#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 -2.13 1.97 0.24 -1.26 -5.02 118.33 112.13 1sju n VAL 2 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 62.10 1sju n VAL 2 Cb 0.00 -0.20 -0.04 0.00 -1.47 0.00 0.00 33.84 32.14 1sju n VAL 2 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1sju n ASN 3 N -2.02 -5.62 -0.94 -1.34 5.03 -1.26 -4.91 115.26 104.20 1sju n ASN 3 Ca 0.00 0.17 0.00 0.00 0.87 0.00 0.00 54.58 55.62 1sju n ASN 3 Cb 0.00 -4.78 0.00 0.00 -1.02 0.00 0.00 39.78 33.98 1sju n ASN 3 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1sju n GLN 4 N -2.77 0.00 -0.60 3.52 10.64 -1.26 -5.06 117.38 121.84 1sju n GLN 4 Ca -0.23 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 54.63 1sju n GLN 4 Cb 0.68 0.00 0.20 0.00 -0.86 0.00 0.00 30.24 30.26 1sju n GLN 4 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1sju n HIS 5 N 0.00 -1.39 0.00 2.61 8.25 -1.26 -4.56 115.22 118.86 1sju n HIS 5 Ca 0.00 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1sju n HIS 5 Cb 0.00 -1.61 0.00 0.00 1.12 0.00 0.00 29.99 29.50 1sju n HIS 5 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1sju n LEU 6 N -2.83 0.00 -1.65 2.41 7.99 -0.95 -5.01 117.00 116.96 1sju n LEU 6 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 1sju n LEU 6 Cb 0.59 0.03 0.00 0.00 -0.11 0.00 0.00 43.42 43.94 1sju n LEU 6 CO 0.54 -0.47 -0.45 0.00 -1.51 0.00 0.00 177.39 175.49 1sju n GLY 8 N -0.33 -0.59 0.00 0.00 0.00 -1.25 0.25 105.19 103.27 1sju n GLY 8 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 -4.46 0.00 0.13 1.61 2.88 -1.26 -0.55 113.62 111.97 1sju n SER 9 Ca 0.04 0.93 0.13 0.00 -1.33 0.00 0.00 58.87 58.64 1sju n SER 9 Cb 0.13 -0.43 0.34 0.00 -0.75 0.00 0.00 64.21 63.50 1sju n SER 9 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1sju h ASP 10 N 0.00 0.00 -0.62 -3.46 3.32 -0.46 -2.33 116.42 112.88 1sju h ASP 10 Ca 0.00 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 1sju h ASP 10 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1sju h ASP 10 CO 0.00 0.00 0.19 0.25 -1.72 0.00 0.00 179.24 177.96 1sju h LEU 11 N 0.00 0.91 0.06 1.55 7.12 0.42 -1.86 115.31 123.51 1sju h LEU 11 Ca 0.00 -0.21 -0.36 0.00 0.13 0.00 0.00 57.88 57.44 1sju h LEU 11 Cb 0.80 -0.24 -0.04 0.00 -0.53 0.00 0.00 40.66 40.65 1sju h LEU 11 CO 0.00 0.88 -2.09 1.33 -0.13 0.00 0.00 178.44 178.43 1sju n VAL 12 N -4.38 1.65 -0.08 1.05 0.24 0.29 -2.71 118.33 114.39 1sju n VAL 12 Ca 0.04 -0.68 0.15 0.00 -2.04 0.00 0.00 64.34 61.80 1sju n VAL 12 Cb 0.21 -1.40 0.55 0.00 -1.47 0.00 0.00 33.84 31.74 1sju n VAL 12 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1sju h GLU 13 N 0.03 0.29 0.00 7.34 4.81 -1.45 0.16 114.58 125.76 1sju h GLU 13 Ca -0.44 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1sju h GLU 13 Cb 2.02 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 31.34 1sju h GLU 13 CO 0.04 0.19 -0.01 0.00 -0.73 0.00 0.00 179.01 178.50 1sju h ALA 14 N 1.69 0.00 -1.64 2.92 0.00 -1.47 -2.82 119.26 117.94 1sju h ALA 14 Ca 0.30 -0.44 0.48 0.00 0.00 0.00 0.00 54.91 55.24 1sju h ALA 14 Cb 0.77 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 1sju h ALA 14 CO -0.07 0.00 1.19 -0.07 0.00 0.00 0.00 179.25 180.31 1sju h LEU 15 N -1.00 0.00 0.19 0.00 3.38 -1.05 3.46 115.31 120.29 1sju h LEU 15 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1sju h LEU 15 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1sju h LEU 15 CO -0.00 0.00 -0.09 0.22 0.09 0.00 0.00 178.44 178.66 1sju h TYR 16 N 0.00 -0.23 0.00 1.13 3.20 -0.63 -1.44 116.97 118.99 1sju h TYR 16 Ca 0.78 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.64 1sju h TYR 16 Cb 3.16 0.08 0.00 0.00 1.54 0.00 0.00 36.73 41.51 1sju h TYR 16 CO 0.00 0.15 0.00 1.25 -1.64 0.00 0.00 178.16 177.92 1sju h LEU 17 N -0.68 