#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 -1.47 1.97 0.24 -1.26 -4.53 118.33 113.28 1sju n VAL 2 Ca 0.00 -1.42 -0.04 0.00 -2.04 0.00 0.00 64.34 60.84 1sju n VAL 2 Cb 0.00 1.46 0.02 0.00 -1.47 0.00 0.00 33.84 33.85 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 1.46 0.07 0.00 -1.34 3.02 -1.26 -5.09 115.26 112.11 1sju n ASN 3 Ca 0.08 -1.09 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 1sju n ASN 3 Cb 0.65 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 1sju n ASN 3 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1sju n GLN 4 N -1.35 0.00 -2.33 3.52 7.27 -1.26 -4.74 117.38 118.49 1sju n GLN 4 Ca 0.02 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.77 1sju n GLN 4 Cb 0.08 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 32.71 1sju n GLN 4 CO 0.00 0.00 0.00 -1.01 0.07 0.00 0.00 177.06 176.12 1sju s HIS 5 N 0.38 3.22 -0.00 3.69 3.76 -1.26 -4.06 115.29 121.03 1sju s HIS 5 Ca 0.00 1.51 -0.00 0.00 -0.15 0.00 0.00 55.06 56.42 1sju s HIS 5 Cb 0.00 -2.91 -0.00 0.00 1.11 0.00 0.00 32.58 30.78 1sju s HIS 5 CO 0.00 -0.67 -0.00 1.28 -0.85 0.00 0.00 174.74 174.50 1sju n LEU 6 N -1.59 0.05 -2.07 0.89 7.99 -0.87 -4.93 117.00 116.47 1sju n LEU 6 Ca 0.08 0.01 0.00 0.00 -0.01 0.00 0.00 56.01 56.08 1sju n LEU 6 Cb 0.53 -0.19 0.00 0.00 -0.11 0.00 0.00 43.42 43.65 1sju n LEU 6 CO 0.45 -0.50 -0.46 0.00 -1.51 0.00 0.00 177.39 175.37 1sju n GLY 8 N 1.79 0.00 0.00 0.00 0.00 -1.26 -0.91 105.19 104.81 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 0.11 1.61 2.88 -1.26 0.92 113.62 117.87 1sju n SER 9 Ca 0.00 0.71 0.12 0.00 -1.33 0.00 0.00 58.87 58.36 1sju n SER 9 Cb 0.00 -0.27 0.46 0.00 -0.75 0.00 0.00 64.21 63.65 1sju n SER 9 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1sju n ASP 10 N -2.14 0.60 0.23 -3.46 9.92 -0.09 -1.94 116.55 119.67 1sju n ASP 10 Ca 0.00 0.63 -0.15 0.00 -0.53 0.00 0.00 54.79 54.75 1sju n ASP 10 Cb 0.00 -0.76 -0.08 0.00 -0.64 0.00 0.00 41.12 39.63 1sju n ASP 10 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1sju h LEU 11 N 0.00 -0.49 0.07 0.64 7.12 0.10 -2.85 115.31 119.91 1sju h LEU 11 Ca 0.00 -0.08 -0.28 0.00 0.13 0.00 0.00 57.88 57.65 1sju h LEU 11 Cb 0.40 0.13 0.02 0.00 -0.53 0.00 0.00 40.66 40.67 1sju h LEU 11 CO 0.00 -0.19 -1.21 -0.37 -0.13 0.00 0.00 178.44 176.54 1sju h VAL 12 N -0.79 1.39 -1.15 1.05 -1.51 -0.65 -2.80 116.25 111.79 1sju h VAL 12 Ca -0.06 -2.70 0.33 0.00 -1.23 0.00 0.00 66.70 63.04 1sju h VAL 12 Cb 0.54 2.77 -0.05 0.00 -2.13 0.00 0.00 31.29 32.42 1sju h VAL 12 CO 0.10 0.80 0.97 -0.08 -1.23 0.00 0.00 177.57 178.14 1sju h GLU 13 N 0.18 0.00 0.00 5.19 4.81 -1.42 0.99 114.58 124.32 1sju h GLU 13 Ca -0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1sju h GLU 13 Cb 1.89 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.27 1sju h GLU 13 CO 0.21 0.00 -0.22 0.00 -0.73 0.00 0.00 179.01 178.28 1sju h ALA 14 N 1.13 0.00 -1.86 2.92 0.00 -1.39 -2.44 119.26 117.62 1sju h ALA 14 Ca 0.54 -0.22 0.54 0.00 0.00 0.00 0.00 54.91 55.77 1sju h ALA 14 Cb 2.49 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 20.42 1sju h ALA 14 CO -0.01 0.22 1.33 -0.07 0.00 0.00 0.00 179.25 180.73 1sju h LEU 15 N -0.98 0.00 0.17 0.00 4.07 -0.38 3.85 115.31 122.05 1sju h LEU 15 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.96 1sju h LEU 15 Cb 0.