#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6i n GLY 2 N 0.00 1.56 2.80 -5.12 0.00 -1.26 -4.91 105.19 98.27 2k6i n GLY 2 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2k6i n GLY 2 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2k6i n VAL 3 N 0.00 -5.45 -3.28 1.61 0.31 -1.26 -3.93 118.33 106.33 2k6i n VAL 3 Ca 0.00 -0.61 -0.07 0.00 -0.01 0.00 0.00 64.34 63.65 2k6i n VAL 3 Cb 0.00 -4.84 0.00 0.00 -0.91 0.00 0.00 33.84 28.10 2k6i n VAL 3 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2k6i n SER 4 N -2.66 -6.94 -0.46 4.52 2.88 -1.26 -4.94 113.62 104.76 2k6i n SER 4 Ca -0.15 -0.34 0.07 0.00 -1.33 0.00 0.00 58.87 57.11 2k6i n SER 4 Cb 0.61 -4.28 0.14 0.00 -0.75 0.00 0.00 64.21 59.94 2k6i n SER 4 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2k6i n VAL 5 N -2.06 1.61 0.12 2.46 0.24 -1.25 -4.60 118.33 114.84 2k6i n VAL 5 Ca -0.09 -2.25 0.07 0.00 -2.04 0.00 0.00 64.34 60.02 2k6i n VAL 5 Cb 0.56 -0.03 0.02 0.00 -1.47 0.00 0.00 33.84 32.92 2k6i n VAL 5 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6i h MET 6 N 0.47 0.00 0.00 7.34 -0.00 -1.92 -3.10 114.93 117.72 2k6i h MET 6 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 59.70 59.56 2k6i h MET 6 Cb 1.14 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.71 2k6i h MET 6 CO 0.01 0.19 -1.66 -1.91 -0.00 0.00 0.00 176.91 173.54 2k6i n GLU 7 N -2.95 1.42 -0.04 -0.10 2.13 -1.26 -3.87 120.64 115.97 2k6i n GLU 7 Ca -0.01 -0.05 -0.14 0.00 0.66 0.00 0.00 57.16 57.62 2k6i n GLU 7 Cb 0.66 -1.28 -0.12 0.00 0.27 0.00 0.00 31.44 30.97 2k6i n GLU 7 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k6i h ALA 8 N 0.77 0.01 0.00 4.31 0.00 -1.81 -3.38 119.26 119.16 2k6i h ALA 8 Ca -0.17 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 2k6i h ALA 8 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2k6i h ALA 8 CO 0.01 -0.05 -0.02 0.82 0.00 0.00 0.00 179.25 180.01 2k6i h ILE 9 N -0.68 1.64 -0.49 0.00 1.08 -1.80 -3.38 117.51 113.89 2k6i h ILE 9 Ca -0.01 -1.92 -0.66 0.00 -0.39 0.00 0.00 64.86 61.88 2k6i h ILE 9 Cb 0.85 2.95 -0.05 0.00 -3.07 0.00 0.00 36.82 37.49 2k6i h ILE 9 CO 0.02 0.50 2.41 1.17 -0.69 0.00 0.00 178.15 181.56 2k6i n LYS 10 N -4.68 2.82 0.05 2.37 4.81 -1.25 -4.64 118.16 117.64 2k6i n LYS 10 Ca -0.09 -2.89 -0.10 0.00 -0.87 0.00 0.00 58.31 54.35 2k6i n LYS 10 Cb 0.41 -3.42 -0.13 0.00 0.02 0.00 0.00 35.03 31.91 2k6i n LYS 10 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2k6i h GLU 11 N 7.28 0.08 -7.12 1.64 4.39 -1.75 -3.43 114.58 115.67 2k6i h GLU 11 Ca 0.47 -0.14 -0.52 0.00 0.34 0.00 0.00 59.36 59.51 2k6i h GLU 11 Cb 0.79 0.05 0.11 0.00 -0.10 0.00 0.00 28.75 29.60 2k6i h GLU 11 CO 1.61 0.94 0.44 0.08 -1.16 0.00 0.00 179.01 180.92 2k6i s VAL 12 N -2.66 2.74 -0.43 3.13 1.01 -1.26 -4.93 120.40 118.00 2k6i s VAL 12 Ca -0.03 0.43 0.03 0.00 0.00 0.00 0.00 61.98 62.41 2k6i s VAL 12 Cb 0.09 -3.10 0.59 0.00 0.00 0.00 0.00 36.38 33.95 2k6i s VAL 12 CO 0.83 -0.13 1.86 0.29 0.00 0.00 0.00 175.10 177.95 2k6i n LYS 13 N -1.82 2.18 0.00 2.72 5.02 -1.26 -4.71 118.16 120.29 2k6i n LYS 13 Ca 0.13 -2.76 0.00 0.00 -2.02 0.00 0.00 58.31 53.66 2k6i n LYS 13 Cb 0.50 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 