0.00 -0.23 2.82 7.12 0.46 -2.32 115.31 122.47 1sju h LEU 17 Ca -0.03 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 57.91 1sju h LEU 17 Cb 0.49 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.61 1sju h LEU 17 CO 0.04 0.00 -0.15 0.58 -0.13 0.00 0.00 178.44 178.78 1sju h VAL 18 N 0.00 1.31 0.00 1.05 2.07 0.56 -3.36 116.25 117.88 1sju h VAL 18 Ca 0.00 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1sju h VAL 18 Cb 0.43 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1sju h VAL 18 CO 0.00 0.39 -0.03 0.00 0.02 0.00 0.00 177.57 177.95 1sju n GLY 20 N 1.87 1.17 0.45 0.00 0.00 -0.90 -4.91 105.19 102.88 1sju n GLY 20 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1sju n GLY 20 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1sju n GLU 21 N 0.00 0.00 -0.77 1.61 4.07 -1.26 -4.86 120.64 119.43 1sju n GLU 21 Ca 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 1sju n GLU 21 Cb 0.00 0.00 0.20 0.00 -0.06 0.00 0.00 31.44 31.58 1sju n GLU 21 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1sju n ARG 22 N 0.00 1.77 0.00 5.31 1.74 -1.26 -5.08 116.66 119.14 1sju n ARG 22 Ca 0.00 -3.26 0.00 0.00 -0.77 0.00 0.00 57.85 53.82 1sju n ARG 22 Cb 0.49 -1.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 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 -1.12 0.71 2.06 -0.13 0.00 -1.26 -4.40 105.19 101.05 1sju n GLY 23 Ca 0.29 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 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 0.00 -1.04 -4.09 1.61 1.16 -1.26 -3.50 117.46 110.34 1sju n PHE 24 Ca 0.00 -1.45 -0.35 0.00 -1.87 0.00 0.00 57.45 53.78 1sju n PHE 24 Cb 0.00 0.33 -0.07 0.00 -1.61 0.00 0.00 39.48 38.13 1sju n PHE 24 CO 0.00 0.00 0.00 0.12 -1.87 0.00 0.00 176.76 175.01 1sju s PHE 25 N -3.69 3.39 -0.02 2.97 2.19 0.40 -4.90 117.98 118.31 1sju s PHE 25 Ca 0.18 0.34 0.06 0.00 0.33 0.00 0.00 56.93 57.84 1sju s PHE 25 Cb -0.01 -1.84 0.11 0.00 -1.31 0.00 0.00 43.02 39.98 1sju s PHE 25 CO 0.13 0.61 1.06 0.66 1.83 0.00 0.00 175.22 179.51 1sju n TYR 26 N 1.77 -0.10 -0.66 10.12 4.01 -1.26 -4.82 117.16 126.22 1sju n TYR 26 Ca -0.17 -0.59 0.08 0.00 -0.16 0.00 0.00 57.90 57.06 1sju n TYR 26 Cb 0.54 0.43 0.37 0.00 -0.31 0.00 0.00 39.34 40.37 1sju n TYR 26 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1sju n THR 27 N -0.00 2.13 0.00 -0.72 -2.24 -1.26 -4.63 114.28 107.55 1sju n THR 27 Ca -0.21 -1.23 0.00 0.00 -2.27 0.00 0.00 64.05 60.35 1sju n THR 27 Cb 0.80 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 1sju n THR 27 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1sju n ASP 28 N 0.93 0.00 -4.04 3.42 2.03 -1.26 -5.07 116.55 112.55 1sju n ASP 28 Ca 0.26 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.35 1sju n ASP 28 Cb 0.99 -0.05 -0.15 0.00 -0.72 0.00 0.00 41.12 41.18 1sju n ASP 28 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1sju s LYS 29 N -0.46 1.13 0.36 -0.67 2.20 -1.26 -5.00 119.74 116.03 1sju s LYS 29 Ca 0.00 -0.39 0.14 0.00 -0.36 0.00 0.00 55.97 55.36 1sju s LYS 29 Cb 0.00 -1.04 1.01 0.00 -1.51 0.00 0.00 37.83 36.29 1sju s LYS 29 CO 0.00 0.17 1.73 0.78 -0.36 0.00 0.00 175.35 177.67 1sju h GLY 30 N 6.25 1.64 -4.04 5.54 0.00 -1.98 -3.43 103.07 107.05 1sju h GLY 30 Ca -0.33 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1sju h GLY 30 CO 0.49 -0.23 -0.01 4.51 0.00 0.00 0.00 176.54 181.29 1sju n ILE 31 N -4.79 -0.02 -0.07 2.60 0.00 -1.26 -4.62 119.36 111.20 1sju n ILE 31 Ca 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 62.75 62.94 1sju n ILE 31 Cb 0.85 -0.08 -0.08 0.00 0.00 0.00 0.00 39.64 40.33 1sju n ILE 31 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1sju n VAL 32 N -2.09 0.81 0.20 9.51 0.24 -1.26 -4.33 118.33 121.41 1sju n VAL 32 Ca -0.01 -0.38 0.10 0.00 -2.04 0.00 0.00 