#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bn5 s ALA 652 N 0.00 3.36 -1.38 4.61 0.00 -1.26 -4.85 121.76 122.24 2bn5 s ALA 652 Ca 0.00 -2.93 -0.15 0.00 0.00 0.00 0.00 51.96 48.88 2bn5 s ALA 652 Cb 0.00 -4.57 0.06 0.00 0.00 0.00 0.00 23.12 18.62 2bn5 s ALA 652 CO 0.00 -3.25 1.98 -3.47 0.00 0.00 0.00 175.76 171.02 2bn5 n ASP 653 N 8.06 4.42 -0.00 0.00 -0.08 -1.26 -4.38 116.55 123.30 2bn5 n ASP 653 Ca 0.46 -2.89 0.01 0.00 -1.51 0.00 0.00 54.79 50.86 2bn5 n ASP 653 Cb 0.46 -1.68 -0.02 0.00 2.34 0.00 0.00 41.12 42.22 2bn5 n ASP 653 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2bn5 n TYR 654 N 6.88 0.00 -0.21 -0.67 4.11 -1.26 -4.66 117.16 121.35 2bn5 n TYR 654 Ca 0.50 0.00 0.31 0.00 -0.00 0.00 0.00 57.90 58.70 2bn5 n TYR 654 Cb 0.42 -0.01 0.68 0.00 -0.00 0.00 0.00 39.34 40.43 2bn5 n TYR 654 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 2bn5 h SER 655 N 0.00 0.00 0.16 9.48 0.87 -1.83 0.75 113.55 122.98 2bn5 h SER 655 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2bn5 h SER 655 Cb 0.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2bn5 h SER 655 CO 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 176.83 176.22 2bn5 h ALA 656 N 1.16 -0.75 0.00 6.23 0.00 -1.87 1.02 119.26 125.05 2bn5 h ALA 656 Ca 0.48 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2bn5 h ALA 656 Cb 2.25 0.08 0.00 0.00 0.00 0.00 0.00 17.79 20.12 2bn5 h ALA 656 CO -0.01 -0.74 0.00 0.37 0.00 0.00 0.00 179.25 178.88 2bn5 h GLN 657 N -0.28 0.00 0.10 0.00 4.15 -1.68 -0.78 115.11 116.62 2bn5 h GLN 657 Ca -0.02 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.10 2bn5 h GLN 657 Cb 0.16 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 2bn5 h GLN 657 CO 0.04 0.00 -1.51 -1.49 -1.93 0.00 0.00 178.83 173.94 2bn5 h TRP 658 N 0.00 0.38 -0.03 3.99 -0.00 0.51 -3.29 115.95 117.52 2bn5 h TRP 658 Ca 0.00 -0.28 -0.16 0.00 -0.00 0.00 0.00 58.89 58.45 2bn5 h TRP 658 Cb 0.40 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 29.53 2bn5 h TRP 658 CO 0.00 1.33 -0.70 0.00 -0.00 0.00 0.00 178.44 179.07 2bn5 h ALA 659 N 0.56 0.78 -0.50 1.49 0.00 0.16 -2.74 119.26 119.01 2bn5 h ALA 659 Ca -0.23 -0.61 0.14 0.00 0.00 0.00 0.00 54.91 54.21 2bn5 h ALA 659 Cb 2.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 2bn5 h ALA 659 CO 0.15 0.82 0.36 1.05 0.00 0.00 0.00 179.25 181.63 2bn5 h GLU 660 N 0.10 0.02 0.30 0.00 4.11 -1.22 0.65 114.58 118.53 2bn5 h GLU 660 Ca -0.02 -0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.40 2bn5 h GLU 660 Cb 1.24 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2bn5 h GLU 660 CO 0.10 0.01 -0.14 1.88 0.07 0.00 0.00 179.01 180.93 2bn5 h TYR 661 N 0.02 -0.38 0.00 2.06 0.05 -1.56 -3.09 116.97 114.07 2bn5 h TYR 661 Ca 0.24 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.01 2bn5 h TYR 661 Cb 0.93 0.12 0.00 0.00 1.01 0.00 0.00 36.73 38.79 2bn5 h TYR 661 CO -0.00 -0.23 0.10 1.88 -1.05 0.00 0.00 178.16 178.85 2bn5 h TYR 662 N -0.69 0.00 -0.01 4.88 0.05 -1.38 1.42 116.97 121.24 2bn5 h TYR 662 Ca -0.04 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.74 2bn5 h TYR 662 Cb 0.