#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a3p n GLY 5 N 0.00 0.25 0.00 0.55 0.00 -1.26 -4.76 105.19 99.96 1a3p n GLY 5 Ca 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1a3p n GLY 5 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a3p n PRO 7 N 0.00 0.00 0.04 1.61 -0.04 -1.26 -4.99 135.00 130.36 1a3p n PRO 7 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 1a3p n PRO 7 Cb 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.39 1a3p n PRO 7 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1a3p n SER 8 N 0.00 0.76 -3.68 3.54 2.88 -1.26 -4.87 113.62 110.99 1a3p n SER 8 Ca 0.00 0.32 -0.09 0.00 -1.33 0.00 0.00 58.87 57.77 1a3p n SER 8 Cb 0.00 0.41 -0.10 0.00 -0.75 0.00 0.00 64.21 63.78 1a3p n SER 8 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1a3p s SER 9 N -5.55 -0.53 -0.12 -3.46 0.15 -1.26 -5.02 113.70 97.91 1a3p s SER 9 Ca -0.03 1.04 0.18 0.00 0.70 0.00 0.00 55.95 57.84 1a3p s SER 9 Cb 0.09 1.09 0.27 0.00 -1.71 0.00 0.00 66.02 65.76 1a3p s SER 9 CO 0.81 -0.21 1.14 0.00 1.20 0.00 0.00 173.24 176.18 1a3p n TYR 10 N 4.64 0.00 -2.29 3.44 0.18 -1.26 -4.92 117.16 116.95 1a3p n TYR 10 Ca -0.18 -0.93 -0.43 0.00 1.88 0.00 0.00 57.90 58.24 1a3p n TYR 10 Cb 0.54 -0.14 -0.02 0.00 -0.38 0.00 0.00 39.34 39.33 1a3p n TYR 10 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 1a3p s ASP 11 N -2.75 6.87 -1.52 9.48 -1.08 -1.26 -2.82 116.67 123.59 1a3p s ASP 11 Ca 0.30 1.91 -0.13 0.00 -0.52 0.00 0.00 52.55 54.11 1a3p s ASP 11 Cb 0.26 -2.54 0.08 0.00 -1.46 0.00 0.00 42.92 39.26 1a3p s ASP 11 CO 0.03 -0.78 0.95 0.61 0.52 0.00 0.00 175.17 176.51 1a3p n GLY 12 N 3.72 -0.48 0.06 2.66 0.00 -1.26 -4.84 105.19 105.05 1a3p n GLY 12 Ca 0.14 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.47 1a3p n GLY 12 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1a3p n TYR 13 N -4.65 0.53 -4.44 1.61 4.19 -1.13 -4.89 117.16 108.37 1a3p n TYR 13 Ca 0.01 0.15 -0.22 0.00 3.31 0.00 0.00 57.90 61.15 1a3p n TYR 13 Cb 0.54 -0.64 -0.10 0.00 0.49 0.00 0.00 39.34 39.62 1a3p n TYR 13 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1a3p n LEU 15 N -0.58 2.15 0.00 0.00 0.00 0.38 -5.00 117.00 113.95 1a3p n LEU 15 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 56.01 55.93 1a3p n LEU 15 Cb 0.61 -0.11 0.00 0.00 0.00 0.00 0.00 43.42 43.92 1a3p n LEU 15 CO 0.38 0.46 0.00 0.59 0.00 0.00 0.00 177.39 178.82 1a3p n ASN 16 N -2.52 -0.00 0.14 1.96 3.02 -1.25 -4.94 115.26 111.66 1a3p n ASN 16 Ca -0.09 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.48 1a3p n ASN 16 Cb 0.62 0.16 0.05 0.00 -0.61 0.00 0.00 39.78 40.00 1a3p n ASN 16 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1a3p h GLY 17 N 0.00 0.00 0.00 7.41 0.00 -1.86 -3.47 103.07 105.15 1a3p h GLY 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1a3p h GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1a3p n GLY 18 N 1.12 0.00 0.00 4.60 0.00 -1.23 -4.58 105.19 105.10 1a3p n GLY 18 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1a3p n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1a3p n VAL 19 N 0.00 0.00 0.00 1.61 0.31 0.70 -4.73 118.33 116.22 1a3p n VAL 19 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1a3p n VAL 19 Cb 0.00 -0.91 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 1a3p n VAL 19 