#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i8i h ALA 2 N 0.00 -0.14 -1.50 3.17 0.00 -2.04 -3.28 119.26 115.47 3i8i h ALA 2 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3i8i h ALA 2 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3i8i h ALA 2 CO 0.00 -0.39 0.00 1.28 0.00 0.00 0.00 179.25 180.14 3i8i n LEU 3 N -4.98 0.12 -0.06 0.00 4.77 -1.26 -3.19 117.00 112.39 3i8i n LEU 3 Ca -0.09 0.71 0.05 0.00 -0.03 0.00 0.00 56.01 56.65 3i8i n LEU 3 Cb 0.23 -0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.14 3i8i n LEU 3 CO 0.32 -0.25 0.14 -0.67 -1.33 0.00 0.00 177.39 175.60 3i8i n ASP 4 N -1.25 0.00 -0.05 -1.43 2.03 -1.26 0.33 116.55 114.92 3i8i n ASP 4 Ca 0.00 0.10 -0.16 0.00 0.52 0.00 0.00 54.79 55.26 3i8i n ASP 4 Cb 0.00 -0.05 -0.13 0.00 -0.72 0.00 0.00 41.12 40.22 3i8i n ASP 4 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 3i8i h ILE 5 N 0.00 1.68 0.00 5.18 2.04 -1.61 0.10 117.51 124.90 3i8i h ILE 5 Ca 0.09 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 63.57 3i8i h ILE 5 Cb 0.34 3.29 0.00 0.00 -0.74 0.00 0.00 36.82 39.71 3i8i h ILE 5 CO -0.01 0.62 0.00 -0.62 0.00 0.00 0.00 178.15 178.14 3i8i n GLU 6 N -4.49 0.48 -2.81 2.37 1.02 0.99 0.37 120.64 118.56 3i8i n GLU 6 Ca -0.12 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.91 3i8i n GLU 6 Cb 0.57 -1.01 0.05 0.00 -0.02 0.00 0.00 31.44 31.04 3i8i n GLU 6 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3i8i n ARG 7 N -0.48 1.09 0.00 3.49 0.00 0.35 -4.64 116.66 116.47 3i8i n ARG 7 Ca 0.00 -2.59 0.00 0.00 -0.00 0.00 0.00 57.85 55.26 3i8i n ARG 7 Cb 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 32.46 31.48 3i8i n ARG 7 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 3i8i n ILE 8 N -0.02 0.00 0.91 5.15 -0.00 -0.02 -4.46 119.36 120.92 3i8i n ILE 8 Ca 0.09 0.00 0.13 0.00 -0.00 0.00 0.00 62.75 62.97 3i8i n ILE 8 Cb 0.76 0.00 0.45 0.00 -0.00 0.00 0.00 39.64 40.85 3i8i n ILE 8 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 3i8i n LYS 9 N 0.00 0.06 0.00 0.38 4.76 1.17 -2.24 118.16 122.30 3i8i n LYS 9 Ca 0.00 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 3i8i n LYS 9 Cb 0.00 -1.56 0.00 0.00 -1.84 0.00 0.00 35.03 31.63 3i8i n LYS 9 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 3i8i n GLU 10 N -1.66 0.24 -5.19 1.97 -0.00 -0.65 -4.96 120.64 110.39 3i8i n GLU 10 Ca 0.06 -0.72 -0.31 0.00 -0.00 0.00 0.00 57.16 56.19 3i8i n GLU 10 Cb 0.36 -0.93 -0.16 0.00 -0.00 0.00 0.00 31.44 30.72 3i8i n GLU 10 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 3i8i s GLU 11 N -0.27 2.01 0.00 3.44 8.01 -0.95 -4.29 118.70 126.65 3i8i s GLU 11 Ca 0.00 -0.97 0.00 0.00 0.01 0.00 0.00 54.97 54.01 3i8i s GLU 11 Cb 0.00 -2.00 0.00 0.00 -4.31 0.00 0.00 34.13 27.82 3i8i s GLU 11 CO 0.00 0.54 0.00 -0.11 0.01 0.00 0.00 175.26 175.70 3i8i n LEU 12 N 2.27 0.00 0.00 1.80 0.00 -1.26 -4.41 117.00 115.40 3i8i n LEU 12 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.85 3i8i n LEU 12 Cb 0.51 0.01 0.00 0.00 0.00 0.00 0.00 43.42 43.95 3i8i n LEU 12 CO 0.23 -0.01 0.00 -1.20 0.00 0.00 0.00 177.39 176.41 3i8i n SER 13 N -0.95 0.00 -2.33 1.96 7.64 -1.26 -5.09 113.62 113.59 3i8i n SER 13 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 3i8i n SER 13 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 3i8i n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i8i n GLN 14 N 2.81 -4.48 -1.11 1.43 1.13 -1.26 -4.72 117.38 111.17 3i8i n GLN 14 Ca 0.00 3.35 -0.42 0.00 -1.94 0.00 0.00 57.00 57.99 3i8i n GLN 14 Cb 0.00 -4.47 -0.05 0.00 0.11 0.00 0.00 30.24 25.83 3i8i n GLN 14 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3i8i n ALA 15 N 1.61 -2.72 0.00 -1.58 0.00 -1.26 -4.96 120.51 111.60 3i8i n ALA 15 Ca -0.17 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3i8i n ALA 15 Cb 0.26 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.41 3i8i n ALA 15 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3i8i n THR 16 N 0.69 0.00 -3.09 0.00 -2.24 -1.26 -4.93 114.28 103.45 3i8i n THR 16 Ca 0.15 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.73 3i8i n THR 16 Cb 0.11 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.39 3i8i n THR 16 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3i8i n VAL 17 N 0.00 -2.04 0.00 2.28 0.31 -1.26 -3.70 118.33 113.92 3i8i n VAL 17 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3i8i n VAL 17 Cb 0.00 -3.35 0.00 0.00 -0.91 0.00 0.00 33.84 29.58 3i8i n VAL 17 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3i8i n LEU 18 N -3.84 0.00 0.00 7.52 4.77 -1.26 -4.05 117.00 120.14 3i8i n LEU 18 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3i8i n LEU 18 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3i8i n LEU 18 CO 0.46 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.90 3i8i n GLU 19 N 0.00 0.00 0.22 3.23 -0.58 -1.24 1.12 120.64 123.39 3i8i n GLU 19 Ca 0.00 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.85 3i8i n GLU 19 Cb 0.00 0.00 0.57 0.00 -0.57 0.00 0.00 31.44 31.44 3i8i n GLU 19 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3i8i h LEU 20 N 0.00 0.00 0.07 -4.62 4.07 -1.87 -2.37 115.31 110.59 3i8i h LEU 20 Ca 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 3i8i h LEU 20 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 3i8i h LEU 20 CO 0.00 0.00 -0.03 0.11 -1.08 0.00 0.00 178.44 177.44 3i8i h LYS 21 N 0.00 -0.09 -1.48 1.13 1.79 6.70 -2.56 116.57 122.06 3i8i h LYS 21 Ca 0.00 0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 58.41 3i8i h LYS 21 Cb 0.50 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.13 3i8i h LYS 21 CO 0.00 -0.06 0.09 0.94 -1.08 0.00 0.00 179.45 179.34 3i8i n GLN 22 N -2.43 1.17 -1.30 3.15 7.27 -0.97 0.20 117.38 124.47 3i8i n GLN 22 Ca -0.01 -0.37 0.04 0.00 0.07 0.00 0.00 57.00 56.73 3i8i n GLN 22 Cb 0.04 -1.14 0.03 0.00 2.41 0.00 0.00 30.24 31.57 3i8i n GLN 22 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 3i8i n LEU 23 N 0.80 0.96 0.17 1.69 -0.00 -0.93 -3.85 117.00 115.84 3i8i n LEU 23 Ca 0.07 -1.97 0.00 0.00 -0.00 0.00 0.00 56.01 54.11 3i8i n LEU 23 Cb 0.57 -0.03 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 3i8i n LEU 23 CO 0.08 0.52 0.00 0.00 -0.00 0.00 0.00 177.39 177.99 3i8i n ILE 24 N 0.33 0.00 0.17 1.96 0.00 0.52 -4.79 119.36 117.55 3i8i n ILE 24 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 62.75 62.94 3i8i n ILE 24 Cb 1.06 -0.29 0.69 0.00 0.00 0.00 0.00 39.64 41.10 3i8i n ILE 24 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 3i8i h ASP 25 N 0.00 0.00 0.16 9.51 3.58 0.48 1.48 116.42 131.63 3i8i h ASP 25 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3i8i h ASP 25 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 3i8i h ASP 25 CO 0.00 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.36 3i8i n ALA 26 N -2.54 2.49 0.04 -0.78 0.00 -1.25 -3.59 120.51 114.88 3i8i n ALA 26 Ca 0.02 -0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.31 3i8i n ALA 26 Cb 0.29 -1.45 -0.07 0.00 0.00 0.00 0.00 19.45 18.21 3i8i n ALA 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3i8i n LEU 27 N -1.09 0.87 -0.01 0.00 4.77 0.51 -4.32 117.00 117.72 3i8i n LEU 27 Ca 0.19 0.38 -0.00 0.00 -0.03 0.00 0.00 56.01 56.54 3i8i n LEU 27 Cb 0.13 0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3i8i n LEU 27 CO 0.17 0.11 -0.02 0.50 -1.33 0.00 0.00 177.39 176.83 3i8i h LYS 28 N 0.00 0.00 -5.03 3.23 3.64 -1.65 -3.37 116.57 113.39 3i8i h LYS 28 Ca -0.15 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 3i8i h LYS 28 Cb 1.53 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.33 3i8i h LYS 28 CO 0.04 0.00 0.99 0.39 -2.27 0.00 0.00 179.45 178.60 3i8i n GLU 29 N -2.54 0.05 0.00 1.90 4.71 -1.24 -5.17 120.64 118.35 3i8i n GLU 29 Ca -0.00 -0.32 0.00 0.00 -0.01 0.00 0.00 57.16 56.82 3i8i n GLU 29 Cb 0.01 -1.63 0.00 0.00 -1.01 0.00 0.00 31.44 28.81 3i8i n GLU 29 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22