP 621 N 0.83 0.42 -0.81 4.20 3.58 -0.74 -1.09 116.42 122.80 2juh h ASP 621 Ca 0.17 -0.57 0.10 0.00 0.42 0.00 0.00 57.03 57.14 2juh h ASP 621 Cb 0.39 -0.12 -0.07 0.00 1.72 0.00 0.00 39.33 41.25 2juh h ASP 621 CO 0.01 0.91 0.45 0.50 -2.88 0.00 0.00 179.24 178.24 2juh h LYS 622 N -0.06 0.74 -0.10 0.28 3.64 -1.38 0.84 116.57 120.53 2juh h LYS 622 Ca -0.00 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.21 2juh h LYS 622 Cb 0.85 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 32.51 2juh h LYS 622 CO 0.06 0.49 -0.45 2.35 -2.27 0.00 0.00 179.45 179.63 2juh h TRP 623 N 0.76 0.63 -0.57 1.91 7.01 -1.43 -1.89 115.95 122.36 2juh h TRP 623 Ca 0.39 -0.28 0.06 0.00 2.11 0.00 0.00 58.89 61.17 2juh h TRP 623 Cb 0.37 -0.10 -0.05 0.00 -2.10 0.00 0.00 29.16 27.28 2juh h TRP 623 CO -0.07 1.04 0.29 -0.22 -2.79 0.00 0.00 178.44 176.69 2juh h LYS 624 N 0.04 0.52 0.00 2.65 3.11 -0.64 -1.35 116.57 120.92 2juh h LYS 624 Ca -0.03 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.66 2juh h LYS 624 Cb 1.09 -0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 32.19 2juh h LYS 624 CO 0.09 0.35 -0.55 0.00 -2.81 0.00 0.00 179.45 176.53 2juh h THR 625 N 0.54 1.30 0.45 1.00 1.03 -0.90 -2.72 112.91 113.61 2juh h THR 625 Ca 0.26 -1.96 -0.02 0.00 -0.01 0.00 0.00 66.41 64.68 2juh h THR 625 Cb 0.19 2.09 0.00 0.00 -1.07 0.00 0.00 68.15 69.36 2juh h THR 625 CO -0.19 0.54 -0.21 0.25 -0.01 0.00 0.00 175.52 175.90 2juh h LEU 626 N 0.00 -0.51 -0.51 0.00 6.46 -0.43 -1.30 115.31 119.03 2juh h LEU 626 Ca -0.01 -0.08 0.01 0.00 -0.12 0.00 0.00 57.88 57.69 2juh h LEU 626 Cb 1.04 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 41.07 2juh h LEU 626 CO 0.07 -0.21 0.33 1.62 -0.62 0.00 0.00 178.44 179.63 2juh h VAL 627 N -0.80 1.11 0.00 1.05 3.04 -1.34 -1.41 116.25 117.89 2juh h VAL 627 Ca -0.06 -0.23 -0.01 0.00 -1.01 0.00 0.00 66.70 65.39 2juh h VAL 627 Cb 0.55 0.39 -0.00 0.00 -2.01 0.00 0.00 31.29 30.22 2juh h VAL 627 CO 0.10 0.12 -0.04 0.45 -1.01 0.00 0.00 177.57 177.19 2juh h HIS 628 N 0.66 0.00 0.00 3.17 3.86 -1.47 -1.35 115.15 120.02 2juh h HIS 628 Ca 0.19 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.22 2juh h HIS 628 Cb -0.05 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.39 2juh h HIS 628 CO -0.05 0.04 -0.86 1.15 0.86 0.00 0.00 177.93 179.08 2juh h THR 629 N 0.00 1.55 -0.33 2.45 2.02 -0.17 -2.72 112.91 115.70 2juh h THR 629 Ca -0.00 -3.01 0.06 0.00 0.77 0.00 0.00 66.41 64.23 2juh h THR 629 Cb 0.10 2.66 -0.06 0.00 -1.74 0.00 0.00 68.15 69.11 2juh h THR 629 CO 0.01 0.84 -0.05 0.00 0.37 0.00 0.00 175.52 176.69 2juh h ALA 630 N 1.14 0.26 0.00 6.16 0.00 -0.57 -3.43 119.26 122.81 2juh h ALA 630 Ca -0.01 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2juh h ALA 630 Cb 1.59 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2juh