#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ccv n GLU 2 N 0.00 -0.85 -1.44 3.49 0.28 -1.26 -4.85 120.64 116.01 1ccv n GLU 2 Ca 0.00 0.11 -0.29 0.00 -0.16 0.00 0.00 57.16 56.82 1ccv n GLU 2 Cb 0.00 -3.82 0.16 0.00 1.43 0.00 0.00 31.44 29.21 1ccv n GLU 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ccv n GLY 4 N -1.97 -2.46 3.69 0.00 0.00 -1.26 -4.77 105.19 98.42 1ccv n GLY 4 Ca 0.08 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1ccv n GLY 4 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ccv s PRO 5 N -3.30 4.36 0.00 1.61 0.04 -1.26 -2.25 135.00 134.20 1ccv s PRO 5 Ca 0.39 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.14 1ccv s PRO 5 Cb -0.06 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.96 1ccv s PRO 5 CO 0.41 -0.42 0.00 0.09 0.04 0.00 0.00 177.00 177.12 1ccv n ASN 6 N 4.96 -1.22 -4.89 6.66 3.02 -1.26 -4.90 115.26 117.63 1ccv n ASN 6 Ca 0.11 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.44 1ccv n ASN 6 Cb 0.46 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.39 1ccv n ASN 6 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1ccv s GLU 7 N -0.10 3.16 0.01 3.52 2.02 -0.96 -1.36 118.70 124.99 1ccv s GLU 7 Ca 0.00 -0.91 -0.07 0.00 0.02 0.00 0.00 54.97 54.01 1ccv s GLU 7 Cb 0.00 -2.72 0.00 0.00 0.10 0.00 0.00 34.13 31.51 1ccv s GLU 7 CO 0.00 0.42 0.13 0.14 0.02 0.00 0.00 175.26 175.97 1ccv s VAL 8 N -2.05 0.09 -0.23 2.63 -7.23 -0.54 -4.72 120.40 108.36 1ccv s VAL 8 Ca 0.33 -0.71 -0.11 0.00 -1.81 0.00 0.00 61.98 59.68 1ccv s VAL 8 Cb -0.08 -0.45 -0.05 0.00 0.56 0.00 0.00 36.38 36.35 1ccv s VAL 8 CO 0.27 -0.39 0.16 0.12 -0.31 0.00 0.00 175.10 174.95 1ccv s PHE 9 N -1.45 3.34 -0.07 2.82 2.19 -1.26 0.72 117.98 124.27 1ccv s PHE 9 Ca -0.14 0.27 0.04 0.00 0.33 0.00 0.00 56.93 57.42 1ccv s PHE 9 Cb -0.07 -2.25 0.00 0.00 -1.31 0.00 0.00 43.02 39.38 1ccv s PHE 9 CO 0.01 0.12 -0.18 -0.80 1.83 0.00 0.00 175.22 176.20 1ccv s ASN 10 N 0.89 2.36 0.00 6.13 0.01 -0.66 -4.92 114.94 118.76 1ccv s ASN 10 Ca 0.08 -0.41 0.15 0.00 -0.71 0.00 0.00 52.86 51.97 1ccv s ASN 10 Cb -0.13 -0.95 0.71 0.00 0.41 0.00 0.00 41.25 41.29 1ccv s ASN 10 CO 0.03 0.12 1.48 0.35 -1.51 0.00 0.00 177.10 177.57 1ccv n THR 11 N 3.49 0.11 -2.70 1.60 -2.24 -1.26 -1.61 114.28 111.67 1ccv n THR 11 Ca -0.20 -0.14 -0.04 0.00 -2.27 0.00 0.00 64.05 61.40 1ccv n THR 11 Cb 0.52 -0.01 0.03 0.00 -2.10 0.00 0.00 70.33 68.78 1ccv n THR 