#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pon s SER 3 N 0.00 7.06 -0.03 3.14 0.15 -1.26 -5.01 113.70 117.74 1pon s SER 3 Ca 0.00 1.53 0.15 0.00 0.70 0.00 0.00 55.95 58.33 1pon s SER 3 Cb 0.00 -2.47 -0.23 0.00 -1.71 0.00 0.00 66.02 61.61 1pon s SER 3 CO 0.00 -0.09 0.30 1.21 1.20 0.00 0.00 173.24 175.86 1pon n GLU 4 N 0.30 0.61 0.23 5.44 2.13 -1.26 -4.43 120.64 123.66 1pon n GLU 4 Ca 0.01 -0.12 0.11 0.00 0.66 0.00 0.00 57.16 57.82 1pon n GLU 4 Cb 0.52 -1.36 0.50 0.00 0.27 0.00 0.00 31.44 31.36 1pon n GLU 4 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1pon h GLU 5 N 0.00 0.00 0.00 5.31 4.81 -1.99 -2.27 114.58 120.44 1pon h GLU 5 Ca -0.05 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.92 1pon h GLU 5 Cb 0.83 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.16 1pon h GLU 5 CO 0.00 0.19 -2.15 0.39 -0.73 0.00 0.00 179.01 176.72 1pon n GLU 6 N -3.37 1.04 0.17 1.92 -0.58 -1.26 -2.22 120.64 116.35 1pon n GLU 6 Ca 0.00 -0.04 0.04 0.00 -0.42 0.00 0.00 57.16 56.75 1pon n GLU 6 Cb 0.41 -1.45 0.24 0.00 -0.57 0.00 0.00 31.44 30.07 1pon n GLU 6 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1pon h LEU 7 N 0.00 0.00 0.29 -4.62 4.07 -1.77 -1.92 115.31 111.36 1pon h LEU 7 Ca -0.40 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.55 1pon h LEU 7 Cb 1.88 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.63 1pon h LEU 7 CO 0.02 0.43 -0.14 0.00 -1.08 0.00 0.00 178.44 177.67 1pon h ALA 8 N 1.57 -0.40 -0.19 1.53 0.00 -1.52 -1.69 119.26 118.56 1pon h ALA 8 Ca -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1pon h ALA 8 Cb 1.05 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1pon h ALA 8 CO 0.06 -0.52 0.12 -0.91 0.00 0.00 0.00 179.25 178.00 1pon h ASN 9 N -0.81 0.20 -0.43 0.00 2.35 -1.57 -1.32 115.58 114.00 1pon h ASN 9 Ca -0.04 -0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 1pon h ASN 9 Cb 0.51 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.81 1pon h ASN 9 CO 0.07 0.14 0.03 0.00 -1.65 0.00 0.00 177.43 176.02 1pon h ALA 10 N 1.89 1.12 0.00 -0.83 0.00 -1.42 -2.59 119.26 117.43 1pon h ALA 10 Ca 0.07 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 1pon h ALA 10 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1pon h ALA 10 CO -0.01 0.57 -0.92 0.35 0.00 0.00 0.00 179.25 179.23 1pon h PHE 11 N 0.76 0.01 0.59 0.00 3.57 -0.43 -2.79 116.94 118.65 1pon h PHE 11 Ca 0.15 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 1pon h PHE 11 Cb 0.41 -0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.16 1pon h PHE 11 CO 0.02 0.93 -0.29 -0.09 -2.23 0.00 0.00 178.31 176.65 1pon h ARG 12 N 0.00 -0.77 0.00 1.11 9.65 -1.37 -3.14 114.38 119.86 1pon h ARG 12 Ca -0.01 0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 58.88 1pon h ARG 12 Cb 1.63 0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 30.38 1pon h ARG 12 CO 0.12 -0.46 -0.19 0.82 2.80 0.00 0.00 179.97 183.06 1pon h ILE 13 N -0.96 0.97 -0.16 1.20 1.08 -1.51 -1.26 117.51 116.88 1pon h ILE 