h ALA 630 CO 0.11 -0.44 0.00 0.45 0.00 0.00 0.00 179.25 179.37 2juh n SER 631 N -5.23 0.00 0.00 0.00 2.88 -1.23 -5.04 113.62 105.00 2juh n SER 631 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2juh n SER 631 Cb 0.18 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 2juh n SER 631 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2juh n ILE 632 N 0.00 0.00 -4.07 2.46 -0.00 -1.03 -5.03 119.36 111.69 2juh n ILE 632 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 62.75 62.40 2juh n ILE 632 Cb 0.00 -0.43 -0.09 0.00 -0.00 0.00 0.00 39.64 39.13 2juh n ILE 632 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2juh s ALA 633 N -2.00 3.51 0.32 -1.39 0.00 -1.21 -5.00 121.76 115.98 2juh s ALA 633 Ca 0.00 -0.73 0.12 0.00 0.00 0.00 0.00 51.96 51.35 2juh s ALA 633 Cb 0.00 -1.82 0.55 0.00 0.00 0.00 0.00 23.12 21.85 2juh s ALA 633 CO 0.00 0.41 1.72 -1.00 0.00 0.00 0.00 175.76 176.89 2juh h PRO 634 N 5.82 0.00 0.00 0.00 0.13 -1.98 -2.66 132.00 133.31 2juh h PRO 634 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2juh h PRO 634 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2juh h PRO 634 CO 0.63 0.49 0.00 0.00 -0.23 0.00 0.00 178.00 178.89 2juh n GLN 635 N -3.95 0.16 0.00 0.86 10.64 -1.26 -2.70 117.38 121.13 2juh n GLN 635 Ca -0.02 0.22 0.16 0.00 -1.83 0.00 0.00 57.00 55.53 2juh n GLN 635 Cb 0.51 -1.72 0.88 0.00 -0.86 0.00 0.00 30.24 29.06 2juh n GLN 635 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2juh n GLN 636 N -1.99 0.81 -2.96 2.61 1.13 -1.00 -4.80 117.38 111.17 2juh n GLN 636 Ca 0.05 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.71 2juh n GLN 636 Cb 0.33 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 29.13 2juh n GLN 636 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 2juh s ARG 637 N -2.18 4.51 -0.00 -1.09 1.70 -1.10 -4.82 118.95 115.97 2juh s ARG 637 Ca 0.42 1.10 0.04 0.00 -0.47 0.00 0.00 55.73 56.81 2juh s ARG 637 Cb 0.21 -3.36 -0.05 0.00 -0.57 0.00 0.00 34.95 31.18 2juh s ARG 637 CO 0.40 0.28 0.11 0.54 -1.08 0.00 0.00 175.30 175.55 2juh n ARG 638 N 2.78 2.17 0.00 3.89 5.12 -1.26 -5.01 116.66 124.35 2juh n ARG 638 Ca -0.02 -0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.88 2juh n ARG 638 Cb 0.50 -0.94 0.00 0.00 -1.16 0.00 0.00 32.46 30.86 2juh n ARG 638 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2juh n GLY 639 N 1.85 2.84 3.39 -0.13 0.00 -1.26 -5.03 105.19 106.85 2juh n GLY 639 Ca -0.00 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2juh n GLY 639 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2juh n GLU 640 N 0.00 -0.39 -2.16 1.61 1.02 -1.26 -4.86 120.64 114.60 2juh n GLU 640 Ca 0.00 -0.07 -0.42 0.00 -0.02 0.00 0.00 57.16 56.64 2juh n GLU 640 Cb 0.00 -1.82 -0.03 0.00 -0.02 0.00 0.00 31.44 29.57 2juh n GLU 640 