#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2i n ALA 642 N 0.00 0.00 -1.68 7.54 0.00 -1.26 -4.63 120.51 120.48 2k2i n ALA 642 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 2k2i n ALA 642 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 2k2i n ALA 642 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2k2i n ASP 643 N -2.10 1.70 -3.69 0.00 9.92 -1.26 -4.98 116.55 116.15 2k2i n ASP 643 Ca 0.00 0.90 -0.29 0.00 -0.53 0.00 0.00 54.79 54.87 2k2i n ASP 643 Cb 0.00 -1.48 -0.15 0.00 -0.64 0.00 0.00 41.12 38.85 2k2i n ASP 643 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2k2i s LEU 644 N -2.70 1.50 -0.37 0.64 2.96 -1.26 -5.04 118.68 114.41 2k2i s LEU 644 Ca 0.74 -1.31 -0.02 0.00 -0.22 0.00 0.00 54.13 53.32 2k2i s LEU 644 Cb -0.43 -0.66 0.18 0.00 0.50 0.00 0.00 46.19 45.79 2k2i s LEU 644 CO 0.48 -0.39 2.25 0.00 -1.32 0.00 0.00 176.35 177.36 2k2i n HIS 645 N 5.01 1.64 -3.94 5.38 1.44 -1.26 -4.77 115.22 118.72 2k2i n HIS 645 Ca -0.05 -2.02 -0.31 0.00 -2.01 0.00 0.00 57.72 53.33 2k2i n HIS 645 Cb 0.44 -1.11 -0.15 0.00 0.12 0.00 0.00 29.99 29.28 2k2i n HIS 645 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2k2i s HIS 646 N -1.88 2.76 0.00 -1.40 5.04 -1.26 -4.91 115.29 113.64 2k2i s HIS 646 Ca 0.41 -2.18 0.00 0.00 -1.54 0.00 0.00 55.06 51.75 2k2i s HIS 646 Cb 0.30 -2.03 0.00 0.00 0.04 0.00 0.00 32.58 30.88 2k2i s HIS 646 CO -0.07 -0.86 0.00 0.94 -2.34 0.00 0.00 174.74 172.42 2k2i n GLN 647 N 4.56 0.00 -3.12 2.88 7.27 -1.26 -4.93 117.38 122.78 2k2i n GLN 647 Ca -0.06 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.70 2k2i n GLN 647 Cb 0.43 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.03 2k2i n GLN 647 CO 0.00 0.00 0.00 -1.01 0.07 0.00 0.00 177.06 176.12 2k2i s HIS 617 N -0.91 3.43 -1.79 3.69 3.76 -1.26 -4.33 115.29 117.89 2k2i s HIS 617 Ca 0.00 1.01 0.00 0.00 -0.15 0.00 0.00 55.06 55.92 2k2i s HIS 617 Cb 0.00 -2.39 0.00 0.00 1.11 0.00 0.00 32.58 31.30 2k2i s HIS 617 CO 0.00 0.07 0.00 0.43 -0.85 0.00 0.00 174.74 174.39 2k2i n SER 649 N -0.73 -5.80 -3.45 1.40 7.64 -1.26 -4.89 113.62 106.54 2k2i n SER 649 Ca 0.02 0.02 -0.37 0.00 1.01 0.00 0.00 58.87 59.55 2k2i n SER 649 Cb 0.53 -4.84 -0.02 0.00 -1.01 0.00 0.00 64.21 58.87 2k2i n SER 649 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2k2i n VAL 650 N -3.89 3.45 -0.06 0.44 0.24 -1.26 -4.32 118.33 112.92 2k2i n VAL 650 Ca -0.24 -2.39 -0.03 0.00 -2.04 0.00 0.00 64.34 59.64 2k2i n VAL 650 Cb 0.68 -2.50 -0.15 0.00 -1.47 0.00 0.00 33.84 30.41 2k2i n VAL 650 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 2k2i n LEU 651 N 4.88 0.00 0.10 1.34 7.94 -1.26 -3.95 117.00 126.05 2k2i n LEU 651 Ca 0.62 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 55.52 2k2i n LEU 651 Cb 0.28 0.31 0.33 0.00 0.53 0.00 0.00 43.42 44.87 2k2i n LEU 651 CO 0.86 0.31 0.81 1.12 -1.11 0.00 0.00 177.39 179.38 2k2i h HIS 652 N 0.00 0.27 -0.17 1.96 2.07 -1.98 0.97 115.15 118.27 2k2i h HIS 652 Ca -0.34 -0.04 0.05 0.00 -2.85 0.00 0.00 60.37 57.19 2k2i h HIS 652 Cb 1.74 -0.07 -0.07 0.00 2.57 0.00 0.00 27.41 31.58 2k2i h HIS 652 CO 0.00 0.46 -0.37 -0.09 -3.07 0.00 0.00 177.93 174.86 2k2i h ARG 653 N 0.23 -0.40 -0.49 5.12 2.43 -1.91 0.53 114.38 119.90 2k2i h ARG 653 Ca 0.04 0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 2k2i h ARG 653 Cb 0.52 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2k2i h ARG 653 CO 0.03 -0.27 -0.14 0.00 -1.51 0.00 0.00 179.97 178.09 2k2i h ALA 654 N 0.34 0.67 -0.01 2.80 0.00 -1.45 0.33 119.26 121.95 2k2i h ALA 654 Ca 0.10 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2k2i h ALA 654 Cb 0.58 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2k2i h ALA 654 CO -0.40 0.60 0.00 1.25 0.00 0.00 0.00 179.25 180.70 2k2i h LEU 655 N 0.81 0.01 -0.14 0.00 5.85 -0.78 -2.90 115.31 118.17 2k2i h LEU 655 Ca 0.12 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2k2i h LEU 655 Cb 0.70 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2k2i h LEU 655 CO 0.05 0.16 0.00 0.00 -0.34 0.00 0.00 178.44 178.31 2k2i n GLN 656 N -5.01 0.19 0.23 1.25 6.02 0.19 -2.28 117.38 117.96 2k2i n GLN 656 Ca -0.07 0.22 0.11 0.00 -0.01 0.00 0.00 57.00 57.25 2k2i n GLN 656 Cb 0.10 -1.75 0.43 0.00 1.02 0.00 0.00 30.24 30.04 2k2i n GLN 656 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k2i h ALA 657 N 2.55 0.98 0.01 -1.58 0.00 -0.18 0.52 119.26 121.56 2k2i h ALA 657 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2k2i h ALA 657 Cb 0.60 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2k2i h ALA 657 CO 0.00 0.22 -0.09 2.35 0.00 0.00 0.00 179.25 181.73 2k2i h TRP 658 N 0.00 0.07 0.00 0.00 2.91 -1.26 -3.41 115.95 114.27 2k2i h TRP 658 Ca -0.00 -0.05 -0.14 0.00 1.13 0.00 0.00 58.89 59.83 2k2i h TRP 658 Cb 0.79 -0.01 -0.03 0.00 -0.51 0.00 0.00 29.16 29.41 2k2i h TRP 658 CO 0.00 0.94 -2.14 1.55 -1.03 0.00 0.00 178.44 177.75 2k2i n VAL 659 N -4.60 0.53 -0.21 2.65 3.14 -0.97 -5.14 118.33 113.74 2k2i n VAL 659 Ca -0.10 -0.64 0.00 0.00 -2.96 0.00 0.00 64.34 60.65 2k2i n VAL 659 Cb 0.47 -0.18 0.00 0.00 -1.06 0.00 0.00 33.84 33.08 2k2i n VAL 659 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78