13 Ca -0.08 -0.67 -0.20 0.00 -0.39 0.00 0.00 64.86 63.52 1pon h ILE 13 Cb 0.66 1.38 0.00 0.00 -3.07 0.00 0.00 36.82 35.79 1pon h ILE 13 CO 0.13 0.18 -0.70 -0.26 -0.69 0.00 0.00 178.15 176.81 1pon h PHE 14 N 0.00 0.90 -2.86 1.37 -1.00 -1.63 -3.45 116.94 110.27 1pon h PHE 14 Ca -0.00 -0.37 -0.55 0.00 2.81 0.00 0.00 57.97 59.85 1pon h PHE 14 Cb 0.36 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 39.76 1pon h PHE 14 CO 0.00 1.17 0.90 0.34 -1.61 0.00 0.00 178.31 179.11 1pon s ASP 15 N -7.03 6.86 -0.05 2.17 2.15 -0.48 -4.93 116.67 115.36 1pon s ASP 15 Ca -0.09 1.99 0.11 0.00 0.43 0.00 0.00 52.55 55.00 1pon s ASP 15 Cb 0.10 -2.55 0.40 0.00 -0.30 0.00 0.00 42.92 40.57 1pon s ASP 15 CO 0.88 -0.76 1.27 2.29 -0.17 0.00 0.00 175.17 178.67 1pon n LYS 16 N 6.09 2.40 0.00 4.34 -0.00 -1.26 -4.40 118.16 125.32 1pon n LYS 16 Ca 0.14 -1.59 0.00 0.00 -0.00 0.00 0.00 58.31 56.87 1pon n LYS 16 Cb 0.44 -1.54 0.00 0.00 -0.00 0.00 0.00 35.03 33.93 1pon n LYS 16 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1pon n ASN 17 N 0.58 0.00 -3.17 -5.58 0.23 -1.26 -5.12 115.26 100.94 1pon n ASN 17 Ca 0.14 0.00 -0.15 0.00 -0.53 0.00 0.00 54.58 54.05 1pon n ASN 17 Cb 0.50 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.28 1pon n ASN 17 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pon n ALA 18 N -0.13 -2.11 0.08 -2.53 0.00 -1.26 -4.94 120.51 109.61 1pon n ALA 18 Ca 0.00 0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.59 1pon n ALA 18 Cb 0.00 -3.93 -0.03 0.00 0.00 0.00 0.00 19.45 15.49 1pon n ALA 18 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1pon n ASP 19 N -3.03 0.71 0.00 0.00 2.03 -1.26 -5.02 116.55 109.98 1pon n ASP 19 Ca -0.16 0.27 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1pon n ASP 19 Cb 0.63 0.70 0.00 0.00 -0.72 0.00 0.00 41.12 41.73 1pon n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pon n GLY 20 N 1.20 0.48 3.63 0.27 0.00 -1.26 -5.15 105.19 104.36 1pon n GLY 20 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 1pon n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pon s TYR 21 N -1.40 2.48 -0.12 1.61 1.51 -1.26 -5.10 117.35 115.07 1pon s TYR 21 Ca 0.00 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.37 1pon s TYR 21 Cb 0.00 -1.77 0.02 0.00 -0.11 0.00 0.00 41.96 40.11 1pon s TYR 21 CO 0.00 0.43 -0.11 0.42 -1.11 0.00 0.00 175.55 175.19 1pon s ILE 22 N -2.72 1.25 0.29 2.71 1.01 -1.26 -4.84 121.20 117.63 1pon s ILE 22 Ca 0.34 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.59 1pon s ILE 22 Cb 0.10 -1.21 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 1pon s ILE 22 CO 0.17 0.40 0.43 1.51 0.00 0.00 0.00 174.94 177.45 1pon s ASP 23 N 1.51 6.19 0.00 3.58 1.47 -1.26 -5.00 116.67 123.16 1pon s ASP 23 Ca 0.03 0.05 0.07 0.00 1.18 0.00 0.00 52.55 53.88 1pon s ASP 23 Cb -0.13 -1.68 0.31 0.00 -0.34 0.00 0.00 42.92 41.08 1pon s ASP 23 CO -0.08 -0.23 1.20 0.00 0.68 0.00 0.00 175.17 176.73 1pon n ILE 24 N -1.56 1.37 0.14 2.11 0.00 -1.26 -2.30 119.36 