#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 5.69 -0.12 -5.58 0.01 -1.26 -4.98 113.70 107.46 1pon s SER 3 Ca 0.00 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 56.53 1pon s SER 3 Cb 0.00 -2.03 0.26 0.00 0.21 0.00 0.00 66.02 64.47 1pon s SER 3 CO 0.00 -0.30 1.14 -0.62 0.41 0.00 0.00 173.24 173.87 1pon n GLU 4 N 5.00 1.91 0.21 12.44 -0.58 -1.26 -4.63 120.64 133.73 1pon n GLU 4 Ca -0.13 -1.09 -0.08 0.00 -0.42 0.00 0.00 57.16 55.44 1pon n GLU 4 Cb 0.48 -1.59 -0.04 0.00 -0.57 0.00 0.00 31.44 29.72 1pon n GLU 4 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1pon h GLU 5 N 0.87 -0.51 -0.05 3.49 4.81 -1.99 -2.62 114.58 118.58 1pon h GLU 5 Ca 0.12 0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1pon h GLU 5 Cb 1.35 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.82 1pon h GLU 5 CO 0.29 -0.34 -0.11 1.49 -0.73 0.00 0.00 179.01 179.61 1pon h GLU 6 N -0.59 -0.15 0.40 1.92 4.81 -2.00 -2.10 114.58 116.86 1pon h GLU 6 Ca -0.05 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1pon h GLU 6 Cb 0.41 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1pon h GLU 6 CO 0.09 -0.10 -0.19 -0.07 -0.73 0.00 0.00 179.01 178.01 1pon h LEU 7 N -0.16 -0.45 -0.31 1.64 -0.00 -1.89 -2.27 115.31 111.87 1pon h LEU 7 Ca 0.06 -0.01 -0.19 0.00 -0.00 0.00 0.00 57.88 57.74 1pon h LEU 7 Cb 0.23 0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.01 1pon h LEU 7 CO -0.14 -0.29 -0.59 0.00 -0.00 0.00 0.00 178.44 177.42 1pon h ALA 8 N 0.01 0.47 -0.86 1.53 0.00 -1.51 -0.61 119.26 118.30 1pon h ALA 8 Ca -0.05 -0.53 0.17 0.00 0.00 0.00 0.00 54.91 54.49 1pon h ALA 8 Cb 0.44 -0.07 -0.16 0.00 0.00 0.00 0.00 17.79 18.00 1pon h ALA 8 CO 0.09 0.68 -0.23 -0.91 0.00 0.00 0.00 179.25 178.88 1pon h ASN 9 N 0.61 -0.86 0.80 0.00 2.35 -1.48 -2.66 115.58 114.34 1pon h ASN 9 Ca 0.00 0.26 -0.13 0.00 -0.55 0.00 0.00 56.30 55.88 1pon h ASN 9 Cb 1.19 0.55 -0.02 0.00 0.05 0.00 0.00 38.32 40.10 1pon h ASN 9 CO 0.13 -0.29 -0.63 0.00 -1.65 0.00 0.00 177.43 174.99 1pon h ALA 10 N 1.79 0.85 0.01 -0.83 0.00 -0.90 -2.76 119.26 117.42 1pon h ALA 10 Ca 0.40 -0.57 -0.22 0.00 0.00 0.00 0.00 54.91 54.52 1pon h ALA 10 Cb 0.62 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1pon h ALA 10 CO -0.89 0.79 -0.94 0.35 0.00 0.00 0.00 179.25 178.56 1pon h PHE 11 N 0.00 0.43 -0.27 0.00 3.57 -0.96 -1.75 116.94 117.95 1pon h PHE 11 Ca -0.01 -0.24 -0.16 0.00 3.53 0.00 0.00 57.97 61.09 1pon h PHE 11 Cb 1.20 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 1pon h PHE 11 CO 0.00 1.07 -0.49 -0.09 -2.23 0.00 0.00 178.31 176.57 1pon h ARG 12 N 0.15 0.74 -0.04 1.11 2.43 -1.57 -2.88 114.38 114.32 1pon h ARG 12 Ca -0.07 -0.43 -0.14 0.00 -0.81 0.00 0.00 59.98 58.53 1pon h ARG 12 Cb 1.58 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.15 1pon h ARG 12 CO 0.15 1.06 -0.61 0.82 -1.51 0.00 0.00 179.97 179.88 1pon h ILE 13 N 0.58 1.41 -0.02 1.20 1.08 -1.42 -2.44 