64.34 62.01 1sju n VAL 32 Cb 0.36 -0.90 0.48 0.00 -1.47 0.00 0.00 33.84 32.31 1sju n VAL 32 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1sju n GLU 33 N -2.74 0.13 0.04 7.34 0.28 -1.26 -1.04 120.64 123.38 1sju n GLU 33 Ca -0.23 0.57 -0.09 0.00 -0.16 0.00 0.00 57.16 57.25 1sju n GLU 33 Cb 0.81 -1.87 -0.13 0.00 1.43 0.00 0.00 31.44 31.68 1sju n GLU 33 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 1sju h GLN 34 N 0.00 0.03 -0.00 3.44 4.15 -1.94 -3.28 115.11 117.51 1sju h GLN 34 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1sju h GLN 34 Cb 0.08 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.79 1sju h GLN 34 CO 0.00 0.86 -0.44 0.00 -1.93 0.00 0.00 178.83 177.32 1sju n THR 37 N -2.59 0.02 -2.03 0.00 5.66 -1.24 -4.62 114.28 109.49 1sju n THR 37 Ca 0.05 -0.01 -0.29 0.00 -3.05 0.00 0.00 64.05 60.75 1sju n THR 37 Cb 0.45 -0.56 0.19 0.00 -1.55 0.00 0.00 70.33 68.86 1sju n THR 37 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1sju s SER 38 N -3.94 3.14 -0.59 1.09 0.01 -0.83 -4.94 113.70 107.65 1sju s SER 38 Ca -0.00 0.13 -0.00 0.00 1.31 0.00 0.00 55.95 57.38 1sju s SER 38 Cb 0.00 -0.16 0.15 0.00 0.21 0.00 0.00 66.02 66.22 1sju s SER 38 CO 0.01 -2.70 0.37 -0.63 0.41 0.00 0.00 173.24 170.70 1sju s ILE 39 N -3.82 3.32 0.22 1.44 -1.09 -1.26 -4.54 121.20 115.47 1sju s ILE 39 Ca 0.74 -3.06 0.06 0.00 -2.23 0.00 0.00 60.65 56.16 1sju s ILE 39 Cb -0.03 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.60 1sju s ILE 39 CO 0.52 -0.85 0.19 0.00 -1.23 0.00 0.00 174.94 173.58 1sju n SER 41 N -0.91 0.00 0.00 0.00 3.41 -1.26 -4.75 113.62 110.11 1sju n SER 41 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 1sju n SER 41 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1sju n SER 41 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1sju n LEU 42 N 0.00 0.16 -0.08 1.04 4.32 -1.26 -2.92 117.00 118.25 1sju n LEU 42 Ca 0.00 0.44 -0.02 0.00 -0.02 0.00 0.00 56.01 56.41 1sju n LEU 42 Cb 0.00 -0.47 -0.02 0.00 -1.62 0.00 0.00 43.42 41.31 1sju n LEU 42 CO 0.00 -0.47 0.11 -1.22 -1.22 0.00 0.00 177.39 174.59 1sju n TYR 43 N -1.95 -0.08 -0.01 -1.77 4.01 -1.26 0.34 117.16 116.43 1sju n TYR 43 Ca 0.00 0.23 -0.12 0.00 -0.16 0.00 0.00 57.90 57.85 1sju n TYR 43 Cb 0.00 -0.45 -0.08 0.00 -0.31 0.00 0.00 39.34 38.50 1sju n TYR 43 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 1sju h GLN 44 N 0.00 0.07 0.00 -0.72 1.08 -1.97 -2.90 115.11 110.66 1sju h GLN 44 Ca 0.03 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1sju h GLN 44 Cb 0.08 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1sju h GLN 44 CO -0.18 0.35 0.00 -0.07 -0.95 0.00 0.00 178.83 177.98 1sju h LEU 45 N -0.23 0.00 0.00 1.46 3.38 0.80 -2.83 115.31 117.90 1sju h LEU 45 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1sju h LEU 45 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1sju h LEU 45 CO 0.00 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.91 1sju n GLU 46 N -2.98 0.67 -0.26 1.13 -0.58 1.03 -2.85 120.64 116.80 1sju n GLU 46 Ca 0.02 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.80 1sju n GLU 46 Cb 0.34 -1.27 0.07 0.00 -0.57 0.00 0.00 31.44 30.02 1sju n GLU 46 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1sju n ASN 47 N -0.77 1.20 -0.00 1.62 3.02 -1.07 -4.74 115.26 114.53 1sju n ASN 47 Ca 0.09 -2.50 0.03 0.00 -0.03 0.00 0.00 54.58 52.16 1sju n ASN 47 Cb 0.04 -0.30 -0.03 0.00 -0.61 0.00 0.00 39.78 38.88 1sju n ASN 47 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1sju n TYR 48 N -0.72 0.00 -2.82 3.10 4.01 -1.13 -5.04 117.16 114.56 1sju n TYR 48 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1sju n TYR 48 Cb 0.65 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 1sju n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40