33.43 2k6i n LYS 13 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k6i n LEU 14 N -0.97 0.00 -2.02 -0.35 4.77 -1.26 -4.82 117.00 112.35 2k6i n LEU 14 Ca 0.55 0.82 -0.17 0.00 -0.03 0.00 0.00 56.01 57.18 2k6i n LEU 14 Cb 1.48 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 42.21 2k6i n LEU 14 CO 0.57 -0.32 -0.19 0.00 -1.33 0.00 0.00 177.39 176.12 2k6i n ALA 15 N -1.75 -0.51 0.11 -1.18 0.00 -1.26 -4.83 120.51 111.09 2k6i n ALA 15 Ca 0.00 0.19 -0.02 0.00 0.00 0.00 0.00 53.44 53.61 2k6i n ALA 15 Cb 0.00 -1.79 -0.00 0.00 0.00 0.00 0.00 19.45 17.66 2k6i n ALA 15 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2k6i h GLU 16 N 0.00 0.00 -0.29 0.00 5.08 -2.00 -3.23 114.58 114.14 2k6i h GLU 16 Ca -0.37 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 2k6i h GLU 16 Cb 1.21 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 2k6i h GLU 16 CO 0.48 0.74 0.12 1.49 -1.00 0.00 0.00 179.01 180.84 2k6i h GLU 17 N 0.00 0.41 -0.19 2.33 4.81 -2.01 -1.66 114.58 118.27 2k6i h GLU 17 Ca -0.01 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 2k6i h GLU 17 Cb 1.50 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.79 2k6i h GLU 17 CO 0.10 0.34 0.13 0.37 -0.73 0.00 0.00 179.01 179.21 2k6i h GLN 18 N 0.41 0.10 -0.25 1.92 4.15 -1.96 -1.78 115.11 117.70 2k6i h GLN 18 Ca 0.10 -0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.39 2k6i h GLN 18 Cb 0.08 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.75 2k6i h GLN 18 CO -0.01 0.06 -0.35 0.00 -1.93 0.00 0.00 178.83 176.60 2k6i h ALA 19 N 1.90 0.37 -0.39 3.38 0.00 -1.47 -1.72 119.26 121.33 2k6i h ALA 19 Ca 0.08 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 2k6i h ALA 19 Cb 0.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2k6i h ALA 19 CO -0.01 0.44 -0.04 0.28 0.00 0.00 0.00 179.25 179.91 2k6i h VAL 20 N 0.39 1.23 0.00 0.00 2.07 -1.35 0.32 116.25 118.91 2k6i h VAL 20 Ca 0.03 -0.97 -0.15 0.00 0.82 0.00 0.00 66.70 66.43 2k6i h VAL 20 Cb 0.94 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2k6i h VAL 20 CO 0.08 0.33 -0.72 0.50 0.02 0.00 0.00 177.57 177.79 2k6i h LYS 21 N 0.60 0.00 0.01 1.57 1.63 -1.32 -1.97 116.57 117.09 2k6i h LYS 21 Ca 0.12 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.92 2k6i h LYS 21 Cb 0.44 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 2k6i h LYS 21 CO 0.02 0.72 -0.01 1.49 -3.45 0.00 0.00 179.45 178.22 2k6i h GLU 22 N 0.00 -0.01 -0.27 1.90 4.81 -0.89 -2.84 114.58 117.27 2k6i h GLU 22 Ca -0.01 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2k6i h GLU 22 Cb 1.29 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.66 2k6i h GLU 22 CO 0.09 0.79 -0.01 -0.84 -0.73 0.00 0.00 179.01 178.31 2k6i h ILE 23 N -0.89 1.17 -0.17 2.32 -0.00 -1.03 -2.11 117.51 116.80 2k6i h ILE 23 Ca -0.00 -0.69 -0.12 0.00 -0.00 0.00 0.00 64.86 64.05 2k6i h ILE 23 Cb 0.81 0.99 -0.01 0.00 -0.00 0.00 0.00 36.82 38.61 2k6i h ILE 23 CO 0.00 0.23 -0.42 -0.08 -0.00 0.00 0.00 178.15 177.88 2k6i h GLU 24 N 0.40 0.40 -0.17 0.16 4.81 -1.45 -2.89 114.58 115.84 2k6i h GLU 24 Ca 0.09 -0.20 -0.17 0.00 -0.13 0.00 0.00 59.36 58.94 2k6i h GLU 24 Cb 0.29 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 2k6i h GLU 