117.51 117.90 1pon h ILE 13 Ca 0.03 -2.03 -0.00 0.00 -0.39 0.00 0.00 64.86 62.46 1pon h ILE 13 Cb 1.06 2.06 -0.00 0.00 -3.07 0.00 0.00 36.82 36.86 1pon h ILE 13 CO 0.10 0.59 0.00 -0.26 -0.69 0.00 0.00 178.15 177.90 1pon h PHE 14 N 0.10 0.03 -3.58 1.37 0.04 -1.45 -3.48 116.94 109.98 1pon h PHE 14 Ca -0.01 -0.01 -0.53 0.00 2.80 0.00 0.00 57.97 60.23 1pon h PHE 14 Cb 1.10 -0.01 0.06 0.00 2.20 0.00 0.00 35.95 39.30 1pon h PHE 14 CO 0.01 0.31 0.72 0.34 -0.60 0.00 0.00 178.31 179.09 1pon s ASP 15 N -5.52 6.68 -0.05 2.17 2.15 -0.92 -4.96 116.67 116.23 1pon s ASP 15 Ca -0.15 2.68 0.02 0.00 0.43 0.00 0.00 52.55 55.53 1pon s ASP 15 Cb 0.04 -2.63 -0.04 0.00 -0.30 0.00 0.00 42.92 39.98 1pon s ASP 15 CO 0.67 -0.65 -0.03 0.29 -0.17 0.00 0.00 175.17 175.29 1pon n LYS 16 N 1.73 1.30 -0.06 4.34 5.02 -1.26 -4.77 118.16 124.46 1pon n LYS 16 Ca 0.04 0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 56.27 1pon n LYS 16 Cb 0.41 -1.11 -0.15 0.00 -0.02 0.00 0.00 35.03 34.16 1pon n LYS 16 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1pon n ASN 17 N -2.48 0.38 -2.01 4.39 4.13 -1.26 -5.06 115.26 113.35 1pon n ASN 17 Ca -0.09 0.18 -0.07 0.00 1.68 0.00 0.00 54.58 56.29 1pon n ASN 17 Cb 0.62 0.59 0.03 0.00 -1.54 0.00 0.00 39.78 39.49 1pon n ASN 17 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pon n ALA 18 N -2.63 -0.91 1.09 5.41 0.00 -1.26 -4.97 120.51 117.24 1pon n ALA 18 Ca -0.24 -0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.31 1pon n ALA 18 Cb 1.07 -1.56 0.14 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.92 2.21 0.00 0.00 8.00 -1.26 -5.00 116.55 118.58 1pon n ASP 19 Ca -0.10 -1.62 0.00 0.00 0.71 0.00 0.00 54.79 53.79 1pon n ASP 19 Cb 0.56 0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 1pon n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pon n GLY 20 N 1.36 2.87 3.62 0.44 0.00 -1.26 -5.10 105.19 107.12 1pon n GLY 20 Ca 0.13 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 -2.71 2.69 -0.16 1.61 2.02 -1.26 -5.05 117.35 114.48 1pon s TYR 21 Ca 0.00 -0.21 -0.07 0.00 -0.37 0.00 0.00 57.07 56.42 1pon s TYR 21 Cb 0.00 -1.25 -0.04 0.00 -0.40 0.00 0.00 41.96 40.27 1pon s TYR 21 CO 0.00 0.57 0.06 0.42 -1.57 0.00 0.00 175.55 175.03 1pon s ILE 22 N -2.04 4.81 0.41 2.71 1.01 -1.26 -4.85 121.20 121.98 1pon s ILE 22 Ca 0.29 -0.04 0.08 0.00 0.00 0.00 0.00 60.65 60.98 1pon s ILE 22 Cb -0.08 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 1pon s ILE 22 CO 0.18 0.50 0.31 1.51 0.00 0.00 0.00 174.94 177.44 1pon s ASP 23 N 0.03 4.89 0.54 3.58 1.47 -1.26 -5.03 116.67 120.90 1pon s ASP 23 Ca 0.06 -0.81 0.20 0.00 1.18 0.00 0.00 52.55 53.18 1pon s ASP 23 Cb -0.12 -0.59 1.42 0.00 -0.34 0.00 0.00 42.92 43.30 1pon s ASP 23 CO 0.01 -0.58 2.16 -0.29 0.68 0.00 0.00 175.17 177.15 1pon h ILE 24 N 1.17 0.85 -0.07 2.11 2.10 -2.01 -2.61 117.51 119.05 1pon h ILE 24 Ca -0.42 0.00 -0.21 0.00 1.08 0.00 0.00 64.86 65.31 1pon