#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sju n VAL 2 N 0.00 0.00 0.00 1.97 0.24 -1.26 -5.05 118.33 114.23 1sju n VAL 2 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1sju n VAL 2 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1sju n VAL 2 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1sju n ASN 3 N 0.00 0.00 0.00 -1.34 0.23 -1.26 -5.14 115.26 107.75 1sju n ASN 3 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1sju n ASN 3 Cb 0.00 0.03 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 1sju n ASN 3 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1sju n GLN 4 N -1.08 2.22 -0.88 -3.83 1.13 -1.26 -4.98 117.38 108.70 1sju n GLN 4 Ca 0.00 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.77 1sju n GLN 4 Cb 0.00 0.00 0.19 0.00 0.11 0.00 0.00 30.24 30.54 1sju n GLN 4 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 1sju s HIS 5 N 0.73 1.81 -0.00 1.08 3.76 -1.26 -4.52 115.29 116.89 1sju s HIS 5 Ca 0.00 1.24 -0.01 0.00 -0.15 0.00 0.00 55.06 56.15 1sju s HIS 5 Cb 0.00 -3.18 -0.00 0.00 1.11 0.00 0.00 32.58 30.51 1sju s HIS 5 CO 0.00 -3.13 -0.01 1.28 -0.85 0.00 0.00 174.74 172.03 1sju n LEU 6 N -4.39 0.12 -1.96 0.89 7.99 -1.02 -4.92 117.00 113.70 1sju n LEU 6 Ca 0.06 0.02 0.00 0.00 -0.01 0.00 0.00 56.01 56.07 1sju n LEU 6 Cb 0.55 -0.21 0.00 0.00 -0.11 0.00 0.00 43.42 43.65 1sju n LEU 6 CO 0.56 -0.51 -0.36 0.00 -1.51 0.00 0.00 177.39 175.57 1sju n GLY 8 N 1.78 0.00 0.00 0.00 0.00 -1.26 -0.00 105.19 105.71 1sju n GLY 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1sju n GLY 8 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sju n SER 9 N 0.00 0.00 -0.08 1.61 2.88 -1.26 0.28 113.62 117.05 1sju n SER 9 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 1sju n SER 9 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 1sju n SER 9 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1sju h ASP 10 N 0.00 0.00 0.09 -3.46 1.82 -0.24 -1.50 116.42 113.13 1sju h ASP 10 Ca 0.00 -0.79 0.00 0.00 -0.39 0.00 0.00 57.03 55.85 1sju h ASP 10 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 1sju h ASP 10 CO 0.00 1.14 0.00 -0.07 -1.61 0.00 0.00 179.24 178.70 1sju h LEU 11 N -1.00 0.00 0.00 2.28 3.38 0.29 -0.94 115.31 119.32 1sju h LEU 11 Ca -0.11 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1sju h LEU 11 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1sju h LEU 11 CO -0.07 0.00 -0.82 0.52 0.09 0.00 0.00 178.44 178.16 1sju n VAL 12 N -2.53 1.46 0.33 1.22 0.31 0.79 -2.40 118.33 117.51 1sju n VAL 12 Ca -0.02 0.15 0.17 0.00 -0.01 0.00 0.00 64.34 64.63 1sju n VAL 12 Cb 0.07 -2.33 0.91 0.00 -0.91 0.00 0.00 33.84 31.58 1sju n VAL 12 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1sju h GLU 13 N -1.00 0.00 0.00 5.55 4.11 -1.15 -0.68 114.58 121.40 1sju h GLU 13 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1sju