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.05 2bn5 h TYR 662 CO 0.05 0.00 0.00 0.54 -1.05 0.00 0.00 178.16 177.70 2bn5 n ARG 663 N -2.84 1.21 -0.37 4.88 3.00 0.22 0.52 116.66 123.28 2bn5 n ARG 663 Ca -0.02 -0.31 0.00 0.00 -0.01 0.00 0.00 57.85 57.51 2bn5 n ARG 663 Cb 0.15 -1.46 0.00 0.00 0.00 0.00 0.00 32.46 31.15 2bn5 n ARG 663 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2bn5 n SER 664 N -0.60 0.00 -0.04 0.55 2.88 0.20 -4.71 113.62 111.90 2bn5 n SER 664 Ca 0.21 -0.92 0.03 0.00 -1.33 0.00 0.00 58.87 56.86 2bn5 n SER 664 Cb 0.18 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.61 2bn5 n SER 664 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2bn5 n VAL 665 N 0.00 0.00 0.00 2.46 0.24 0.43 -4.99 118.33 116.47 2bn5 n VAL 665 Ca 0.00 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 2bn5 n VAL 665 Cb 0.46 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.85 2bn5 n VAL 665 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bn5 n GLY 666 N 1.04 0.87 0.00 7.63 0.00 -1.26 -5.00 105.19 108.47 2bn5 n GLY 666 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2bn5 n GLY 666 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2bn5 n LYS 667 N 0.00 0.00 -0.08 1.61 0.00 -0.96 -5.03 118.16 113.69 2bn5 n LYS 667 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.24 2bn5 n LYS 667 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 35.03 35.03 2bn5 n LYS 667 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 2bn5 h ILE 668 N 0.00 0.50 -0.92 0.58 5.03 -0.22 1.06 117.51 123.54 2bn5 h ILE 668 Ca 0.00 0.00 0.20 0.00 -0.12 0.00 0.00 64.86 64.94 2bn5 h ILE 668 Cb 0.00 0.50 -0.11 0.00 -3.03 0.00 0.00 36.82 34.18 2bn5 h ILE 668 CO 0.00 0.00 0.48 -0.08 -0.68 0.00 0.00 178.15 177.87 2bn5 h GLU 669 N -0.12 0.55 0.00 2.37 4.81 -1.96 1.03 114.58 121.26 2bn5 h GLU 669 Ca 0.16 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.24 2bn5 h GLU 669 Cb 0.37 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2bn5 h GLU 669 CO -0.39 0.37 -0.57 1.49 -0.73 0.00 0.00 179.01 179.17 2bn5 h GLU 670 N 0.57 0.00 -0.32 1.92 4.81 -1.26 -2.97 114.58 117.33 2bn5 h GLU 670 Ca 0.55 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.77 2bn5 h GLU 670 Cb 0.93 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 2bn5 h GLU 670 CO -0.44 0.57 0.14 0.00 -0.73 0.00 0.00 179.01 178.55 2bn5 h ALA 671 N 1.43 1.64 -0.00 2.92 0.00 0.92 0.33 119.26 126.49 2bn5 h ALA 671 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2bn5 h ALA 671 Cb 1.31 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2bn5 h ALA 671 CO 0.07 0.29 0.01 0.93 0.00 0.00 0.00 179.25 180.55 2bn5 h GLU 672 N 0.45 0.00 -0.23 0.00 5.08 -0.83 -0.03 114.58 119.02 2bn5 h GLU 672 Ca 0.11 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.31 2bn5 h GLU 672 