11 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ccv s GLY 13 N 0.57 2.68 -0.33 0.00 0.00 -0.60 -4.69 107.32 104.96 1ccv s GLY 13 Ca 0.26 -1.11 -0.28 0.00 0.00 0.00 0.00 44.72 43.59 1ccv s GLY 13 CO -0.10 -2.07 2.02 -1.35 0.00 0.00 0.00 173.10 171.60 1ccv s SER 14 N -3.97 5.52 0.48 1.64 1.04 -1.26 -0.11 113.70 117.03 1ccv s SER 14 Ca 0.22 1.41 0.21 0.00 0.48 0.00 0.00 55.95 58.27 1ccv s SER 14 Cb 0.02 -2.52 1.23 0.00 0.10 0.00 0.00 66.02 64.85 1ccv s SER 14 CO 0.13 -1.99 1.94 0.00 0.98 0.00 0.00 173.24 174.30 1ccv h ALA 15 N 14.59 2.34 -0.93 5.32 0.00 -1.86 0.24 119.26 138.96 1ccv h ALA 15 Ca -0.35 -0.01 -0.60 0.00 0.00 0.00 0.00 54.91 53.96 1ccv h ALA 15 Cb 1.20 -0.01 -0.39 0.00 0.00 0.00 0.00 17.79 18.60 1ccv h ALA 15 CO 1.04 -0.53 -0.32 0.00 0.00 0.00 0.00 179.25 179.43 1ccv n ALA 17 N -0.72 -3.32 -1.80 0.00 0.00 0.85 -3.97 120.51 111.56 1ccv n ALA 17 Ca 0.48 -1.19 -0.34 0.00 0.00 0.00 0.00 53.44 52.39 1ccv n ALA 17 Cb 0.82 -1.06 -0.04 0.00 0.00 0.00 0.00 19.45 19.18 1ccv n ALA 17 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ccv s PRO 18 N -2.92 3.83 0.23 0.00 0.04 -1.26 -4.84 135.00 130.08 1ccv s PRO 18 Ca 0.42 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.84 1ccv s PRO 18 Cb -0.03 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 1ccv s PRO 18 CO 0.54 -0.41 0.11 0.95 0.04 0.00 0.00 177.00 178.24 1ccv s THR 19 N -1.95 0.30 0.61 1.26 -4.23 0.20 -4.19 115.64 107.65 1ccv s THR 19 Ca 0.67 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.48 1ccv s THR 19 Cb -0.17 -2.56 0.36 0.00 1.34 0.00 0.00 72.50 71.47 1ccv s THR 19 CO 0.20 -0.01 2.02 0.00 -0.54 0.00 0.00 174.62 176.29 1ccv h ALA 21 N 1.59 0.34 -3.07 0.00 0.00 -1.95 -3.41 119.26 112.75 1ccv h ALA 21 Ca 0.10 -1.29 -0.63 0.00 0.00 0.00 0.00 54.91 53.09 1ccv h ALA 21 Cb 0.69 0.67 -0.41 0.00 0.00 0.00 0.00 17.79 18.74 1ccv h ALA 21 CO -0.00 1.08 -0.54 -0.65 0.00 0.00 0.00 179.25 179.14 1ccv s GLN 22 N -2.50 2.53 -1.18 0.00 -0.21 0.30 -4.98 119.66 113.62 1ccv s GLN 22 Ca -0.23 -3.35 -0.11 0.00 0.02 0.00 0.00 55.36 51.70 1ccv s GLN 22 Cb 0.06 -3.47 -0.07 0.00 1.00 0.00 0.00 33.01 30.54 1ccv s GLN 22 CO 0.73 -1.28 2.36 -0.35 -2.12 0.00 0.00 175.29 174.62 1ccv n PRO 23 N 2.00 2.59 -3.64 2.91 -0.04 -0.30 0.60 135.00 139.11 1ccv n PRO 23 Ca 0.20 -1.89 -0.05 0.00 -0.04 0.00 0.00 63.50 61.72 1ccv n PRO 23 Cb 0.35 -2.74 -0.07 0.00 -0.04 0.00 0.00 33.50 31.01 