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1sju h LEU 15 CO 0.00 -0.00 -0.08 0.22 -1.08 0.00 0.00 178.44 177.50 1sju h TYR 16 N 0.00 -0.21 0.00 1.13 3.20 0.79 -1.13 116.97 120.75 1sju h TYR 16 Ca 0.89 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.75 1sju h TYR 16 Cb 3.55 0.07 0.00 0.00 1.54 0.00 0.00 36.73 41.89 1sju h TYR 16 CO -0.00 0.18 0.00 1.37 -1.64 0.00 0.00 178.16 178.07 1sju h LEU 17 N -0.94 0.00 -0.30 2.82 8.10 0.14 1.71 115.31 126.84 1sju h LEU 17 Ca -0.02 0.00 -0.20 0.00 0.11 0.00 0.00 57.88 57.76 1sju h LEU 17 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.70 1sju h LEU 17 CO 0.04 0.00 -0.77 0.58 -4.11 0.00 0.00 178.44 174.17 1sju h VAL 18 N 0.00 1.35 0.00 0.15 2.07 0.68 -3.41 116.25 117.09 1sju h VAL 18 Ca 0.00 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.40 1sju h VAL 18 Cb 0.66 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1sju h VAL 18 CO 0.00 0.65 -0.15 0.00 0.02 0.00 0.00 177.57 178.09 1sju n GLY 20 N 2.76 -1.61 0.00 0.00 0.00 0.58 -4.92 105.19 102.00 1sju n GLY 20 Ca -0.02 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.80 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 0.29 0.00 -0.59 1.61 2.13 -1.26 -4.95 120.64 117.87 1sju n GLU 21 Ca 0.02 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.92 1sju n GLU 21 Cb 0.39 0.00 0.33 0.00 0.27 0.00 0.00 31.44 32.42 1sju n GLU 21 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1sju n ARG 22 N -0.03 3.72 0.00 5.31 0.00 -1.26 -5.06 116.66 119.33 1sju n ARG 22 Ca 0.00 -2.85 0.00 0.00 -0.00 0.00 0.00 57.85 55.00 1sju n ARG 22 Cb 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 32.46 30.57 1sju n ARG 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1sju n GLY 23 N 0.65 -4.21 3.17 5.14 0.00 -1.26 -4.89 105.19 103.78 1sju n GLY 23 Ca 0.24 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.02 1sju n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1sju s PHE 24 N -0.93 -0.35 -0.30 1.61 -0.12 -1.26 -3.93 117.98 112.69 1sju s PHE 24 Ca 0.00 0.84 -0.11 0.00 -0.05 0.00 0.00 56.93 57.60 1sju s PHE 24 Cb 0.00 0.11 -0.03 0.00 -0.63 0.00 0.00 43.02 42.47 1sju s PHE 24 CO 0.00 -0.19 0.20 -0.59 -0.05 0.00 0.00 175.22 174.59 1sju s PHE 25 N 0.48 3.21 -0.02 3.49 -0.12 0.67 -4.90 117.98 120.79 1sju s PHE 25 Ca -0.03 -0.12 0.10 0.00 -0.05 0.00 0.00 56.93 56.84 1sju s PHE 25 Cb -0.04 -2.41 0.18 0.00 -0.63 0.00 0.00 43.02 40.12 1sju s PHE 25 CO -0.03 -0.28 1.08 2.48 -0.05 0.00 0.00 175.22 178.42 1sju n TYR 26 N 5.06 0.00 -1.53 3.49 4.11 -1.26 -4.53 117.16 122.50 1sju n TYR 26 Ca -0.14 -0.32 0.00 0.00 -0.00 0.00 0.00 57.90 57.44 1sju n TYR 26 Cb 0.51 -0.10 0.00 0.00 -0.00 0.00 0.00 39.34 39.75 1sju n TYR 26 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 1sju n THR 27 N -0.02 0.00 0.00 -3.48 5.66 -1.26 -4.76 114.28 110.41 1sju n THR 27 Ca 0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 1sju n THR 27 Cb 0.84 -0.02 0.00 0.00 -1.55 0.00 0.00 70.33 69.60 1sju n THR 27 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1sju n ASP 28 N 0.00 0.00 -1.60 1.09 2.03 -1.26 -4.80 116.55 112.00 1sju n ASP 28 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1sju n ASP 28 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1sju n ASP 28 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1sju n LYS 29 N 0.00 1.90 -1.36 -0.67 4.76 -1.26 -5.03 118.16 116.49 1sju n LYS 29 Ca 0.00 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.24 1sju n LYS 29 Cb 0.00 0.00 0.11 0.00 -1.84 0.00 0.00 35.03 33.30 1sju n LYS 29 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1sju n GLY 30 N 5.00 5.62 0.05 0.72 0.00 -1.26 -4.71 105.19 110.61 1sju n GLY 30 Ca 0.00 -1.96 0.03 0.00 0.00 0.00 0.00 46.02 44.08 1sju n GLY 30 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1sju n ILE 31 N -0.94 1.62 1.08 -0.61 3.06 -1.26 -0.58 119.36 121.73 1sju n ILE 31 Ca 0.46 0.57 0.14 0.00 -2.50 0.00 0.00 62.75 61.41 1sju n ILE 31 Cb 0.96 -1.57 0.60 0.00 0.54 0.00 0.00 39.64 40.17 1sju n ILE 31 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 1sju n VAL 32 N -1.68 0.00 1.92 9.51 0.31 -1.26 -3.13 118.33 124.00 1sju n VAL 32 