#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 -0.80 1.97 0.24 -1.26 -4.75 118.33 113.72 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 -3.20 -2.14 0.00 0.00 176.83 171.49 1sju n ASN 3 N -1.01 -0.36 -3.17 -1.34 2.85 -1.26 -4.90 115.26 106.07 1sju n ASN 3 Ca 0.00 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.39 1sju n ASN 3 Cb 0.00 -1.13 0.01 0.00 1.24 0.00 0.00 39.78 39.91 1sju n ASN 3 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1sju s GLN 4 N -0.46 2.02 0.78 1.20 -0.21 -1.26 -5.03 119.66 116.70 1sju s GLN 4 Ca 0.00 -1.27 -0.09 0.00 0.02 0.00 0.00 55.36 54.02 1sju s GLN 4 Cb 0.00 0.59 0.10 0.00 1.00 0.00 0.00 33.01 34.70 1sju s GLN 4 CO 0.00 -0.94 1.11 -3.38 -2.12 0.00 0.00 175.29 169.95 1sju s HIS 5 N -2.62 2.54 0.00 0.91 0.00 -1.24 -3.28 115.29 111.60 1sju s HIS 5 Ca 0.15 0.41 0.00 0.00 -3.00 0.00 0.00 55.06 52.63 1sju s HIS 5 Cb -0.05 -3.42 0.00 0.00 -4.00 0.00 0.00 32.58 25.11 1sju s HIS 5 CO 0.10 -1.76 0.00 1.28 -1.00 0.00 0.00 174.74 173.35 1sju n LEU 6 N -3.17 0.15 -1.66 5.38 4.77 -1.09 -4.91 117.00 116.48 1sju n LEU 6 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1sju n LEU 6 Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1sju n LEU 6 CO 0.51 -0.08 -0.50 0.00 -1.33 0.00 0.00 177.39 175.99 1sju n GLY 8 N -2.15 0.00 0.10 0.00 0.00 -1.26 0.19 105.19 102.08 1sju n GLY 8 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.03 -0.20 0.00 1.61 2.88 -1.26 0.31 113.62 116.93 1sju n SER 9 Ca 0.00 0.46 -0.11 0.00 -1.33 0.00 0.00 58.87 57.89 1sju n SER 9 Cb 0.00 -0.09 -0.14 0.00 -0.75 0.00 0.00 64.21 63.23 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 0.09 -0.04 -3.46 5.19 0.76 -2.90 116.42 116.06 1sju h ASP 10 Ca 0.08 -0.17 -0.01 0.00 -0.62 0.00 0.00 57.03 56.30 1sju h ASP 10 Cb 0.14 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.62 1sju h ASP 10 CO -0.26 1.15 -0.02 -0.07 -3.12 0.00 0.00 179.24 176.92 1sju h LEU 11 N 0.02 0.09 -1.36 1.55 3.38 1.42 -2.22 115.31 118.18 1sju h LEU 11 Ca -0.26 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.24 1sju h LEU 11 Cb 1.98 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.70 1sju h LEU 11 CO 0.10 0.49 -0.26 0.58 0.09 0.00 0.00 178.44 179.43 1sju h VAL 12 N -0.31 0.81 -0.38 1.22 2.07 0.48 0.32 116.25 120.45 1sju h VAL 12 Ca 0.01 -1.07 -0.12 0.00 0.82 0.00 0.00 66.70 66.33 1sju h VAL 12 Cb 0.45 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1sju h VAL 12 CO 0.01 0.26 -0.25 -0.08 0.02 0.00 0.00 177.57 177.53 1sju h GLU 13 N 0.00 0.84 0.00 1.57 4.81 -1.33 -2.78 114.58 117.70 1sju h GLU 13 Ca -0.00 -0.40 -0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1sju h GLU 13 Cb 0.63 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.00 1sju h GLU 13 CO 0.03 1.04 -0.00 0.00 -0.73 