1ccv n PRO 23 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1ccv s LYS 24 N 3.25 0.18 0.63 0.54 2.20 -1.26 -4.96 119.74 120.32 1ccv s LYS 24 Ca 0.52 0.20 -0.17 0.00 -0.36 0.00 0.00 55.97 56.16 1ccv s LYS 24 Cb 0.14 0.09 -0.02 0.00 -1.51 0.00 0.00 37.83 36.53 1ccv s LYS 24 CO -0.03 -0.02 1.17 0.99 -0.36 0.00 0.00 175.35 177.10 1ccv s THR 25 N -0.00 2.82 -0.36 3.43 2.01 -1.26 -4.18 115.64 118.10 1ccv s THR 25 Ca 0.06 0.45 -0.05 0.00 0.31 0.00 0.00 61.69 62.47 1ccv s THR 25 Cb -0.05 -3.08 0.19 0.00 0.01 0.00 0.00 72.50 69.58 1ccv s THR 25 CO -0.13 -0.17 0.97 -0.13 -0.69 0.00 0.00 174.62 174.47 1ccv s ARG 26 N -3.63 0.35 1.00 4.92 1.81 -1.25 -5.00 118.95 117.14 1ccv s ARG 26 Ca 0.73 -0.19 -0.17 0.00 -1.72 0.00 0.00 55.73 54.38 1ccv s ARG 26 Cb -0.26 0.02 -0.14 0.00 -0.45 0.00 0.00 34.95 34.12 1ccv s ARG 26 CO 0.36 -0.49 -0.74 -0.89 -0.68 0.00 0.00 175.30 172.87 1ccv n ILE 27 N 3.55 0.00 0.00 1.52 -0.00 -1.26 -4.55 119.36 118.61 1ccv n ILE 27 Ca 0.08 -0.48 0.00 0.00 -0.00 0.00 0.00 62.75 62.36 1ccv n ILE 27 Cb 0.62 -0.04 0.00 0.00 -0.00 0.00 0.00 39.64 40.22 1ccv n ILE 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1ccv n THR 29 N -2.49 0.00 -1.00 0.00 -2.24 -1.26 -5.04 114.28 102.26 1ccv n THR 29 Ca 0.00 -1.67 -0.24 0.00 -2.27 0.00 0.00 64.05 59.87 1ccv n THR 29 Cb 0.33 0.65 0.08 0.00 -2.10 0.00 0.00 70.33 69.29 1ccv n THR 29 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1ccv n MET 30 N -0.60 2.16 -4.13 -0.78 1.56 -1.26 -4.90 117.12 109.18 1ccv n MET 30 Ca -0.02 -2.37 -0.12 0.00 -0.27 0.00 0.00 57.70 54.92 1ccv n MET 30 Cb 0.43 -1.93 -0.08 0.00 2.15 0.00 0.00 33.22 33.79 1ccv n MET 30 CO 0.00 0.00 0.00 -1.14 -0.73 0.00 0.00 175.97 174.10 1ccv s GLN 31 N -2.72 1.42 0.61 2.12 0.74 -1.26 -5.18 119.66 115.40 1ccv s GLN 31 Ca 0.46 -1.55 0.07 0.00 0.05 0.00 0.00 55.36 54.40 1ccv s GLN 31 Cb 0.37 0.36 0.11 0.00 1.10 0.00 0.00 33.01 34.94 1ccv s GLN 31 CO 0.01 -0.53 0.85 0.00 -0.55 0.00 0.00 175.29 175.07 1ccv s ARG 33 N -4.74 1.24 -0.25 0.00 3.00 0.84 -4.78 118.95 114.26 1ccv s ARG 33 Ca 0.62 -0.15 -0.21 0.00 -1.00 0.00 0.00 55.73 54.99 1ccv s ARG 33 Cb -0.05 -1.42 -0.02 0.00 0.00 0.00 0.00 34.95 33.47 1ccv s ARG 33 CO 0.40 -0.29 0.67 0.42 0.00 0.00 0.00 175.30 176.50 1ccv s ILE 34 N 1.79 4.96 0.00 4.11 1.01 -1.26 -1.55 121.20 130.26 1ccv s ILE 34 Ca 0.05 1.22 0.00 0.00 0.00 0.00 0.00 60.65 61.92 1ccv s ILE 34 Cb -0.13 