24 CO 0.01 0.75 -0.61 1.49 -0.73 0.00 0.00 179.01 179.93 2k6i h GLU 25 N 0.33 0.57 -0.82 1.92 4.81 -1.16 -3.10 114.58 117.12 2k6i h GLU 25 Ca 0.03 -0.39 -0.03 0.00 -0.13 0.00 0.00 59.36 58.83 2k6i h GLU 25 Cb 0.88 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.28 2k6i h GLU 25 CO 0.07 1.00 0.38 0.00 -0.73 0.00 0.00 179.01 179.73 2k6i h ALA 26 N 0.91 1.06 -0.11 2.92 0.00 -1.28 -2.25 119.26 120.51 2k6i h ALA 26 Ca -0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2k6i h ALA 26 Cb 1.17 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2k6i h ALA 26 CO 0.11 0.64 -0.13 -0.22 0.00 0.00 0.00 179.25 179.65 2k6i h LYS 27 N 1.17 0.16 -0.48 0.00 3.64 -1.48 -2.47 116.57 117.12 2k6i h LYS 27 Ca 0.28 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.53 2k6i h LYS 27 Cb 0.15 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2k6i h LYS 27 CO -0.03 0.30 -0.10 -0.91 -2.27 0.00 0.00 179.45 176.45 2k6i h ASN 28 N 0.16 0.85 -0.62 4.20 -0.26 -1.34 -2.65 115.58 115.92 2k6i h ASN 28 Ca 0.03 -0.26 0.18 0.00 -0.56 0.00 0.00 56.30 55.69 2k6i h ASN 28 Cb 0.34 -0.23 -0.03 0.00 -1.06 0.00 0.00 38.32 37.34 2k6i h ASN 28 CO 0.02 0.97 0.45 0.03 -1.06 0.00 0.00 177.43 177.84 2k6i h ARG 29 N 0.78 0.01 -0.02 0.81 3.08 -1.24 0.17 114.38 117.97 2k6i h ARG 29 Ca 0.13 -0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.00 2k6i h ARG 29 Cb 0.60 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2k6i h ARG 29 CO 0.04 0.01 -0.79 0.00 -1.07 0.00 0.00 179.97 178.16 2k6i h ALA 30 N 1.69 0.61 0.00 0.04 0.00 -1.54 -3.10 119.26 116.97 2k6i h ALA 30 Ca 0.30 -0.67 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 2k6i h ALA 30 Cb 1.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2k6i h ALA 30 CO -0.01 0.85 -0.22 1.49 0.00 0.00 0.00 179.25 181.37 2k6i h GLU 31 N 0.14 0.00 -0.13 0.00 4.81 -0.67 -2.44 114.58 116.29 2k6i h GLU 31 Ca -0.03 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.23 2k6i h GLU 31 Cb 1.38 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.76 2k6i h GLU 31 CO 0.12 0.22 0.13 0.37 -0.73 0.00 0.00 179.01 179.12 2k6i h GLN 32 N 0.00 0.00 0.00 1.92 5.75 -1.40 0.22 115.11 121.60 2k6i h GLN 32 Ca -0.00 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.25 2k6i h GLN 32 Cb 0.50 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.01 2k6i h GLN 32 CO 0.03 0.00 -1.33 -0.89 -2.65 0.00 0.00 178.83 173.98 2k6i n ILE 33 N -3.93 1.54 0.28 2.39 -0.00 -0.93 -4.17 119.36 114.54 2k6i n ILE 33 Ca 0.00 -0.05 0.13 0.00 -0.00 0.00 0.00 62.75 62.83 2k6i n ILE 33 Cb 0.25 -2.03 0.81 0.00 -0.00 0.00 0.00 39.64 38.66 2k6i n ILE 33 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.55 176.66 2k6i h LYS 34 N -0.99 0.00 -0.79 0.38 1.79 -1.38 -2.00 116.57 113.57 2k6i h LYS 34 Ca -0.37 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.24 2k6i h LYS 34 Cb 1.33 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.92 2k6i h LYS 34 CO -0.22 0.03 0.52 0.00 -1.08 0.00 0.00 179.45 178.70 2k6i h ALA 35 N 1.97 2.01 0.22 3.86 0.00 -0.72 -1.45 119.26 125.14 2k6i h ALA 35 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.59 2k6i h ALA 35 Cb 0.08 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.81 2k6i