117.87 1pon n ILE 24 Ca -0.05 0.34 -0.25 0.00 0.00 0.00 0.00 62.75 62.79 1pon n ILE 24 Cb 0.57 -1.22 -0.16 0.00 0.00 0.00 0.00 39.64 38.83 1pon n ILE 24 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1pon h GLU 25 N 0.00 0.52 0.06 9.51 4.81 -2.04 -3.40 114.58 124.04 1pon h GLU 25 Ca 0.00 -0.89 -0.00 0.00 -0.13 0.00 0.00 59.36 58.34 1pon h GLU 25 Cb 0.11 0.33 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1pon h GLU 25 CO 0.00 1.43 -0.03 1.05 -0.73 0.00 0.00 179.01 180.73 1pon h GLU 26 N 0.13 -0.08 0.00 1.92 -0.00 -1.85 -3.38 114.58 111.32 1pon h GLU 26 Ca -0.27 0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.10 1pon h GLU 26 Cb 2.15 0.02 0.00 0.00 -0.00 0.00 0.00 28.75 30.92 1pon h GLU 26 CO 0.26 0.17 0.00 -0.11 -0.00 0.00 0.00 179.01 179.33 1pon n LEU 27 N -5.01 0.00 -0.31 3.06 -0.00 -1.17 -1.67 117.00 111.90 1pon n LEU 27 Ca -0.08 0.84 0.12 0.00 -0.00 0.00 0.00 56.01 56.89 1pon n LEU 27 Cb 0.16 -0.34 0.30 0.00 -0.00 0.00 0.00 43.42 43.54 1pon n LEU 27 CO 0.33 -0.34 1.06 1.23 -0.00 0.00 0.00 177.39 179.67 1pon h GLY 28 N 0.00 1.53 1.43 -3.96 0.00 -1.79 -0.40 103.07 99.87 1pon h GLY 28 Ca 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 47.33 47.02 1pon h GLY 28 CO 0.00 -0.23 -0.33 0.83 0.00 0.00 0.00 176.54 176.81 1pon h GLU 29 N 0.45 0.64 0.73 4.80 3.07 -1.67 0.14 114.58 122.73 1pon h GLU 29 Ca 0.55 -0.29 -0.03 0.00 -0.50 0.00 0.00 59.36 59.08 1pon h GLU 29 Cb 1.00 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 1pon h GLU 29 CO -0.50 0.88 -0.42 0.82 -1.40 0.00 0.00 179.01 178.40 1pon h ILE 30 N 0.54 0.00 0.00 3.13 5.03 -0.60 0.59 117.51 126.20 1pon h ILE 30 Ca 0.06 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.80 1pon h ILE 30 Cb 0.83 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.62 1pon h ILE 30 CO 0.07 0.00 0.00 0.18 -0.68 0.00 0.00 178.15 177.72 1pon n LEU 31 N -5.07 1.99 0.13 1.44 4.77 -0.23 -4.30 117.00 115.73 1pon n LEU 31 Ca -0.13 -1.00 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 1pon n LEU 31 Cb 0.44 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1pon n LEU 31 CO 0.31 0.37 0.00 -1.14 -1.33 0.00 0.00 177.39 175.60 1pon n ARG 32 N 0.27 0.00 -2.48 3.23 3.00 0.47 -4.96 116.66 116.19 1pon n ARG 32 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.42 1pon n ARG 32 Cb 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.81 1pon n ARG 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1pon s ALA 33 N -1.66 3.61 -0.01 5.13 0.00 0.21 -5.01 121.76 124.02 1pon s ALA 33 Ca 0.00 0.45 -0.20 0.00 0.00 0.00 0.00 51.96 52.21 1pon s ALA 33 Cb 0.00 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1pon s ALA 33 CO 0.00 -1.02 0.58 -0.08 0.00 0.00 0.00 175.76 175.24 1pon s THR 34 N 3.04 4.92 0.00 0.00 -1.32 -1.26 -4.56 115.64 116.47 1pon s THR 34 Ca 0.53 1.22 0.00 0.00 -1.21 0.00 0.00 61.69 62.23 1pon s THR 34 Cb -0.21 -3.92 0.00 0.00 -1.51 0.00 0.00 72.50 66.86 1pon s THR 34 CO 0.15 0.42 0.00 0.61 -2.21 0.00 0.00 174.62 173.59