Ca -0.00 -0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.47 1sju n VAL 32 Cb 0.05 -0.40 0.88 0.00 -0.91 0.00 0.00 33.84 33.46 1sju n VAL 32 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1sju n GLU 33 N -1.44 0.96 -0.02 5.55 2.13 0.25 -2.73 120.64 125.34 1sju n GLU 33 Ca 0.08 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.92 1sju n GLU 33 Cb 0.32 -1.49 -0.08 0.00 0.27 0.00 0.00 31.44 30.47 1sju n GLU 33 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1sju n GLN 34 N -0.99 0.99 -0.44 5.31 10.64 -1.18 -4.50 117.38 127.21 1sju n GLN 34 Ca 0.22 -0.06 0.08 0.00 -1.83 0.00 0.00 57.00 55.41 1sju n GLN 34 Cb 0.10 -1.24 0.27 0.00 -0.86 0.00 0.00 30.24 28.51 1sju n GLN 34 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1sju n THR 37 N -2.20 0.71 -1.25 0.00 5.66 -1.26 -4.50 114.28 111.44 1sju n THR 37 Ca -0.11 -0.62 0.00 0.00 -3.05 0.00 0.00 64.05 60.27 1sju n THR 37 Cb 0.62 -0.38 0.00 0.00 -1.55 0.00 0.00 70.33 69.02 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 -2.63 0.00 -5.03 1.09 2.88 -1.26 -4.97 113.62 103.70 1sju n SER 38 Ca -0.08 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.26 1sju n SER 38 Cb 0.72 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.24 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 1.79 2.14 0.00 2.46 -1.09 -1.26 -3.89 121.20 121.35 1sju s ILE 39 Ca 0.00 -0.99 0.00 0.00 -2.23 0.00 0.00 60.65 57.43 1sju s ILE 39 Cb 0.00 -2.15 0.00 0.00 -1.58 0.00 0.00 42.46 38.73 1sju s ILE 39 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 174.94 173.71 1sju s SER 41 N 0.78 -1.50 0.61 0.00 1.04 -1.26 -4.99 113.70 108.38 1sju s SER 41 Ca 0.00 -0.25 0.24 0.00 0.48 0.00 0.00 55.95 56.42 1sju s SER 41 Cb 0.00 1.92 0.85 0.00 0.10 0.00 0.00 66.02 68.90 1sju s SER 41 CO 0.00 -0.23 1.30 0.17 0.98 0.00 0.00 173.24 175.46 1sju h LEU 42 N 7.45 0.00 -0.42 2.42 -0.00 -1.98 1.32 115.31 124.10 1sju h LEU 42 Ca 0.01 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.86 1sju h LEU 42 Cb 1.19 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.83 1sju h LEU 42 CO 0.11 0.00 0.13 0.22 -0.00 0.00 0.00 178.44 178.90 1sju h TYR 43 N 0.00 0.68 -0.03 0.17 3.20 -1.95 0.90 116.97 119.94 1sju h TYR 43 Ca 0.43 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 62.19 1sju h TYR 43 Cb 2.76 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 40.84 1sju h TYR 43 CO 0.00 0.62 -0.15 0.37 -1.64 0.00 0.00 178.16 177.36 1sju h GLN 44 N 0.53 0.16 -0.06 1.82 5.75 0.13 -2.87 115.11 120.57 1sju h GLN 44 Ca 0.13 -0.13 0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1sju h GLN 44 Cb 0.27 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.84 1sju h GLN 44 CO -0.00 0.79 0.17 -0.07 -2.65 0.00 0.00 178.83 177.06 1sju h LEU 45 N -0.43 0.00 0.00 -2.39 3.38 -1.36 0.57 115.31 115.09 1sju h LEU 45 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1sju h LEU 45 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1sju h LEU 45 CO 0.03 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.94 1sju n GLU 46 N -3.28 0.26 -0.12 1.13 -0.58 0.30 -2.20 120.64 116.15 1sju n GLU 46 Ca -0.01 0.11 0.05 0.00 -0.42 0.00 0.00 57.16 56.89 1sju n GLU 46 Cb 0.25 -1.50 0.10 0.00 -0.57 0.00 0.00 31.44 29.72 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 -1.28 2.57 -1.08 1.62 3.02 0.20 -4.51 115.26 115.81 1sju n ASN 47 Ca 0.09 -2.38 0.09 0.00 -0.03 0.00 0.00 54.58 52.34 1sju n ASN 47 Cb 0.14 -0.23 0.26 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.46 0.87 -4.39 3.10 4.01 -0.93 -4.97 117.16 114.38 1sju n TYR 48 Ca 0.09 -0.55 -0.23 0.00 -0.16 0.00 0.00 57.90 57.06 1sju n TYR 48 Cb 0.47 -0.08 -0.08 0.00 -0.31 0.00 0.00 39.34 39.34 1sju n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40