h GLU 13 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1sju h GLU 13 CO -0.04 0.00 -0.08 0.00 0.07 0.00 0.00 179.01 178.97 1sju h ALA 14 N 1.51 0.00 -1.46 1.06 0.00 -1.32 -2.70 119.26 116.35 1sju h ALA 14 Ca 0.00 -0.21 0.46 0.00 0.00 0.00 0.00 54.91 55.16 1sju h ALA 14 Cb 0.49 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.26 1sju h ALA 14 CO 0.00 0.08 1.01 1.28 0.00 0.00 0.00 179.25 181.61 1sju n LEU 15 N -2.72 0.09 0.17 0.00 4.77 -1.01 0.34 117.00 118.64 1sju n LEU 15 Ca -0.01 1.03 -0.11 0.00 -0.03 0.00 0.00 56.01 56.89 1sju n LEU 15 Cb 0.04 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 1sju n LEU 15 CO 0.02 -1.08 0.34 0.22 -1.33 0.00 0.00 177.39 175.56 1sju h TYR 16 N 0.00 -0.45 0.00 -1.77 3.20 -1.25 -2.77 116.97 113.94 1sju h TYR 16 Ca 0.79 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.65 1sju h TYR 16 Cb 2.88 0.15 0.00 0.00 1.54 0.00 0.00 36.73 41.30 1sju h TYR 16 CO -0.00 -0.14 0.00 -0.11 -1.64 0.00 0.00 178.16 176.26 1sju n LEU 17 N -5.11 0.62 -0.06 2.82 7.94 0.71 -0.98 117.00 122.93 1sju n LEU 17 Ca -0.08 0.67 -0.12 0.00 -1.11 0.00 0.00 56.01 55.36 1sju n LEU 17 Cb 0.26 -0.60 -0.06 0.00 0.53 0.00 0.00 43.42 43.55 1sju n LEU 17 CO 0.23 -0.58 0.72 0.58 -1.11 0.00 0.00 177.39 177.23 1sju h VAL 18 N 0.00 1.28 0.00 1.96 2.07 0.60 -3.38 116.25 118.77 1sju h VAL 18 Ca 0.00 -0.95 -0.11 0.00 0.82 0.00 0.00 66.70 66.46 1sju h VAL 18 Cb 0.32 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1sju h VAL 18 CO 0.00 0.28 -1.26 0.00 0.02 0.00 0.00 177.57 176.62 1sju n GLY 20 N 1.44 0.24 3.23 0.00 0.00 -0.16 -4.82 105.19 105.13 1sju n GLY 20 Ca -0.22 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.05 1sju n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sju n GLU 21 N 0.00 -5.28 -0.46 1.61 4.71 -1.22 -4.86 120.64 115.15 1sju n GLU 21 Ca 0.00 0.81 0.08 0.00 -0.01 0.00 0.00 57.16 58.05 1sju n GLU 21 Cb 0.00 -5.69 0.26 0.00 -1.01 0.00 0.00 31.44 25.00 1sju n GLU 21 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1sju n ARG 22 N -4.21 3.03 -2.16 3.49 1.74 -1.26 -5.05 116.66 112.24 1sju n ARG 22 Ca -0.07 -2.83 0.00 0.00 -0.77 0.00 0.00 57.85 54.18 1sju n ARG 22 Cb 0.59 -1.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 1sju n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sju n GLY 23 N -0.40 -5.31 1.76 -0.13 0.00 -1.26 -4.41 105.19 95.44 1sju n GLY 23 Ca 0.21 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1sju n GLY 23 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1sju n PHE 24 N 1.95 -2.78 -3.04 1.61 1.16 -1.26 -4.06 117.46 111.04 1sju n PHE 24 Ca 0.00 -0.92 -0.43 0.00 -1.87 0.00 0.00 57.45 54.22 1sju n PHE 24 Cb 0.00 -0.27 0.01 0.00 -1.61 0.00 0.00 39.48 37.61 1sju n PHE 24 CO 0.00 0.00 0.00 1.19 -1.87 0.00 0.00 176.76 176.08 1sju n PHE 25 N -1.67 2.89 -2.23 2.97 3.01 0.75 -4.69 117.46 118.49 