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.37 1ccv s ILE 34 CO -0.07 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.49 1ccv n GLY 35 N 4.06 0.11 3.80 6.18 0.00 -0.63 -5.01 105.19 113.69 1ccv n GLY 35 Ca 0.01 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.39 1ccv n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ccv n GLN 37 N -0.18 0.40 -3.22 0.00 10.64 0.22 -4.94 117.38 120.31 1ccv n GLN 37 Ca 0.05 -3.16 -0.39 0.00 -1.83 0.00 0.00 57.00 51.67 1ccv n GLN 37 Cb 0.52 2.53 -0.06 0.00 -0.86 0.00 0.00 30.24 32.37 1ccv n GLN 37 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ccv s GLN 39 N 1.36 -0.83 -0.48 0.00 -0.21 -0.47 -4.75 119.66 114.28 1ccv s GLN 39 Ca 0.27 0.87 -0.27 0.00 0.02 0.00 0.00 55.36 56.25 1ccv s GLN 39 Cb -0.16 -1.56 -0.05 0.00 1.00 0.00 0.00 33.01 32.25 1ccv s GLN 39 CO 0.11 -3.67 2.14 -2.00 -2.12 0.00 0.00 175.29 169.74 1ccv s GLU 40 N -4.48 2.52 0.00 2.91 2.56 -1.26 -1.16 118.70 119.78 1ccv s GLU 40 Ca 0.68 1.21 0.00 0.00 0.00 0.00 0.00 54.97 56.86 1ccv s GLU 40 Cb -0.25 -4.45 0.00 0.00 2.00 0.00 0.00 34.13 31.43 1ccv s GLU 40 CO 0.64 -2.82 0.00 0.41 -0.56 0.00 0.00 175.26 172.93 1ccv n GLY 41 N 5.81 0.23 3.23 -1.50 0.00 -1.26 -5.13 105.19 106.57 1ccv n GLY 41 Ca 0.29 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 1ccv n GLY 41 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ccv s PHE 42 N -1.20 1.34 -0.01 1.61 0.40 -0.31 -4.12 117.98 115.70 1ccv s PHE 42 Ca 0.00 -0.56 0.03 0.00 -0.60 0.00 0.00 56.93 55.80 1ccv s PHE 42 Cb 0.00 -0.71 -0.01 0.00 0.51 0.00 0.00 43.02 42.81 1ccv s PHE 42 CO 0.00 0.12 -0.10 -0.51 0.70 0.00 0.00 175.22 175.42 1ccv s LEU 43 N -2.39 2.03 0.01 -0.37 1.43 0.11 -4.56 118.68 114.95 1ccv s LEU 43 Ca 0.08 -0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 52.68 1ccv s LEU 43 Cb -0.05 -0.53 -0.04 0.00 0.03 0.00 0.00 46.19 45.61 1ccv s LEU 43 CO 0.03 0.12 1.01 -0.60 0.23 0.00 0.00 176.35 177.13 1ccv s ARG 44 N -0.27 4.55 0.19 1.70 3.52 -1.26 0.59 118.95 127.97 1ccv s ARG 44 Ca 0.04 1.47 -0.04 0.00 -0.13 0.00 0.00 55.73 57.07 1ccv s ARG 44 Cb -0.04 -3.44 -0.05 0.00 -1.56 0.00 0.00 34.95 29.86 1ccv s ARG 44 CO -0.00 -0.06 0.42 0.54 -0.81 0.00 0.00 175.30 175.39 1ccv s ASN 45 N 0.95 6.46 0.37 -2.12 4.22 0.23 -1.39 114.94 123.67 1ccv s ASN 45 Ca 0.53 0.57 0.32 0.00 -2.14 0.00 0.00 52.86 52.14 1ccv s ASN 45 Cb -0.22 -2.08 1.19 0.00 1.28 0.00 0.00 41.25 