#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pon s THR 39 N 0.00 2.18 0.25 2.52 -1.32 -1.26 -4.89 115.64 113.12 1pon s THR 39 Ca 0.00 0.06 0.36 0.00 -1.21 0.00 0.00 61.69 60.90 1pon s THR 39 Cb 0.00 -2.21 0.39 0.00 -1.51 0.00 0.00 72.50 69.17 1pon s THR 39 CO 0.00 -0.08 2.09 -0.33 -2.21 0.00 0.00 174.62 174.09 1pon h GLU 40 N -2.15 0.00 0.00 7.08 5.08 -2.05 -2.75 114.58 119.79 1pon h GLU 40 Ca -0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1pon h GLU 40 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1pon h GLU 40 CO 0.49 0.00 0.00 0.93 -1.00 0.00 0.00 179.01 179.43 1pon h GLU 41 N 0.00 0.00 0.09 2.33 5.08 -1.98 0.12 114.58 120.23 1pon h GLU 41 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 1pon h GLU 41 Cb 0.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1pon h GLU 41 CO 0.00 0.00 -1.80 -0.44 -1.00 0.00 0.00 179.01 175.77 1pon h ASP 42 N 0.00 0.31 -0.53 1.42 3.32 -1.83 -1.90 116.42 117.21 1pon h ASP 42 Ca 0.00 -0.61 0.02 0.00 0.02 0.00 0.00 57.03 56.46 1pon h ASP 42 Cb 0.30 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 1pon h ASP 42 CO 0.00 1.53 0.35 0.40 -1.72 0.00 0.00 179.24 179.80 1pon h ILE 43 N 0.05 1.10 -0.13 0.35 5.03 -1.55 -2.01 117.51 120.36 1pon h ILE 43 Ca -0.34 -0.23 -0.12 0.00 -0.12 0.00 0.00 64.86 64.05 1pon h ILE 43 Cb 2.03 0.38 -0.01 0.00 -3.03 0.00 0.00 36.82 36.18 1pon h ILE 43 CO 0.11 0.12 -0.46 -0.33 -0.68 0.00 0.00 178.15 176.91 1pon h GLU 44 N 0.67 0.32 0.33 2.37 4.39 -0.81 -2.69 114.58 119.16 1pon h GLU 44 Ca 0.20 -0.17 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1pon h GLU 44 Cb -0.01 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1pon h GLU 44 CO -0.05 0.72 -0.16 -0.44 -1.16 0.00 0.00 179.01 177.93 1pon h ASP 45 N 0.26 -0.38 -0.20 1.42 5.19 -1.02 -2.83 116.42 118.87 1pon h ASP 45 Ca 0.02 -0.08 0.06 0.00 -0.62 0.00 0.00 57.03 56.41 1pon h ASP 45 Cb 0.92 0.10 -0.06 0.00 0.18 0.00 0.00 39.33 40.46 1pon h ASP 45 CO 0.08 -0.15 -0.24 0.25 -3.12 0.00 0.00 179.24 176.05 1pon h LEU 46 N -0.59 -0.76 -1.11 1.55 5.85 -1.44 -2.72 115.31 116.08 1pon h LEU 46 Ca -0.05 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1pon h LEU 46 Cb 0.43 0.35 0.00 0.00 0.37 0.00 0.00 40.66 41.81 1pon h LEU 46 CO 0.08 -0.28 -0.12 0.80 -0.34 0.00 0.00 178.44 178.58 1pon n MET 47 N -5.37 1.59 -0.01 1.25 1.56 -1.02 -1.55 117.12 113.58 1pon n MET 47 Ca -0.02 -1.11 0.09 0.00 -0.27 0.00 0.00 57.70 56.40 1pon n MET 47 Cb 0.29 -1.48 -0.14 0.00 2.15 0.00 0.00 33.22 34.04 1pon n MET 47 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1pon n LYS 48 N 0.26 0.64 0.00 2.12 3.00 -1.07 -3.75 118.16 119.36 1pon n LYS 48 Ca 0.15 -0.14 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1pon n LYS 48 Cb 0.43 -1.43 0.00 0.00 0.00 0.00 0.00 35.03 34.03 1pon n LYS 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1pon n ASP 49 N -2.03 0.00 0.33 3.14 -0.08 -1.03 -4.49 116.55 112.38 1pon n ASP 49 Ca -0.02 0.34 