1sju n PHE 25 Ca 0.07 -2.85 -0.13 0.00 1.01 0.00 0.00 57.45 55.56 1sju n PHE 25 Cb 0.27 -1.39 0.05 0.00 -0.01 0.00 0.00 39.48 38.40 1sju n PHE 25 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1sju n TYR 26 N 1.74 1.92 -2.51 1.38 9.36 -1.26 -4.45 117.16 123.34 1sju n TYR 26 Ca 0.26 -2.04 0.01 0.00 3.32 0.00 0.00 57.90 59.45 1sju n TYR 26 Cb 0.34 -0.29 0.05 0.00 -0.63 0.00 0.00 39.34 38.81 1sju n TYR 26 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1sju n THR 27 N -0.66 0.82 0.00 2.97 -2.24 -1.26 -4.87 114.28 109.04 1sju n THR 27 Ca 0.29 -2.10 0.00 0.00 -2.27 0.00 0.00 64.05 59.97 1sju n THR 27 Cb 0.90 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.99 1sju n THR 27 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1sju n ASP 28 N -0.12 0.00 -4.63 3.42 5.68 -1.26 -5.10 116.55 114.54 1sju n ASP 28 Ca 0.10 0.00 -0.43 0.00 -0.50 0.00 0.00 54.79 53.96 1sju n ASP 28 Cb 0.97 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.93 1sju n ASP 28 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1sju s LYS 29 N 0.00 3.80 0.31 0.11 -0.14 -1.26 -4.82 119.74 117.74 1sju s LYS 29 Ca 0.00 1.68 0.20 0.00 -1.36 0.00 0.00 55.97 56.48 1sju s LYS 29 Cb 0.00 -4.03 1.07 0.00 -1.68 0.00 0.00 37.83 33.19 1sju s LYS 29 CO 0.00 -1.29 1.59 0.41 -0.76 0.00 0.00 175.35 175.30 1sju n GLY 30 N 4.65 -0.82 3.74 -3.33 0.00 -1.26 -4.61 105.19 103.56 1sju n GLY 30 Ca 0.19 0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.98 1sju n GLY 30 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1sju s ILE 31 N -3.50 2.72 0.00 -0.61 1.10 -1.26 -4.51 121.20 115.14 1sju s ILE 31 Ca -0.02 0.59 0.00 0.00 -0.51 0.00 0.00 60.65 60.71 1sju s ILE 31 Cb 0.06 -3.38 0.00 0.00 0.15 0.00 0.00 42.46 39.29 1sju s ILE 31 CO 0.18 0.09 0.00 0.55 -2.11 0.00 0.00 174.94 173.65 1sju n VAL 32 N 2.58 0.00 1.10 4.00 3.14 -1.26 -4.91 118.33 122.97 1sju n VAL 32 Ca 0.08 0.00 0.10 0.00 -2.96 0.00 0.00 64.34 61.56 1sju n VAL 32 Cb 0.40 0.00 0.55 0.00 -1.06 0.00 0.00 33.84 33.74 1sju n VAL 32 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1sju n GLU 33 N 0.00 0.44 0.00 1.45 4.07 -1.26 -2.18 120.64 123.16 1sju n GLU 33 Ca 0.00 0.06 0.13 0.00 -0.06 0.00 0.00 57.16 57.28 1sju n GLU 33 Cb 0.00 -1.50 0.32 0.00 -0.06 0.00 0.00 31.44 30.20 1sju n GLU 33 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1sju n GLN 34 N -1.17 0.76 0.00 5.31 6.02 -1.26 -3.99 117.38 123.06 1sju n GLN 34 Ca 0.12 -0.47 0.00 0.00 -0.01 0.00 0.00 57.00 56.64 1sju n GLN 34 Cb 0.12 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.89 1sju n GLN 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1sju n THR 37 N -2.64 0.00 -3.78 0.00 5.66 -1.26 -3.93 114.28 108.33 1sju n THR 37 Ca -0.05 -0.28 -0.11 0.00 -3.05 0.00 0.00 64.05 60.56 1sju n THR 37 Cb 0.65 0.45 -0.01 0.00 -1.55 0.00 0.00 70.33 69.88 1sju n THR 37 