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2juh s PRO 641 N -3.58 4.22 -0.07 3.49 0.04 -1.26 -5.02 135.00 132.83 2juh s PRO 641 Ca 0.56 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.64 2juh s PRO 641 Cb -0.20 -3.80 0.01 0.00 0.04 0.00 0.00 34.50 30.55 2juh s PRO 641 CO 0.68 -0.73 -0.15 0.54 0.04 0.00 0.00 177.00 177.38 2juh s VAL 642 N 3.38 1.34 0.08 -0.36 0.11 -1.26 -4.99 120.40 118.69 2juh s VAL 642 Ca 0.66 -0.61 -0.31 0.00 -2.93 0.00 0.00 61.98 58.79 2juh s VAL 642 Cb -0.30 -1.19 -0.07 0.00 -1.53 0.00 0.00 36.38 33.28 2juh s VAL 642 CO 0.25 0.40 1.38 -2.16 -3.33 0.00 0.00 175.10 171.64 2juh s PRO 643 N 0.47 4.32 0.52 1.54 0.04 -1.26 -4.91 135.00 135.72 2juh s PRO 643 Ca -0.13 2.03 0.32 0.00 0.04 0.00 0.00 61.00 63.26 2juh s PRO 643 Cb -0.15 -3.34 1.26 0.00 0.04 0.00 0.00 34.50 32.30 2juh s PRO 643 CO 0.04 -0.46 1.93 0.37 0.04 0.00 0.00 177.00 178.92 2juh h GLN 644 N 7.09 0.00 -0.31 4.56 4.15 -1.99 -2.86 115.11 125.75 2juh h GLN 644 Ca -0.41 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 58.85 2juh h GLN 644 Cb 1.20 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.89 2juh h GLN 644 CO 0.87 0.00 -0.43 0.22 -1.93 0.00 0.00 178.83 177.56 2juh h ASP 645 N 0.00 0.86 -0.02 -0.69 3.58 -1.98 -0.54 116.42 117.64 2juh h ASP 645 Ca 0.00 -0.41 -0.17 0.00 0.42 0.00 0.00 57.03 56.87 2juh h ASP 645 Cb 0.54 -0.24 0.01 0.00 1.72 0.00 0.00 39.33 41.36 2juh h ASP 645 CO 0.00 1.17 -0.66 -0.07 -2.88 0.00 0.00 179.24 176.80 2juh h LEU 646 N 0.64 0.61 -0.57 2.28 3.38 -1.93 -1.33 115.31 118.39 2juh h LEU 646 Ca 0.04 -0.74 -0.07 0.00 0.09 0.00 0.00 57.88 57.20 2juh h LEU 646 Cb 1.00 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2juh h LEU 646 CO 0.10 1.26 0.08 -0.07 0.09 0.00 0.00 178.44 179.91 2juh h LEU 647 N 0.01 0.92 -0.53 1.67 3.38 -1.54 0.23 115.31 119.45 2juh h LEU 647 Ca -0.08 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.47 2juh h LEU 647 Cb 1.35 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 2juh h LEU 647 CO 0.13 0.95 -0.60 -0.78 0.09 0.00 0.00 178.44 178.23 2juh h ASP 648 N 0.85 0.51 -0.02 -0.43 3.58 -1.16 -2.70 116.42 117.04 2juh h ASP 648 Ca 0.17 -0.29 -0.03 0.00 0.42 0.00 0.00 57.03 57.31 2juh h ASP 648 Cb 0.43 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2juh h ASP 648 CO 0.01 0.99 -0.09 0.03 -2.88 0.00 0.00 179.24 177.31 2juh h ARG 649 N 0.33 0.10 -0.54 0.28 2.47 -1.04 -2.61 114.38 113.37 2juh h ARG 649 Ca -0.00 -0.08 0.08 0.00 -1.26 0.00 0.00 59.98 58.72 2juh h ARG 649 Cb 1.14 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 29.44 2juh h ARG 649 CO 0.11 0.72 0.36 -0.24 0.56 0.00 0.00 179.97 181.48 2juh h VAL 650 N -0.50 0.92 -0.22 2.04 3.04 -0.61 -1.57 116.25 119.36 2juh h VAL 650 Ca -0.00 -0.14 -0.19 0.00 -1.01 0.00 0.00 66.70 65.36 2juh h VAL 650 Cb 0.73 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 