0.21 0.00 -1.51 0.00 0.00 54.79 53.81 1pon n ASP 49 Cb 0.45 -0.01 1.12 0.00 2.34 0.00 0.00 41.12 45.03 1pon n ASP 49 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1pon h SER 50 N 0.00 0.00 -3.12 1.67 0.02 -1.54 -3.39 113.55 107.19 1pon h SER 50 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1pon h SER 50 Cb 0.00 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.56 1pon h SER 50 CO 0.00 0.00 0.69 -0.62 -1.14 0.00 0.00 176.83 175.76 1pon s ASP 51 N -5.31 6.86 0.00 3.07 2.15 -1.25 -5.00 116.67 117.20 1pon s ASP 51 Ca -0.04 2.32 0.00 0.00 0.43 0.00 0.00 52.55 55.26 1pon s ASP 51 Cb 0.13 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.15 1pon s ASP 51 CO 0.44 -0.60 0.00 0.29 -0.17 0.00 0.00 175.17 175.13 1pon n LYS 52 N 3.58 0.00 0.00 4.34 4.01 -1.26 -4.82 118.16 124.01 1pon n LYS 52 Ca 0.10 0.00 0.11 0.00 -0.51 0.00 0.00 58.31 58.01 1pon n LYS 52 Cb 0.43 -0.13 0.65 0.00 -0.51 0.00 0.00 35.03 35.47 1pon n LYS 52 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1pon n ASN 53 N -1.97 0.00 -3.42 4.39 6.94 -1.26 -4.89 115.26 115.05 1pon n ASN 53 Ca 0.00 -0.94 -0.22 0.00 -0.02 0.00 0.00 54.58 53.40 1pon n ASN 53 Cb 0.00 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 37.50 1pon n ASN 53 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1pon n ASN 54 N -0.92 -5.76 -3.58 0.53 4.13 -1.26 -4.95 115.26 103.45 1pon n ASN 54 Ca 0.17 -0.52 -0.41 0.00 1.68 0.00 0.00 54.58 55.50 1pon n ASN 54 Cb 0.08 -4.81 -0.01 0.00 -1.54 0.00 0.00 39.78 33.50 1pon n ASN 54 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 1pon n ASP 55 N -2.80 6.92 -0.45 6.41 5.75 -1.26 -4.95 116.55 126.16 1pon n ASP 55 Ca -0.02 -2.98 0.38 0.00 -0.01 0.00 0.00 54.79 52.17 1pon n ASP 55 Cb 0.57 -1.47 0.70 0.00 -1.03 0.00 0.00 41.12 39.89 1pon n ASP 55 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1pon h GLY 56 N 7.01 0.60 -5.14 6.12 0.00 -1.97 -3.40 103.07 106.28 1pon h GLY 56 Ca 0.64 -0.07 -0.57 0.00 0.00 0.00 0.00 47.33 47.33 1pon h GLY 56 CO 1.63 -0.15 0.54 0.50 0.00 0.00 0.00 176.54 179.06 1pon s ARG 57 N -5.12 4.32 -0.17 4.80 0.52 -1.26 -5.03 118.95 117.01 1pon s ARG 57 Ca -0.06 1.20 -0.09 0.00 -0.52 0.00 0.00 55.73 56.26 1pon s ARG 57 Cb 0.26 -3.58 -0.05 0.00 0.52 0.00 0.00 34.95 32.11 1pon s ARG 57 CO 0.83 -0.40 0.14 0.42 0.02 0.00 0.00 175.30 176.31 1pon s ILE 58 N 2.38 5.45 0.00 1.52 1.01 -1.26 -5.11 121.20 125.18 1pon s ILE 58 Ca 0.42 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.28 1pon s ILE 58 Cb -0.17 -3.44 0.00 0.00 0.01 0.00 0.00 42.46 38.86 1pon s ILE 58 CO 0.12 0.51 0.00 -0.90 0.00 0.00 0.00 174.94 174.68 1pon n ASP 59 N 2.88 0.49 -0.03 3.58 5.68 -1.26 -4.98 116.55 122.91 1pon n ASP 59 Ca -0.18 -0.96 -0.12 0.00 -0.50 0.00 0.00 54.79 53.04 1pon n ASP 59 Cb 0.53 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.53 1pon n ASP 59 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1pon h PHE 60 N 0.23 0.86 0.00 2.11 3.04 -1.99 -1.83 