h ILE 24 Cb 1.26 0.98 0.00 0.00 -1.09 0.00 0.00 36.82 37.97 1pon h ILE 24 CO 0.61 0.00 -0.81 -0.08 -1.08 0.00 0.00 178.15 176.79 1pon h GLU 25 N 0.00 0.51 0.00 2.19 4.57 -2.03 -3.25 114.58 116.58 1pon h GLU 25 Ca 0.02 -0.46 -0.11 0.00 -1.18 0.00 0.00 59.36 57.63 1pon h GLU 25 Cb 0.09 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1pon h GLU 25 CO -0.00 1.09 -0.52 0.93 -1.18 0.00 0.00 179.01 179.33 1pon h GLU 26 N 0.33 0.00 0.37 1.92 5.08 -1.88 -3.39 114.58 117.01 1pon h GLU 26 Ca -0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1pon h GLU 26 Cb 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1pon h GLU 26 CO 0.15 0.52 -0.18 1.25 -1.00 0.00 0.00 179.01 179.75 1pon h LEU 27 N 0.00 -0.42 0.00 1.33 7.12 -1.52 -2.83 115.31 118.99 1pon h LEU 27 Ca -0.01 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.02 1pon h LEU 27 Cb 0.96 0.11 0.00 0.00 -0.53 0.00 0.00 40.66 41.19 1pon h LEU 27 CO 0.07 -0.13 0.00 0.61 -0.13 0.00 0.00 178.44 178.85 1pon n GLY 28 N 0.12 -0.60 0.33 3.75 0.00 -1.26 -2.59 105.19 104.94 1pon n GLY 28 Ca -0.06 0.13 0.22 0.00 0.00 0.00 0.00 46.02 46.31 1pon n GLY 28 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1pon h GLU 29 N 0.00 0.00 0.71 1.61 4.11 -1.75 0.31 114.58 119.56 1pon h GLU 29 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 1pon h GLU 29 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1pon h GLU 29 CO 0.00 0.00 -0.40 0.82 0.07 0.00 0.00 179.01 179.51 1pon h ILE 30 N 0.00 0.00 0.18 -1.06 2.04 -1.42 -2.46 117.51 114.79 1pon h ILE 30 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1pon h ILE 30 Cb 0.01 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.09 1pon h ILE 30 CO 0.00 0.00 -0.18 -0.07 0.00 0.00 0.00 178.15 177.90 1pon h LEU 31 N -1.02 -0.51 -0.25 1.44 3.38 -0.63 -3.36 115.31 114.36 1pon h LEU 31 Ca -0.10 0.04 0.06 0.00 0.09 0.00 0.00 57.88 57.97 1pon h LEU 31 Cb 0.80 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.67 1pon h LEU 31 CO 0.12 -0.24 -0.12 0.03 0.09 0.00 0.00 178.44 178.32 1pon h ARG 32 N -0.36 -0.09 0.00 1.13 2.47 -0.64 -3.23 114.38 113.66 1pon h ARG 32 Ca -0.02 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1pon h ARG 32 Cb 0.32 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 1pon h ARG 32 CO -0.03 -0.06 0.00 0.00 0.56 0.00 0.00 179.97 180.45 1pon n ALA 33 N -2.61 1.08 -3.85 0.04 0.00 -0.92 -3.34 120.51 110.90 1pon n ALA 33 Ca -0.01 0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.21 1pon n ALA 33 Cb 0.21 -1.14 -0.16 0.00 0.00 0.00 0.00 19.45 18.36 1pon n ALA 33 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1pon s THR 34 N -3.21 1.09 0.00 0.00 -4.23 -1.22 -5.12 115.64 102.95 1pon s THR 34 Ca -0.00 -0.94 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1pon s THR 34 Cb 0.03 -1.47 0.00 0.00 1.34 0.00 0.00 72.50 72.40 1pon s THR 34 CO 0.10 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.64