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2bn5 h GLU 672 CO -0.01 0.00 -0.49 0.00 -1.00 0.00 0.00 179.01 177.51 2bn5 h ALA 673 N 1.99 0.36 -0.61 3.43 0.00 -0.45 -3.14 119.26 120.85 2bn5 h ALA 673 Ca 0.00 -0.49 0.01 0.00 0.00 0.00 0.00 54.91 54.43 2bn5 h ALA 673 Cb 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2bn5 h ALA 673 CO -0.00 0.53 0.39 0.82 0.00 0.00 0.00 179.25 181.00 2bn5 h ILE 674 N 0.45 1.13 -0.93 0.00 5.03 -0.85 -0.47 117.51 121.88 2bn5 h ILE 674 Ca 0.00 -0.27 0.27 0.00 -0.12 0.00 0.00 64.86 64.74 2bn5 h ILE 674 Cb 1.10 0.27 -0.04 0.00 -3.03 0.00 0.00 36.82 35.12 2bn5 h ILE 674 CO 0.11 0.14 0.79 -0.33 -0.68 0.00 0.00 178.15 178.19 2bn5 h GLU 675 N 0.79 0.00 -0.09 2.37 5.08 -1.37 1.59 114.58 122.96 2bn5 h GLU 675 Ca 0.23 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.50 2bn5 h GLU 675 Cb -0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2bn5 h GLU 675 CO -0.07 0.00 -0.37 -0.22 -1.00 0.00 0.00 179.01 177.36 2bn5 h LYS 676 N 0.00 0.18 -0.16 2.33 3.64 -1.12 -2.36 116.57 119.08 2bn5 h LYS 676 Ca 0.44 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.66 2bn5 h LYS 676 Cb 2.03 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.83 2bn5 h LYS 676 CO -0.00 0.53 -0.28 1.15 -2.27 0.00 0.00 179.45 178.57 2bn5 h THR 677 N 0.15 1.26 -1.00 1.00 2.02 0.23 -2.46 112.91 114.10 2bn5 h THR 677 Ca 0.02 -1.22 0.24 0.00 0.77 0.00 0.00 66.41 66.22 2bn5 h THR 677 Cb 0.73 1.45 -0.09 0.00 -1.74 0.00 0.00 68.15 68.50 2bn5 h THR 677 CO 0.05 0.37 0.65 0.25 0.37 0.00 0.00 175.52 177.22 2bn5 h LEU 678 N 0.26 0.47 -2.27 2.58 5.85 -1.21 0.86 115.31 121.85 2bn5 h LEU 678 Ca 0.04 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.86 2bn5 h LEU 678 Cb 0.63 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 2bn5 h LEU 678 CO 0.05 0.13 0.24 0.50 -0.34 0.00 0.00 178.44 179.01 2bn5 h LYS 679 N 0.44 0.00 -6.27 1.25 1.63 -1.52 -3.43 116.57 108.67 2bn5 h LYS 679 Ca 0.56 0.00 -0.67 0.00 -0.85 0.00 0.00 60.65 59.69 2bn5 h LYS 679 Cb 1.36 0.00 0.04 0.00 -0.60 0.00 0.00 32.23 33.03 2bn5 h LYS 679 CO -0.28 0.00 0.76 0.09 -3.45 0.00 0.00 179.45 176.58 2bn5 n ASN 680 N -3.31 2.41 -2.21 4.20 4.13 0.30 -4.87 115.26 115.91 2bn5 n ASN 680 Ca -0.00 1.07 0.02 0.00 1.68 0.00 0.00 54.58 57.35 2bn5 n ASN 680 Cb 0.33 -1.24 0.04 0.00 -1.54 0.00 0.00 39.78 37.36 2bn5 n ASN 680 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 2bn5 n LYS 681 N 4.28 0.93 -3.02 3.52 4.81 -1.26 -4.68 118.16 122.73 2bn5 n LYS 681 Ca 0.22 -2.73 -0.22 0.00 -0.87 0.00 0.00 58.31 54.71 2bn5 n LYS 681 Cb 0.20 -0.80 0.04 0.00 0.02 0.00 0.00 35.03 34.49 2bn5 n LYS 681 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2bn5 n GLN 682 N -0.14 -4.94 0.00 1.64 0.00 -1.26 -4.72 117.38 107.97 2bn5 n GLN 682 Ca 0.05 0.89 0.01 0.00 -0.00 0.00 0.00 57.00 57.95 2bn5 n GLN 682 Cb 0.95 -5.70 0.08 0.00 0.00 0.00 0.00 30.24 25.57 2bn5 n GLN 682 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35