116.94 119.36 1pon h PHE 60 Ca 0.00 -0.30 0.00 0.00 3.98 0.00 0.00 57.97 61.65 1pon h PHE 60 Cb 0.00 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.35 1pon h PHE 60 CO 0.00 1.08 0.00 -0.25 -2.02 0.00 0.00 178.31 177.12 1pon n ASP 61 N -3.98 0.00 -0.27 0.41 8.00 -1.26 -2.36 116.55 117.09 1pon n ASP 61 Ca -0.04 0.65 0.26 0.00 0.71 0.00 0.00 54.79 56.37 1pon n ASP 61 Cb 0.61 -0.15 0.46 0.00 -0.02 0.00 0.00 41.12 42.03 1pon n ASP 61 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1pon n GLU 62 N -1.42 -0.04 -0.31 -1.24 -0.58 -1.22 -0.77 120.64 115.07 1pon n GLU 62 Ca 0.00 1.02 -0.02 0.00 -0.42 0.00 0.00 57.16 57.74 1pon n GLU 62 Cb 0.00 -1.87 0.10 0.00 -0.57 0.00 0.00 31.44 29.10 1pon n GLU 62 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1pon h PHE 63 N 0.00 1.05 -0.07 -0.32 3.57 -0.94 0.17 116.94 120.39 1pon h PHE 63 Ca 0.65 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 62.05 1pon h PHE 63 Cb 1.81 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 40.18 1pon h PHE 63 CO -0.01 0.62 -0.49 -0.07 -2.23 0.00 0.00 178.31 176.13 1pon h LEU 64 N 1.10 0.19 0.00 0.59 3.38 -0.65 -1.17 115.31 118.75 1pon h LEU 64 Ca 0.33 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1pon h LEU 64 Cb -0.04 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1pon h LEU 64 CO -0.10 0.66 -0.47 0.29 0.09 0.00 0.00 178.44 178.90 1pon n LYS 65 N -3.95 0.14 -0.05 1.13 5.02 -1.07 -2.59 118.16 116.79 1pon n LYS 65 Ca -0.02 0.05 -0.02 0.00 -2.02 0.00 0.00 58.31 56.30 1pon n LYS 65 Cb 0.53 -1.59 -0.01 0.00 -0.02 0.00 0.00 35.03 33.94 1pon n LYS 65 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 1pon h MET 66 N 0.00 0.00 -1.60 1.97 1.85 -0.48 -0.39 114.93 116.28 1pon h MET 66 Ca 0.00 0.00 0.51 0.00 -0.61 0.00 0.00 59.70 59.60 1pon h MET 66 Cb 0.62 0.00 -0.11 0.00 0.43 0.00 0.00 31.60 32.54 1pon h MET 66 CO 0.00 0.00 1.09 -0.12 -0.40 0.00 0.00 176.91 177.48 1pon n MET 67 N -4.06 -0.02 0.00 0.39 0.00 -0.46 -3.94 117.12 109.03 1pon n MET 67 Ca -0.04 1.14 0.00 0.00 -0.00 0.00 0.00 57.70 58.80 1pon n MET 67 Cb 0.14 -2.41 0.00 0.00 0.00 0.00 0.00 33.22 30.95 1pon n MET 67 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1pon n GLU 68 N -4.29 0.00 0.00 2.12 2.13 -1.07 -5.09 120.64 114.43 1pon n GLU 68 Ca 0.41 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.23 1pon n GLU 68 Cb 1.72 0.00 0.00 0.00 0.27 0.00 0.00 31.44 33.43 1pon n GLU 68 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1pon n GLY 69 N 4.22 2.22 0.34 8.31 0.00 -0.16 -5.04 105.19 115.09 1pon n GLY 69 Ca 0.00 -1.46 -0.02 0.00 0.00 0.00 0.00 46.02 44.54 1pon n GLY 69 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1pon n VAL 70 N 2.12 0.00 -1.73 1.61 3.14 -1.26 -5.09 118.33 117.12 1pon n VAL 70 Ca 0.00 -0.14 0.00 0.00 -2.96 0.00 0.00 64.34 61.24 1pon n VAL 70 Cb 0.00 -1.32 0.00 0.00 -1.06 0.00 0.00 33.84 31.46 1pon n VAL 70 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37