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1sju n SER 38 N -1.84 1.88 -2.47 1.09 2.88 -1.26 -4.92 113.62 108.99 1sju n SER 38 Ca -0.01 -1.81 -0.28 0.00 -1.33 0.00 0.00 58.87 55.44 1sju n SER 38 Cb 0.39 0.01 0.01 0.00 -0.75 0.00 0.00 64.21 63.87 1sju n SER 38 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1sju n ILE 39 N -0.94 2.52 -0.43 2.46 2.08 -1.26 -4.26 119.36 119.54 1sju n ILE 39 Ca -0.02 -4.77 -0.26 0.00 0.56 0.00 0.00 62.75 58.25 1sju n ILE 39 Cb 0.26 -1.25 0.22 0.00 -0.75 0.00 0.00 39.64 38.12 1sju n ILE 39 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1sju n SER 41 N -3.44 0.00 -0.11 0.00 7.64 -1.26 -4.69 113.62 111.77 1sju n SER 41 Ca 0.07 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.72 1sju n SER 41 Cb 0.50 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.59 1sju n SER 41 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1sju n LEU 42 N 0.00 1.91 -0.29 -3.43 0.00 -1.26 -2.91 117.00 111.02 1sju n LEU 42 Ca 0.00 0.39 -0.08 0.00 0.00 0.00 0.00 56.01 56.32 1sju n LEU 42 Cb 0.00 -0.94 -0.04 0.00 0.00 0.00 0.00 43.42 42.43 1sju n LEU 42 CO 0.00 0.36 0.54 1.88 0.00 0.00 0.00 177.39 180.17 1sju h TYR 43 N -0.95 -1.45 -0.38 1.96 0.05 -1.97 2.77 116.97 117.00 1sju h TYR 43 Ca -0.42 0.10 -0.10 0.00 0.05 0.00 0.00 58.73 58.36 1sju h TYR 43 Cb 1.40 0.74 -0.01 0.00 1.01 0.00 0.00 36.73 39.86 1sju h TYR 43 CO 0.06 -0.41 -0.15 0.37 -1.05 0.00 0.00 178.16 176.98 1sju h GLN 44 N -0.14 0.77 0.00 4.88 4.15 -1.97 -2.89 115.11 119.91 1sju h GLN 44 Ca 0.20 -0.32 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 1sju h GLN 44 Cb 0.53 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.19 1sju h GLN 44 CO -0.81 0.94 -0.06 -0.07 -1.93 0.00 0.00 178.83 176.90 1sju h LEU 45 N 0.56 0.00 0.00 -2.39 3.38 -0.89 -2.72 115.31 113.25 1sju h LEU 45 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1sju h LEU 45 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1sju h LEU 45 CO 0.05 0.06 0.00 1.21 0.09 0.00 0.00 178.44 179.85 1sju n GLU 46 N -3.16 0.76 -0.49 1.13 0.00 0.91 -2.69 120.64 117.10 1sju n GLU 46 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 57.16 57.27 1sju n GLU 46 Cb 0.37 -1.41 0.34 0.00 0.00 0.00 0.00 31.44 30.74 1sju n GLU 46 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1sju n ASN 47 N -0.91 4.26 0.00 4.31 4.13 -1.03 -4.29 115.26 121.74 1sju n ASN 47 Ca 0.15 -2.22 0.00 0.00 1.68 0.00 0.00 54.58 54.19 1sju n ASN 47 Cb 0.07 -0.53 0.00 0.00 -1.54 0.00 0.00 39.78 37.78 1sju n ASN 47 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1sju n TYR 48 N 1.36 0.00 -4.38 3.10 4.01 -1.09 -4.95 117.16 115.21 1sju n TYR 48 Ca 0.25 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.73 1sju n TYR 48 Cb 0.74 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.68 1sju n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40