30.51 2juh h VAL 650 CO 0.02 0.07 -0.60 -0.07 -1.01 0.00 0.00 177.57 175.98 2juh h LEU 651 N 0.40 0.91 -0.16 3.16 4.07 -1.48 -0.58 115.31 121.63 2juh h LEU 651 Ca 0.25 -0.58 0.04 0.00 0.08 0.00 0.00 57.88 57.67 2juh h LEU 651 Cb 0.45 -0.26 -0.05 0.00 1.08 0.00 0.00 40.66 41.88 2juh h LEU 651 CO -0.06 1.32 -0.14 0.00 -1.08 0.00 0.00 178.44 178.48 2juh h ALA 652 N 0.61 -0.03 -0.07 1.53 0.00 -0.89 0.30 119.26 120.71 2juh h ALA 652 Ca -0.01 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2juh h ALA 652 Cb 1.22 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2juh h ALA 652 CO 0.13 -0.58 -0.19 0.00 0.00 0.00 0.00 179.25 178.61 2juh h ALA 653 N 0.94 0.12 -0.77 0.00 0.00 -1.54 0.95 119.26 118.95 2juh h ALA 653 Ca 0.10 -0.38 0.11 0.00 0.00 0.00 0.00 54.91 54.75 2juh h ALA 653 Cb 0.31 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 2juh h ALA 653 CO -0.26 0.06 0.39 1.25 0.00 0.00 0.00 179.25 180.70 2juh h HIS 654 N -0.25 0.70 0.03 0.00 6.17 -0.92 0.22 115.15 121.10 2juh h HIS 654 Ca -0.00 0.03 -0.09 0.00 0.71 0.00 0.00 60.37 61.02 2juh h HIS 654 Cb 0.80 -0.20 0.01 0.00 2.52 0.00 0.00 27.41 30.54 2juh h HIS 654 CO 0.12 0.22 -0.35 0.00 0.71 0.00 0.00 177.93 178.63 2juh h ALA 655 N 1.48 0.01 -0.28 5.26 0.00 -0.44 -1.74 119.26 123.55 2juh h ALA 655 Ca 0.39 -0.53 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2juh h ALA 655 Cb 0.46 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 2juh h ALA 655 CO -0.30 0.15 -0.09 -0.92 0.00 0.00 0.00 179.25 178.09 2juh h TYR 656 N -0.53 -0.20 -0.10 0.00 3.20 -0.44 -1.66 116.97 117.24 2juh h TYR 656 Ca -0.05 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.71 2juh h TYR 656 Cb 1.16 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.55 2juh h TYR 656 CO 0.20 -0.15 -0.54 -1.49 -1.64 0.00 0.00 178.16 174.54 2juh h TRP 657 N -0.03 0.37 -0.49 -3.82 4.06 -0.69 -3.00 115.95 112.36 2juh h TRP 657 Ca 0.14 -0.13 0.09 0.00 2.06 0.00 0.00 58.89 61.05 2juh h TRP 657 Cb 0.24 -0.07 -0.03 0.00 -1.00 0.00 0.00 29.16 28.30 2juh h TRP 657 CO -0.29 0.77 0.33 1.03 -3.56 0.00 0.00 178.44 176.73 2juh h SER 658 N 0.23 0.26 -0.14 -3.49 0.87 -0.41 0.31 113.55 111.18 2juh h SER 658 Ca 0.00 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.61 2juh h SER 658 Cb 1.03 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 2juh h SER 658 CO 0.09 0.16 0.18 -0.61 -0.53 0.00 0.00 176.83 176.12 2juh h GLN 659 N 0.30 0.00 0.05 2.24 4.15 -1.23 -2.33 115.11 118.28 2juh h GLN 659 Ca 0.22 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.37 2juh h GLN 659 Cb 0.49 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.16 2juh h GLN 659 CO -0.05 0.00 -1.46 1.96 -1.93 0.00 0.00 178.83 177.35 2juh h GLN 660 N 0.00 0.11 -4.69 1.69 4.20 -1.11 -3.48 115.11 111.82 2juh h GLN 660 Ca 0.06 -0.18 -0.31 0.00 0.06 0.00 0.00 58.65 58.29 2juh h GLN 660 Cb 0.43 0.07 -0.22 0.00 0.30 0.00 0.00 27.48 28.05 2juh h GLN 660 CO -0.00 1.09 -0.75 -0.65 -0.67 0.00 0.00 178.83 177.85 2juh s GLN 661 N -2.43 0.58 0.42 1.46 -0.21 -0.88 -5.17 119.66 113.44 2juh s GLN 661 Ca -0.26 -0.73 0.07 0.00 0.02 0.00 0.00 55.36 54.47 2juh s GLN 661 Cb 0.06 -0.41 -0.03 0.00 1.00 0.00 0.00 33.01 33.62 2juh s GLN 661 CO 0.67 0.08 0.30 0.20 -2.12 0.00 0.00 175.29 174.42 2juh s GLY 662 N -1.44 2.22 -0.28 3.09 0.00 -1.26 -4.17 107.32 105.49 2juh s GLY 662 Ca -0.07 -1.96 -0.27 0.00 0.00 0.00 0.00 44.72 42.42 2juh s GLY 662 CO 0.01 -1.79 1.31 1.25 0.00 0.00 0.00 173.10 173.88 2juh s LYS 663 N -4.05 0.18 0.23 2.90 2.36 -1.26 -5.14 119.74 114.96 2juh s LYS 663 Ca 0.45 0.13 0.00 0.00 -2.55 0.00 0.00 55.97 54.01 2juh s LYS 663 Cb -0.00 0.09 -0.04 0.00 -1.05 0.00 0.00 37.83 36.82 2juh s LYS 663 CO 0.26 -0.04 0.12 1.14 1.55 0.00 0.00 175.35 178.37 2juh s GLN 664 N -0.40 1.32 -0.12 4.03 -2.07 -1.26 -5.17 119.66 115.98 2juh s GLN 664 Ca 0.06 -1.70 -0.33 0.00 -1.82 0.00 0.00 55.36 51.57 2juh s GLN 664 Cb -0.03 0.02 0.13 0.00 -1.09 0.00 0.00 33.01 32.04 2juh s GLN 664 CO -0.10 -0.35 1.23 -1.58 -1.32 0.00 0.00 175.29 173.16 2juh s HIS 665 N -3.95 -0.10 0.32 9.60 2.46 -1.26 -5.18 115.29 117.17 2juh s HIS 665 Ca 0.38 0.03 0.01 0.00 0.47 0.00 0.00 55.06 55.95 2juh s HIS 665 Cb 0.07 0.53 0.06 0.00 -0.13 0.00 0.00 32.58 33.11 2juh s HIS 665 CO 0.13 -0.25 0.44 1.33 -2.47 0.00 0.00 174.74 173.93 2juh n VAL 666 N -0.24 0.00 -4.26 0.89 0.24 -1.26 -5.13 118.33 108.57 2juh n VAL 666 Ca -0.03 -0.76 -0.16 0.00 -2.04 0.00 0.00 64.34 61.35 2juh n VAL 666 Cb 0.60 -1.08 -0.10 0.00 -1.47 0.00 0.00 33.84 31.79 2juh n VAL 666 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 2juh s GLU 667 N -3.54 1.08 0.11 7.34 1.03 -1.26 -5.04 118.70 118.41 2juh s GLU 667 Ca 0.30 -1.37 -0.02 0.00 0.03 0.00 0.00 54.97 53.91 2juh s GLU 667 Cb -0.02 -0.81 0.03 0.00 -0.80 0.00 0.00 34.13 32.53 2juh s GLU 667 CO 0.20 0.13 0.09 -0.35 -1.33 0.00 0.00 175.26 174.00 2juh n PRO 668 N 0.11 -1.20 -4.31 -4.83 -0.04 -1.26 -5.05 135.00 118.43 2juh n PRO 668 Ca -0.12 -0.15 -0.17 0.00 -0.04 0.00 0.00 63.50 63.02 2juh n PRO 668 Cb 0.59 -0.14 -0.10 0.00 -0.04 0.00 0.00 33.50 33.81 2juh n PRO 668 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2juh s LEU 669 N 0.00 2.54 0.52 1.53 2.96 -1.26 -5.17 118.68 119.80 2juh s LEU 669 Ca 0.06 -1.00 0.00 0.00 -0.22 0.00 0.00 54.13 52.98 2juh s LEU 669 Cb -0.01 -0.56 -0.00 0.00 0.50 0.00 0.00 46.19 46.12 2juh s LEU 669 CO 0.05 -0.22 0.01 -1.59 -1.32 0.00 0.00 176.35 173.28 2juh s LYS 670 N -3.59 2.22 0.22 1.98 -2.85 -1.26 -5.17 119.74 111.29 2juh s LYS 670 Ca 0.19 -2.44 0.05 0.00 -1.00 0.00 0.00 55.97 52.78 2juh s LYS 670 Cb -0.00 -1.44 -0.02 0.00 -2.06 0.00 