0.00 0.00 179.01 179.35 1sju h ALA 14 N 0.79 -0.01 -1.72 2.92 0.00 -1.09 -2.76 119.26 117.39 1sju h ALA 14 Ca 0.08 -0.44 0.51 0.00 0.00 0.00 0.00 54.91 55.06 1sju h ALA 14 Cb 0.82 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.53 1sju h ALA 14 CO 0.07 -0.02 1.22 1.28 0.00 0.00 0.00 179.25 181.80 1sju n LEU 15 N -4.65 0.04 -0.01 0.00 4.77 0.11 0.42 117.00 117.68 1sju n LEU 15 Ca -0.09 0.98 -0.10 0.00 -0.03 0.00 0.00 56.01 56.77 1sju n LEU 15 Cb 0.42 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 40.94 1sju n LEU 15 CO 0.31 -1.00 0.34 0.22 -1.33 0.00 0.00 177.39 175.93 1sju h TYR 16 N 0.00 -0.09 0.00 -1.77 3.20 -1.44 -3.11 116.97 113.77 1sju h TYR 16 Ca 0.86 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.72 1sju h TYR 16 Cb 3.32 0.03 0.00 0.00 1.54 0.00 0.00 36.73 41.62 1sju h TYR 16 CO -0.00 0.47 0.00 1.25 -1.64 0.00 0.00 178.16 178.24 1sju h LEU 17 N -0.91 0.00 -0.40 2.82 5.85 0.45 1.01 115.31 124.14 1sju h LEU 17 Ca -0.01 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1sju h LEU 17 Cb 0.59 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1sju h LEU 17 CO 0.02 0.00 0.15 0.58 -0.34 0.00 0.00 178.44 178.85 1sju h VAL 18 N 0.00 1.20 0.00 1.05 2.07 0.85 -3.37 116.25 118.05 1sju h VAL 18 Ca 0.00 -0.64 -0.17 0.00 0.82 0.00 0.00 66.70 66.72 1sju h VAL 18 Cb 0.47 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1sju h VAL 18 CO 0.00 0.23 -1.57 0.00 0.02 0.00 0.00 177.57 176.25 1sju n GLY 20 N 2.53 2.30 0.68 0.00 0.00 0.35 -4.87 105.19 106.18 1sju n GLY 20 Ca -0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 46.02 45.46 1sju n GLY 20 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1sju n GLU 21 N 0.00 0.00 0.06 1.61 0.28 -1.26 -4.64 120.64 116.69 1sju n GLU 21 Ca 0.00 -0.40 0.10 0.00 -0.16 0.00 0.00 57.16 56.70 1sju n GLU 21 Cb 0.00 0.46 0.40 0.00 1.43 0.00 0.00 31.44 33.73 1sju n GLU 21 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1sju n ARG 22 N 0.00 0.09 0.00 3.44 5.12 -1.26 -4.84 116.66 119.21 1sju n ARG 22 Ca -0.11 0.30 0.00 0.00 -1.93 0.00 0.00 57.85 56.11 1sju n ARG 22 Cb 0.43 -1.66 0.00 0.00 -1.16 0.00 0.00 32.46 30.06 1sju n ARG 22 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1sju n GLY 23 N 0.13 3.29 6.78 -0.13 0.00 -1.26 -4.90 105.19 109.10 1sju n GLY 23 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.00 -1.17 0.00 1.61 -1.74 -1.26 -4.84 117.46 108.06 1sju n PHE 24 Ca 0.00 0.01 0.00 0.00 -0.56 0.00 0.00 57.45 56.90 1sju n PHE 24 Cb 0.00 0.02 0.00 0.00 1.52 0.00 0.00 39.48 41.02 1sju n PHE 24 CO 0.00 0.00 0.00 1.19 -0.56 0.00 0.00 176.76 177.39 1sju n PHE 25 N -0.30 0.00 -2.86 2.97 3.72 0.16 -4.91 117.46 116.25 1sju n PHE 25 Ca 0.00 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.21 1sju n PHE 25 Cb 0.00 