41.42 1ccv s ASN 45 CO 0.28 -0.03 1.13 0.61 -2.04 0.00 0.00 177.10 177.05 1ccv n GLY 46 N -0.36 -0.68 1.51 0.45 0.00 -1.26 0.29 105.19 105.14 1ccv n GLY 46 Ca -0.03 0.52 -0.07 0.00 0.00 0.00 0.00 46.02 46.44 1ccv n GLY 46 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ccv n GLU 47 N -3.64 1.36 -3.90 1.61 4.07 -1.26 -4.79 120.64 114.08 1ccv n GLU 47 Ca 0.31 -0.76 -0.32 0.00 -0.06 0.00 0.00 57.16 56.33 1ccv n GLU 47 Cb 1.35 -1.30 -0.06 0.00 -0.06 0.00 0.00 31.44 31.37 1ccv n GLU 47 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ccv n GLY 48 N 0.53 -0.37 3.28 8.31 0.00 0.83 -4.86 105.19 112.91 1ccv n GLY 48 Ca 0.15 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 1ccv n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ccv s ALA 49 N -2.81 2.73 -0.82 4.61 0.00 -1.02 -4.84 121.76 119.62 1ccv s ALA 49 Ca 0.63 -1.17 -0.26 0.00 0.00 0.00 0.00 51.96 51.16 1ccv s ALA 49 Cb -0.36 -1.61 0.02 0.00 0.00 0.00 0.00 23.12 21.17 1ccv s ALA 49 CO 0.77 -0.40 1.46 0.00 0.00 0.00 0.00 175.76 177.59 1ccv s VAL 51 N 6.31 2.44 0.83 0.00 -7.23 0.20 -4.78 120.40 118.17 1ccv s VAL 51 Ca 0.46 -1.46 -0.14 0.00 -1.81 0.00 0.00 61.98 59.03 1ccv s VAL 51 Cb -0.06 -2.03 0.03 0.00 0.56 0.00 0.00 36.38 34.88 1ccv s VAL 51 CO 0.07 0.25 0.71 0.18 -0.31 0.00 0.00 175.10 176.00 1ccv n LEU 52 N 1.35 1.66 0.11 1.32 4.32 -1.26 0.10 117.00 124.59 1ccv n LEU 52 Ca -0.17 0.49 -0.03 0.00 -0.02 0.00 0.00 56.01 56.29 1ccv n LEU 52 Cb 0.52 -1.31 0.08 0.00 -1.62 0.00 0.00 43.42 41.09 1ccv n LEU 52 CO 0.25 -2.83 0.39 1.55 -1.22 0.00 0.00 177.39 175.53 1ccv h PRO 53 N -0.99 0.00 0.00 3.23 0.13 -1.90 -2.75 132.00 129.71 1ccv h PRO 53 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1ccv h PRO 53 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1ccv h PRO 53 CO 0.41 0.73 0.00 -0.85 -0.23 0.00 0.00 178.00 178.05 1ccv n GLU 54 N -3.63 0.31 -0.00 0.86 0.28 -1.26 -2.04 120.64 115.16 1ccv n GLU 54 Ca -0.01 0.07 0.05 0.00 -0.16 0.00 0.00 57.16 57.11 1ccv n GLU 54 Cb 0.72 -1.50 0.04 0.00 1.43 0.00 0.00 31.44 32.13 1ccv n GLU 54 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1ccv n ASN 55 N -1.30 1.84 0.00 -1.84 3.02 -1.06 -5.28 115.26 110.65 1ccv n ASN 55 Ca 0.11 -1.42 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 1ccv n ASN 55 Cb 0.19 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1ccv n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64