#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pon n SER 3 N 0.00 3.93 -0.27 -5.58 2.88 -1.26 -4.92 113.62 108.40 1pon n SER 3 Ca 0.00 0.78 0.16 0.00 -1.33 0.00 0.00 58.87 58.48 1pon n SER 3 Cb 0.00 -1.52 0.44 0.00 -0.75 0.00 0.00 64.21 62.38 1pon n SER 3 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1pon h GLU 4 N 11.31 0.53 0.18 -1.46 5.08 -2.06 -3.23 114.58 124.93 1pon h GLU 4 Ca -0.48 -0.03 -0.31 0.00 -1.00 0.00 0.00 59.36 57.54 1pon h GLU 4 Cb 1.24 -0.12 0.02 0.00 0.50 0.00 0.00 28.75 30.39 1pon h GLU 4 CO 0.95 0.35 -1.41 1.49 -1.00 0.00 0.00 179.01 179.39 1pon h GLU 5 N 0.55 0.38 -0.09 2.33 4.81 -1.99 -2.00 114.58 118.57 1pon h GLU 5 Ca 0.48 -0.64 -0.13 0.00 -0.13 0.00 0.00 59.36 58.94 1pon h GLU 5 Cb 1.00 0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1pon h GLU 5 CO -0.22 1.29 -0.54 0.93 -0.73 0.00 0.00 179.01 179.74 1pon h GLU 6 N 0.10 0.25 0.00 1.92 5.08 -1.99 -0.36 114.58 119.58 1pon h GLU 6 Ca -0.21 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1pon h GLU 6 Cb 2.06 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 31.33 1pon h GLU 6 CO 0.22 0.73 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.88 1pon h LEU 7 N 0.20 0.00 -0.02 1.33 3.38 -1.65 -1.54 115.31 117.01 1pon h LEU 7 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1pon h LEU 7 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1pon h LEU 7 CO 0.08 0.01 -0.13 0.00 0.09 0.00 0.00 178.44 178.50 1pon h ALA 8 N 1.99 0.04 -0.94 1.53 0.00 -0.53 -2.09 119.26 119.25 1pon h ALA 8 Ca -0.00 -0.40 0.08 0.00 0.00 0.00 0.00 54.91 54.59 1pon h ALA 8 Cb 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 1pon h ALA 8 CO 0.00 -0.02 0.59 -0.91 0.00 0.00 0.00 179.25 178.91 1pon h ASN 9 N -0.53 0.92 -0.18 0.00 4.21 -1.13 -2.09 115.58 116.79 1pon h ASN 9 Ca -0.01 0.02 -0.10 0.00 1.21 0.00 0.00 56.30 57.42 1pon h ASN 9 Cb 0.83 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.86 1pon h ASN 9 CO 0.03 0.57 -0.30 0.00 -1.29 0.00 0.00 177.43 176.44 1pon h ALA 10 N 1.45 0.27 -0.08 -0.83 0.00 -1.38 -2.08 119.26 116.61 1pon h ALA 10 Ca 0.42 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1pon h ALA 10 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1pon h ALA 10 CO -0.20 0.29 -0.43 0.35 0.00 0.00 0.00 179.25 179.27 1pon h PHE 11 N 0.16 0.21 -0.23 0.00 3.04 -1.43 -2.81 116.94 115.89 1pon h PHE 11 Ca 0.01 -0.06 -0.02 0.00 3.98 0.00 0.00 57.97 61.88 1pon h PHE 11 Cb 0.88 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.34 1pon h PHE 11 CO 0.09 0.59 0.05 -0.09 -2.02 0.00 0.00 178.31 176.93 1pon h ARG 12 N 0.15 0.37 0.01 1.11 9.65 -1.42 -3.22 114.38 121.03 1pon h ARG 12 Ca 0.01 -0.09 -0.19 0.00 -1.10 0.00 0.00 59.98 58.61 1pon h ARG 12 Cb 0.83 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.34 1pon h ARG 12 CO 0.06 0.49 -0.87 0.82 2.80 0.00 0.00 179.97 183.27 1pon h ILE 13 N 0.19 1.55 0.22 1.20 1.08 -1.27 -2.69 117.51 117.79 1pon h ILE 13 Ca 0.07 -2.77 -0.01 0.00 -0.39 0.00 0.00 64.86 61.76 1pon h ILE 13 Cb 0.29 2.53 0.00 0.00 -3.07 0.00 0.00 36.82 36.57 1pon h ILE 13 CO 0.00 0.80 -0.10 -0.26 -0.69 0.00 0.00 178.15 177.90 1pon h PHE 14 N 0.05 -0.27 -1.75 1.37 0.04 -1.66 -3.43 116.94 111.30 1pon h PHE 14 Ca -0.03 -0.01 -0.46 0.00 2.80 0.00 0.00 57.97 60.28 1pon h PHE 14 Cb 1.51 0.09 -0.03 0.00 2.20 0.00 0.00 35.95 39.72 1pon h PHE 14 CO 0.02 -0.10 1.32 0.34 -0.60 0.00 0.00 178.31 179.28 1pon s ASP 15 N -5.01 5.06 0.13 2.17 2.15 -1.01 -4.85 116.67 115.30 1pon s ASP 15 Ca -0.15 0.38 0.25 0.00 0.43 0.00 0.00 52.55 53.46 1pon s ASP 15 Cb 0.04 -2.53 0.94 0.00 -0.30 0.00 0.00 42.92 41.08 1pon s ASP 15 CO 0.64 -2.55 1.77 2.29 -0.17 0.00 0.00 175.17 177.14 1pon n LYS 16 N 9.12 0.14 -0.11 4.34 0.00 -1.26 -2.95 118.16 127.43 1pon n LYS 16 Ca 0.26 0.19 -0.13 0.00 -0.00 0.00 0.00 58.31 58.63 1pon n LYS 16 Cb 0.52 -1.69 -0.13 0.00 -0.00 0.00 0.00 35.03 33.73 1pon n LYS 16 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1pon n ASN 17 N -1.93 1.22 -2.04 -5.58 4.05 -1.26 -5.08 115.26 104.64 1pon n ASN 17 Ca 0.05 -0.07 -0.08 0.00 0.45 0.00 0.00 54.58 54.94 1pon n ASN 17 Cb 0.33 0.26 0.04 0.00 1.23 0.00 0.00 39.78 41.64 1pon n ASN 17 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1pon n ALA 18 N -2.98 -0.86 0.60 5.20 0.00 -1.15 -4.96 120.51 116.36 1pon n ALA 18 Ca -0.38 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.11 1pon n ALA 18 Cb 1.04 -1.41 0.18 0.00 0.00 0.00 0.00 19.45 19.26 1pon n ALA 18 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1pon n ASP 19 N -1.83 2.39 0.00 0.00 9.92 -1.26 -4.95 116.55 120.81 1pon n ASP 19 Ca -0.12 -2.09 0.00 0.00 -0.53 0.00 0.00 54.79 52.05 1pon n ASP 19 Cb 0.57 -0.33 0.00 0.00 -0.64 0.00 0.00 41.12 40.72 1pon n ASP 19 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1pon n GLY 20 N 0.98 0.70 3.55 0.44 0.00 -1.26 -5.06 105.19 104.54 1pon n GLY 20 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.47 2.54 0.08 1.61 1.51 -1.26 -5.10 117.35 114.27 1pon s TYR 21 Ca 0.00 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 1pon s TYR 21 Cb 0.00 -1.19 -0.04 0.00 -0.11 0.00 0.00 41.96 40.62 1pon s TYR 21 CO 0.00 0.57 0.15 0.42 -1.11 0.00 0.00 175.55 175.58 1pon s ILE 22 N -1.99 4.95 0.31 2.71 1.01 -1.26 -4.81 121.20 122.13 1pon s ILE 22 Ca 0.27 -0.62 0.11 0.00 0.00 0.00 0.00 60.65 60.40 1pon s ILE 22 Cb -0.07 -3.42 -0.06 0.00 0.01 0.00 0.00 42.46 38.92 1pon s ILE 22 CO 0.16 0.10 -0.15 1.51 0.00 0.00 0.00 174.94 176.55 1pon s ASP 23 N -2.55 3.62 0.51 3.58 -4.77 -1.26 -5.05 116.67 110.76 1pon s ASP 23 Ca 0.32 -1.10 0.29 0.00 -3.30 0.00 0.00 52.55 48.76 1pon s ASP 23 Cb -0.12 -0.32 1.32 0.00 -1.09 0.00 0.00 42.92 42.71 1pon s ASP 23 CO 0.25 -0.07 1.99 -0.29 0.70 0.00 0.00 175.17 177.75 1pon h ILE 24 N 2.17 0.39 -0.01 2.11 -0.00 -2.01 -2.80 117.51 117.36 1pon h ILE 24 Ca -0.41 -0.70 -0.22 0.00 -0.00 0.00 0.00 64.86 63.54 1pon h ILE 24 Cb 1.25 1.50 0.00 0.00 -0.00 0.00 0.00 36.82 39.58 1pon h ILE 24 CO 0.65 0.12 -0.92 -0.33 -0.00 0.00 0.00 178.15 177.66 1pon h GLU 25 N 0.00 0.39 0.18 2.19 5.08 -2.03 -3.37 114.58 117.02 1pon h GLU 25 Ca -0.00 -0.42 -0.01 0.00 -1.00 0.00 0.00 59.36 57.93 1pon h GLU 25 Cb 0.49 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1pon h GLU 25 CO 0.02 1.08 -0.09 1.05 -1.00 0.00 0.00 179.01 180.07 1pon h GLU 26 N 0.23 -0.23 0.00 2.33 -0.00 -1.91 -3.30 114.58 111.69 1pon h GLU 26 Ca -0.07 0.02 0.00 0.00 -0.00 0.00 0.00 59.36 59.30 1pon h GLU 26 Cb 1.55 0.05 0.00 0.00 -0.00 0.00 0.00 28.75 30.35 1pon h GLU 26 CO 0.16 0.13 0.00 -0.11 -0.00 0.00 0.00 179.01 179.19 1pon n LEU 27 N -5.02 0.00 -0.31 3.06 7.94 -1.16 -2.38 117.00 119.12 1pon n LEU 27 Ca -0.09 0.60 0.16 0.00 -1.11 0.00 0.00 56.01 55.57 1pon n LEU 27 Cb 0.24 -0.11 0.41 0.00 0.53 0.00 0.00 43.42 44.49 1pon n LEU 27 CO 0.31 -0.11 1.21 1.23 -1.11 0.00 0.00 177.39 178.92 1pon h GLY 28 N 0.00 1.38 0.71 -3.96 0.00 -1.73 -1.23 103.07 98.24 1pon h GLY 28 Ca 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1pon h GLY 28 CO 0.00 -0.04 -0.43 -2.09 0.00 0.00 0.00 176.54 173.98 1pon h GLU 29 N 0.61 -0.94 0.08 4.80 4.81 -1.63 -2.11 114.58 120.20 1pon h GLU 29 Ca 0.54 0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.85 1pon h GLU 29 Cb 1.04 0.21 -0.05 0.00 0.63 0.00 0.00 28.75 30.59 1pon h GLU 29 CO -0.29 -0.63 -0.46 0.82 -0.73 0.00 0.00 179.01 177.72 1pon h ILE 30 N -0.98 0.09 -0.16 2.32 2.04 -0.88 -1.32 117.51 118.62 1pon h ILE 30 Ca -0.07 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 1pon h ILE 30 Cb 0.82 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1pon h ILE 30 CO 0.02 0.00 -0.07 0.17 0.00 0.00 0.00 178.15 178.27 1pon h LEU 31 N -0.67 0.23 -3.72 1.44 8.10 -1.39 -3.23 115.31 116.07 1pon h LEU 31 Ca 0.02 -0.04 -0.25 0.00 0.11 0.00 0.00 57.88 57.72 1pon h LEU 31 Cb 0.70 -0.06 -0.29 0.00 -0.44 0.00 0.00 40.66 40.58 1pon h LEU 31 CO -0.29 0.34 -0.83 0.54 -4.11 0.00 0.00 178.44 174.09 1pon n ARG 32 N -4.33 1.96 -4.76 0.17 5.12 -0.79 -5.03 116.66 108.99 1pon n ARG 32 Ca -0.01 -3.37 -0.33 0.00 -1.93 0.00 0.00 57.85 52.21 1pon n ARG 32 Cb 0.22 -1.52 -0.12 0.00 -1.16 0.00 0.00 32.46 29.88 1pon n ARG 32 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1pon s ALA 33 N -2.85 2.80 -0.14 7.54 0.00 -0.50 -4.91 121.76 123.69 1pon s ALA 33 Ca 0.39 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 51.45 1pon s ALA 33 Cb 0.38 -1.07 0.17 0.00 0.00 0.00 0.00 23.12 22.60 1pon s ALA 33 CO -0.05 0.57 1.08 -2.37 0.00 0.00 0.00 175.76 174.99 1pon n THR 34 N 2.21 0.00 1.99 0.00 5.66 -1.26 -5.01 114.28 117.87 1pon n THR 34 Ca -0.17 -0.41 0.16 0.00 -3.05 0.00 0.00 64.05 60.57 1pon n THR 34 Cb 0.52 0.66 0.94 0.00 -1.55 0.00 0.00 70.33 70.90 1pon n THR 34 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63