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.57 1sju n PHE 25 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 1sju n TYR 26 N 0.00 -1.60 -3.21 1.38 9.36 -1.26 -4.99 117.16 116.83 1sju n TYR 26 Ca 0.00 0.41 0.00 0.00 3.32 0.00 0.00 57.90 61.63 1sju n TYR 26 Cb 0.00 -3.93 0.00 0.00 -0.63 0.00 0.00 39.34 34.78 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 -4.30 0.00 0.00 2.97 -2.24 -1.26 -4.18 114.28 105.27 1sju n THR 27 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1sju n THR 27 Cb 0.61 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 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 -1.14 0.00 -0.75 3.42 2.03 -1.26 0.01 116.55 118.86 1sju n ASP 28 Ca 0.00 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.39 1sju n ASP 28 Cb 0.00 0.00 0.24 0.00 -0.72 0.00 0.00 41.12 40.64 1sju n ASP 28 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1sju n LYS 29 N 0.00 2.57 -1.01 -0.67 4.81 -1.26 -4.92 118.16 117.67 1sju n LYS 29 Ca 0.00 -2.81 -0.07 0.00 -0.87 0.00 0.00 58.31 54.56 1sju n LYS 29 Cb 0.00 -1.78 -0.03 0.00 0.02 0.00 0.00 35.03 33.24 1sju n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1sju n GLY 30 N -0.71 0.64 2.58 3.14 0.00 0.10 -3.38 105.19 107.56 1sju n GLY 30 Ca 0.21 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 1sju n GLY 30 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1sju n ILE 31 N -1.58 -0.10 1.12 -0.61 -0.00 -1.26 -4.65 119.36 112.27 1sju n ILE 31 Ca -0.07 -0.05 0.06 0.00 -0.00 0.00 0.00 62.75 62.69 1sju n ILE 31 Cb 0.38 -0.19 0.19 0.00 -0.00 0.00 0.00 39.64 40.02 1sju n ILE 31 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 1sju n VAL 32 N -1.66 0.35 1.22 7.28 3.14 -1.22 -3.58 118.33 123.87 1sju n VAL 32 Ca -0.01 -0.38 0.13 0.00 -2.96 0.00 0.00 64.34 61.12 1sju n VAL 32 Cb 0.15 0.21 0.30 0.00 -1.06 0.00 0.00 33.84 33.44 1sju n VAL 32 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1sju n GLU 33 N 0.32 1.30 -0.00 1.45 1.02 -1.26 -3.06 120.64 120.40 1sju n GLU 33 Ca 0.11 -0.89 0.06 0.00 -0.02 0.00 0.00 57.16 56.42 1sju n GLU 33 Cb 0.26 -1.48 0.05 0.00 -0.02 0.00 0.00 31.44 30.25 1sju n GLU 33 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1sju n GLN 34 N -0.08 0.67 -0.98 3.49 1.13 -1.23 -4.55 117.38 115.82 1sju n GLN 34 Ca 0.13 -1.22 -0.00 0.00 -1.94 0.00 0.00 57.00 53.98 1sju n GLN 34 Cb 0.41 -1.23 -0.01 0.00 0.11 0.00 0.00 30.24 29.52 1sju n GLN 34 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1sju h THR 37 N 0.00 1.49 -0.51 0.00 1.35 -1.80 -3.43 112.91 110.01 1sju h THR 37 Ca 0.00 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.05 1sju h THR 37 Cb 0.45 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 1sju h THR 37 CO 0.00 0.50 0.00 -0.24 -0.25 0.00 0.00 175.52 175.53 1sju n SER 38 N -4.50 0.00 -4.78 5.36 2.88 -1.26 -4.96 113.62 106.36 1sju n SER 38 Ca -0.09 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.09 1sju n SER 38 Cb 0.49 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.87 1sju n SER 38 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1sju s ILE 39 N 3.48 5.41 1.15 2.46 -1.09 -1.26 -3.64 121.20 127.71 1sju s ILE 39 Ca 0.00 0.27 -0.16 0.00 -2.23 0.00 0.00 60.65 58.53 1sju s ILE 39 Cb 0.00 -3.48 0.26 0.00 -1.58 0.00 0.00 42.46 37.66 1sju s ILE 39 CO 0.00 0.49 1.06 0.00 -1.23 0.00 0.00 174.94 175.26 1sju s SER 41 N -3.30 0.69 0.10 0.00 0.15 -1.26 -4.80 113.70 105.28 1sju s SER 41 Ca 0.68 -1.34 0.04 0.00 0.70 0.00 0.00 55.95 56.03 1sju s SER 41 Cb -0.17 0.82 0.32 0.00 -1.71 0.00 0.00 66.02 65.28 1sju s SER 41 CO 0.59 -0.26 0.43 -0.11 1.20 0.00 0.00 173.24 175.10 1sju n LEU 42 N 4.39 0.06 0.19 3.45 0.00 -1.26 0.10 117.00 123.93 1sju n LEU 42 Ca 0.10 0.46 -0.13 0.00 0.00 0.00 0.00 56.01 56.44 1sju n LEU 42 Cb 0.47 -0.21 -0.07 0.00 0.00 0.00 0.00 43.42 43.62 1sju n LEU 42 CO 0.06 -0.50 0.52 1.88 0.00 0.00 0.00 177.39 179.35 1sju h TYR 43 N 0.00 -1.00 -0.38 1.96 0.05 -1.98 0.99 116.97 116.61 1sju h TYR 43 Ca 0.21 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.96 1sju h TYR 43 Cb 0.53 0.39 -0.02 0.00 1.01 0.00 0.00 36.73 38.65 1sju h TYR 43 CO -0.04 -0.47 0.07 1.96 -1.05 0.00 0.00 178.16 178.63 1sju h GLN 44 N -0.69 0.62 -0.81 4.88 4.20 0.26 -2.59 115.11 120.98 1sju h GLN 44 Ca -0.04 -0.16 0.09 0.00 0.06 0.00 0.00 58.65 58.60 1sju h GLN 44 Cb 0.61 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.26 1sju h GLN 44 CO -0.06 0.68 0.53 1.25 -0.67 0.00 0.00 178.83 180.56 1sju h LEU 45 N 0.47 0.70 -0.05 1.46 6.46 -0.98 0.28 115.31 123.66 1sju h LEU 45 Ca 0.12 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.89 1sju h LEU 45 Cb 0.35 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.15 1sju h LEU 45 CO 0.01 0.42 0.00 -0.62 -0.62 0.00 0.00 178.44 177.63 1sju n GLU 46 N -4.50 0.01 0.00 1.25 -0.58 0.34 -1.81 120.64 115.34 1sju n GLU 46 Ca 0.13 0.46 0.00 0.00 -0.42 0.00 0.00 57.16 57.34 1sju n GLU 46 Cb 0.30 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 1sju n GLU 46 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1sju n ASN 47 N -1.53 0.18 -0.86 1.62 5.15 0.99 -3.06 115.26 117.76 1sju n ASN 47 Ca 0.01 -1.91 0.05 0.00 -0.60 0.00 0.00 54.58 52.13 1sju n ASN 47 Cb 0.03 -0.09 0.14 0.00 -0.53 0.00 0.00 39.78 39.33 1sju n ASN 47 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1sju n TYR 48 N -0.40 0.00 -3.56 1.20 4.01 -0.75 -5.02 117.16 112.65 1sju n TYR 48 Ca 0.00 -1.13 -0.08 0.00 -0.16 0.00 0.00 57.90 56.53 1sju n TYR 48 Cb 0.05 -0.21 -0.02 0.00 -0.31 0.00 0.00 39.34 38.85 1sju n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40