h ALA 35 CO 0.00 -0.22 -1.48 0.93 0.00 0.00 0.00 179.25 178.49 2k6i h GLU 36 N 0.51 0.46 -0.91 0.00 5.08 -1.57 -3.30 114.58 114.84 2k6i h GLU 36 Ca 0.39 -0.78 0.21 0.00 -1.00 0.00 0.00 59.36 58.18 2k6i h GLU 36 Cb 0.78 0.29 -0.07 0.00 0.50 0.00 0.00 28.75 30.25 2k6i h GLU 36 CO -0.14 1.37 0.60 0.00 -1.00 0.00 0.00 179.01 179.84 2k6i h ALA 37 N 0.25 2.22 -0.05 3.43 0.00 -1.23 0.16 119.26 124.04 2k6i h ALA 37 Ca -0.25 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2k6i h ALA 37 Cb 2.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.89 2k6i h ALA 37 CO 0.24 -0.51 0.00 -0.89 0.00 0.00 0.00 179.25 178.09 2k6i n ILE 38 N -4.52 0.00 -0.09 0.00 5.41 -0.99 -0.12 119.36 119.06 2k6i n ILE 38 Ca 0.20 1.20 0.25 0.00 1.00 0.00 0.00 62.75 65.40 2k6i n ILE 38 Cb 0.72 -2.19 0.72 0.00 -0.71 0.00 0.00 39.64 38.17 2k6i n ILE 38 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 2k6i h GLU 39 N 0.00 0.00 0.03 0.38 4.11 -1.62 0.25 114.58 117.73 2k6i h GLU 39 Ca 0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.18 2k6i h GLU 39 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 2k6i h GLU 39 CO 0.00 0.00 -1.04 1.49 0.07 0.00 0.00 179.01 179.53 2k6i h GLU 40 N 0.00 0.52 0.00 1.06 4.81 -0.66 -3.21 114.58 117.10 2k6i h GLU 40 Ca 0.34 -0.59 -0.02 0.00 -0.13 0.00 0.00 59.36 58.96 2k6i h GLU 40 Cb 1.45 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 2k6i h GLU 40 CO -0.00 1.22 -0.10 0.00 -0.73 0.00 0.00 179.01 179.39 2k6i h ALA 41 N 0.57 0.95 -0.35 2.92 0.00 0.26 -3.30 119.26 120.30 2k6i h ALA 41 Ca -0.11 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 54.78 2k6i h ALA 41 Cb 1.69 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.39 2k6i h ALA 41 CO 0.19 0.13 -0.16 -0.22 0.00 0.00 0.00 179.25 179.19 2k6i h LYS 42 N 0.00 -0.10 0.00 0.00 1.63 -0.78 0.21 116.57 117.53 2k6i h LYS 42 Ca -0.00 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.79 2k6i h LYS 42 Cb 0.95 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.60 2k6i h LYS 42 CO 0.01 -0.06 -0.07 1.57 -3.45 0.00 0.00 179.45 177.45 2k6i h LYS 43 N -0.10 0.00 0.00 1.90 2.10 -1.71 -1.15 116.57 117.60 2k6i h LYS 43 Ca 0.18 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.74 2k6i h LYS 43 Cb 0.37 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.69 2k6i h LYS 43 CO -0.42 0.07 -0.42 1.25 -2.00 0.00 0.00 179.45 177.94 2k6i h LEU 44 N 0.00 0.00 -0.44 7.07 7.12 -0.80 -3.30 115.31 124.97 2k6i h LEU 44 Ca -0.00 0.00 0.09 0.00 0.13 0.00 0.00 57.88 58.10 2k6i h LEU 44 Cb 0.19 0.00 -0.08 0.00 -0.53 0.00 0.00 40.66 40.24 2k6i h LEU 44 CO 0.01 0.42 -0.08 0.40 -0.13 0.00 0.00 178.44 179.06 2k6i h ILE 45 N 0.00 0.59 -2.70 4.05 1.08 0.21 -3.41 117.51 117.33 2k6i h ILE 45 Ca -0.00 -0.01 -0.48 0.00 -0.39 0.00 0.00 64.86 63.98 2k6i h ILE 45 Cb 1.22 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 2k6i h ILE 45 CO 0.05 0.01 -0.25 0.00 -0.69 0.00 0.00 178.15 177.27 2k6i s ALA 46 N -6.21 3.75 -2.00 1.87 0.00 -1.24 -5.14 121.76 112.79 2k6i s ALA 46 Ca -0.14 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2k6i s ALA 46 Cb 0.15 -2.03 0.24 0.00 0.00 0.00 0.00 23.12 21.48 2k6i s ALA 46 CO 0.71 0.07 0.72 0.00 0.00 0.00 0.00 175.76 177.26