0.00 37.83 34.31 2juh s LYS 670 CO 0.04 -0.42 0.19 0.44 0.10 0.00 0.00 175.35 175.70 2juh n ILE 671 N -1.29 0.00 -4.99 3.79 -5.35 -1.26 -5.17 119.36 105.10 2juh n ILE 671 Ca -0.20 -1.63 -0.29 0.00 -0.27 0.00 0.00 62.75 60.36 2juh n ILE 671 Cb 0.67 0.81 -0.16 0.00 -1.74 0.00 0.00 39.64 39.22 2juh n ILE 671 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2juh s LEU 672 N 0.00 1.95 -0.07 7.28 1.98 -1.26 -5.06 118.68 123.50 2juh s LEU 672 Ca 0.27 -0.43 -0.02 0.00 -2.89 0.00 0.00 54.13 51.06 2juh s LEU 672 Cb 0.01 -1.15 -0.01 0.00 0.66 0.00 0.00 46.19 45.71 2juh s LEU 672 CO 0.19 0.16 -0.03 0.44 -1.89 0.00 0.00 176.35 175.21 2juh h ASP 673 N 6.42 0.00 -5.16 3.68 3.32 -2.09 -3.49 116.42 119.10 2juh h ASP 673 Ca -0.29 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.51 2juh h ASP 673 Cb 1.19 0.00 0.16 0.00 0.22 0.00 0.00 39.33 40.90 2juh h ASP 673 CO 0.47 0.38 -0.71 0.00 -1.72 0.00 0.00 179.24 177.66 2juh n ALA 674 N -2.70 -2.00 -2.00 3.45 0.00 -1.26 -5.03 120.51 110.97 2juh n ALA 674 Ca -0.01 0.04 -0.22 0.00 0.00 0.00 0.00 53.44 53.24 2juh n ALA 674 Cb 0.05 -3.68 0.09 0.00 0.00 0.00 0.00 19.45 15.90 2juh n ALA 674 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2juh s LYS 675 N -4.69 1.94 0.10 0.00 -2.85 -1.26 -5.13 119.74 107.85 2juh s LYS 675 Ca 0.20 -1.14 -0.26 0.00 -1.00 0.00 0.00 55.97 53.77 2juh s LYS 675 Cb -0.03 -2.41 0.08 0.00 -2.06 0.00 0.00 37.83 33.41 2juh s LYS 675 CO 0.64 -1.21 0.99 0.00 0.10 0.00 0.00 175.35 175.87 2juh s ALA 676 N -2.99 -1.76 0.00 0.59 0.00 -1.26 -5.19 121.76 111.15 2juh s ALA 676 Ca 0.64 0.38 -0.28 0.00 0.00 0.00 0.00 51.96 52.70 2juh s ALA 676 Cb -0.06 0.55 0.10 0.00 0.00 0.00 0.00 23.12 23.71 2juh s ALA 676 CO 0.42 -0.97 1.26 1.14 0.00 0.00 0.00 175.76 177.61 2juh s GLN 677 N -3.14 0.48 -1.00 0.00 -2.07 -1.26 -5.03 119.66 107.63 2juh s GLN 677 Ca 0.11 -0.30 -0.02 0.00 -1.82 0.00 0.00 55.36 53.33 2juh s GLN 677 Cb -0.01 0.14 -0.02 0.00 -1.09 0.00 0.00 33.01 32.04 2juh s GLN 677 CO -0.01 -0.22 0.85 1.17 -1.32 0.00 0.00 175.29 175.76 2juh n LYS 678 N -0.77 -4.64 0.11 9.60 0.00 -1.26 -4.92 118.16 116.28 2juh n LYS 678 Ca -0.00 0.74 -0.02 0.00 0.00 0.00 0.00 58.31 59.03 2juh n LYS 678 Cb 0.60 -5.38 0.22 0.00 0.00 0.00 0.00 35.03 30.46 2juh n LYS 678 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.40 177.01 2juh h VAL 679 N -1.44 1.33 0.00 3.15 -1.51 -2.07 -3.48 116.25 112.23 2juh h VAL 679 Ca -0.52 -1.62 0.00 0.00 -1.23 0.00 0.00 66.70 63.33 2juh h VAL 679 Cb 1.29 1.78 0.00 0.00 -2.13 0.00 0.00 31.29 32.23 2juh h VAL 679 CO 0.42 0.48 0.00 0.61 -1.23 0.00 0.00 177.57 177.85 2juh n GLY 680 N -0.10 -1.36 0.00 5.19 0.00 -1.26 -5.34 105.19 102.31 2juh n GLY 680 Ca -0.02 -1.00 0.09 0.00 0.00 0.00 0.00 46.02 45.09 2juh n GLY 680 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32