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1a3p n MET 21 N 0.00 0.00 -2.43 5.55 0.00 0.80 -0.33 117.12 120.70 1a3p n MET 21 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.27 1a3p n MET 21 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 33.22 33.20 1a3p n MET 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 1a3p s HIS 22 N -0.16 2.66 -0.42 3.17 2.46 -1.26 -1.13 115.29 120.61 1a3p s HIS 22 Ca 0.00 0.83 0.09 0.00 0.47 0.00 0.00 55.06 56.45 1a3p s HIS 22 Cb 0.00 -4.02 0.59 0.00 -0.13 0.00 0.00 32.58 29.02 1a3p s HIS 22 CO 0.00 -1.69 1.48 1.51 -2.47 0.00 0.00 174.74 173.57 1a3p n ILE 23 N 6.42 2.17 -0.32 0.89 0.13 0.67 -4.52 119.36 124.81 1a3p n ILE 23 Ca 0.15 -1.11 0.30 0.00 -1.10 0.00 0.00 62.75 60.99 1a3p n ILE 23 Cb 0.47 -0.39 0.54 0.00 -0.84 0.00 0.00 39.64 39.43 1a3p n ILE 23 CO 0.00 0.00 0.00 1.21 2.80 0.00 0.00 176.55 180.56 1a3p n GLU 24 N 0.25 -0.05 -0.19 9.51 0.00 0.48 0.32 120.64 130.96 1a3p n GLU 24 Ca 0.25 1.19 0.13 0.00 0.00 0.00 0.00 57.16 58.73 1a3p n GLU 24 Cb 1.04 -2.19 0.24 0.00 0.00 0.00 0.00 31.44 30.52 1a3p n GLU 24 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1a3p n SER 25 N -4.86 0.05 -0.01 4.31 7.64 -1.26 -1.58 113.62 117.92 1a3p n SER 25 Ca 0.34 0.93 -0.01 0.00 1.01 0.00 0.00 58.87 61.15 1a3p n SER 25 Cb 1.21 -0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 64.01 1a3p n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a3p n LEU 26 N -4.49 2.45 0.00 -3.43 -0.00 0.15 -5.08 117.00 106.61 1a3p n LEU 26 Ca 0.17 -0.01 0.00 0.00 -0.00 0.00 0.00 56.01 56.17 1a3p n LEU 26 Cb 0.56 -0.03 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1a3p n LEU 26 CO -0.02 0.43 0.00 0.47 -0.00 0.00 0.00 177.39 178.27 1a3p n ASP 27 N -2.45 0.00 0.00 1.45 8.00 0.89 -5.15 116.55 119.30 1a3p n ASP 27 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1a3p n ASP 27 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1a3p n ASP 27 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1a3p n SER 28 N -0.76 2.64 -4.83 -2.24 3.41 -1.23 -4.30 113.62 106.31 1a3p n SER 28 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.23 1a3p n SER 28 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1a3p n SER 28 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1a3p s TYR 29 N 0.96 3.66 0.36 7.33 5.04 -1.26 0.24 117.35 133.68 1a3p s TYR 29 Ca 0.00 0.83 -0.05 0.00 -2.44 0.00 0.00 57.07 55.41 1a3p s TYR 29 Cb 0.00 -2.21 0.01 0.00 0.35 0.00 0.00 41.96 40.12 1a3p s TYR 29 CO 0.00 0.62 0.54 -0.08 -1.34 0.00 0.00 175.55 175.29 1a3p s THR 30 N -0.87 0.00 0.02 4.34 -1.32 -0.28 -4.70 115.64 112.83 1a3p s THR 30 Ca 0.21 -1.48 0.08 0.00 -1.21 0.00 0.00 61.69 59.29 1a3p s THR 30 Cb -0.15 -2.70 -0.02 0.00 -1.51 0.00 0.00 72.50 68.12 1a3p s THR 30 CO 0.10 0.00 -0.23 0.00 -2.21 0.00 0.00 174.62 172.28 1a3p s ASN 32 N -0.89 5.85 0.00 0.00 2.47 0.55 -4.65 114.94 118.27 1a3p s ASN 32 Ca 0.09 -0.91 0.00 0.00 0.42 0.00 0.00 52.86 52.46 1a3p s ASN 32 Cb -0.09 -2.07 0.00 0.00 -1.45 0.00 0.00 41.25 37.64 1a3p s ASN 32 CO 0.01 -0.39 0.00 0.00 -3.72 0.00 0.00 177.10 173.00 1a3p s VAL 34 N 0.64 0.09 0.51 0.00 0.11 0.39 -4.55 120.40 117.58 1a3p s VAL 34 Ca 0.00 -1.62 0.25 0.00 -2.93 0.00 0.00 61.98 57.68 1a3p s VAL 34 Cb 0.00 -1.91 0.25 0.00 -1.53 0.00 0.00 36.38 33.19 1a3p s VAL 34 CO 0.00 -0.39 1.75 -0.29 -3.33 0.00 0.00 175.10 172.84 1a3p h ILE 35 N 2.70 0.00 0.00 7.04 2.10 -1.99 0.13 117.51 127.49 1a3p h ILE 35 Ca -0.33 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.61 1a3p h ILE 35 Cb 1.21 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.50 1a3p h ILE 35 CO 0.54 0.00 -1.24 0.61 -1.08 0.00 0.00 178.15 176.98 1a3p n GLY 36 N -1.24 -0.59 2.89 8.18 0.00 -1.26 -4.39 105.19 108.78 1a3p n GLY 36 Ca -0.02 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 1a3p n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1a3p s TYR 37 N -2.78 1.12 0.00 1.61 2.02 0.44 0.30 117.35 120.06 1a3p s TYR 37 Ca -0.00 -0.45 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 1a3p s TYR 37 Cb 0.11 -0.98 0.00 0.00 -0.40 0.00 0.00 41.96 40.69 1a3p s TYR 37 CO 0.64 -0.36 0.00 0.45 -1.57 0.00 0.00 175.55 174.72 1a3p n SER 38 N 4.59 0.00 0.00 2.29 2.88 0.08 -0.47 113.62 122.99 1a3p n SER 38 Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 1a3p n SER 38 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1a3p n SER 38 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1a3p n GLY 39 N 1.82 2.02 0.00 0.46 0.00 -1.26 -1.97 105.19 106.26 1a3p n GLY 39 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1a3p n GLY 39 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a3p n ASP 40 N 2.63 0.00 -0.02 1.61 2.03 -1.26 -4.95 116.55 116.59 1a3p n ASP 40 Ca 0.00 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.31 1a3p n ASP 40 Cb 0.00 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.35 1a3p n ASP 40 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1a3p n ARG 41 N 0.00 1.93 -2.30 -0.67 0.00 -1.21 -3.79 116.66 110.61 1a3p n ARG 41 Ca 0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 57.85 57.82 1a3p n ARG 41 Cb 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 32.46 31.31 1a3p n ARG 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1a3p h GLN 43 N -0.01 0.00 -3.68 0.00 -0.00 -1.93 -3.38 115.11 106.11 1a3p h GLN 43 Ca -0.00 0.00 -0.74 0.00 -0.00 0.00 0.00 58.65 57.90 1a3p h GLN 43 Cb 1.00 0.00 -0.31 0.00 -0.00 0.00 0.00 27.48 28.18 1a3p h GLN 43 CO 0.01 0.26 -0.12 -0.08 -0.00 0.00 0.00 178.83 178.90 1a3p s THR 44 N -3.00 4.67 -0.95 1.86 -1.32 -1.26 -4.95 115.64 110.70 1a3p s THR 44 Ca -0.02 -2.77 -0.21 0.00 -1.21 0.00 0.00 61.69 57.48 1a3p s THR 44 Cb 0.09 -3.95 0.09 0.00 -1.51 0.00 0.00 72.50 67.22 1a3p s THR 44 CO 0.80 -0.96 1.27 -0.13 -2.21 0.00 0.00 174.62 173.38 1a3p s ARG 45 N -0.03 3.56 0.67 7.08 0.52 -1.26 -0.74 118.95 128.75 1a3p s ARG 45 Ca 0.18 -1.38 0.43 0.00 -0.52 0.00 0.00 55.73 54.44 1a3p s ARG 45 Cb -0.15 -5.06 2.35 0.00 0.52 0.00 0.00 34.95 32.61 1a3p s ARG 45 CO -0.06 -1.98 2.33 0.22 0.02 0.00 0.00 175.30 175.82 1a3p h ASP 46 N 9.34 0.00 -4.64 0.23 3.58 0.43 -3.46 116.42 121.90 1a3p h ASP 46 Ca 0.14 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.35 1a3p h ASP 46 Cb 1.02 0.00 0.12 0.00 1.72 0.00 0.00 39.33 42.19 1a3p h ASP 46 CO 1.26 0.00 -0.55 -0.11 -2.88 0.00 0.00 179.24 176.95 1a3p n LEU 47 N -3.07 -3.45 -0.03 2.28 0.00 0.24 -4.98 117.00 107.98 1a3p n LEU 47 Ca -0.03 -0.45 0.00 0.00 0.00 0.00 0.00 56.01 55.54 1a3p n LEU 47 Cb 0.11 -2.41 0.00 0.00 0.00 0.00 0.00 43.42 41.12 1a3p n LEU 47 CO 0.19 0.29 0.26 -1.14 0.00 0.00 0.00 177.39 177.00