#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdn s LEU 10 N 0.00 3.07 -0.05 -1.96 2.01 -1.26 -2.72 118.68 117.77 2wdn s LEU 10 Ca 0.00 -1.31 0.05 0.00 0.01 0.00 0.00 54.13 52.88 2wdn s LEU 10 Cb 0.00 -1.38 -0.01 0.00 0.01 0.00 0.00 46.19 44.81 2wdn s LEU 10 CO 0.00 -0.21 -0.21 -0.76 1.01 0.00 0.00 176.35 176.18 2wdn s LEU 11 N 1.23 1.99 -0.03 1.79 2.01 -1.18 -4.85 118.68 119.64 2wdn s LEU 11 Ca -0.07 -0.42 -0.01 0.00 0.01 0.00 0.00 54.13 53.63 2wdn s LEU 11 Cb -0.19 -1.16 -0.04 0.00 0.01 0.00 0.00 46.19 44.81 2wdn s LEU 11 CO -0.06 0.20 0.05 -1.83 1.01 0.00 0.00 176.35 175.73 2wdn s GLU 12 N -0.10 3.02 0.04 1.70 1.03 -1.26 0.14 118.70 123.27 2wdn s GLU 12 Ca -0.03 -0.46 -0.18 0.00 0.03 0.00 0.00 54.97 54.33 2wdn s GLU 12 Cb -0.12 -2.83 -0.06 0.00 -0.80 0.00 0.00 34.13 30.31 2wdn s GLU 12 CO 0.03 0.67 0.51 0.00 -1.33 0.00 0.00 175.26 175.13 2wdn s THR 14 N -0.98 2.80 -0.32 0.00 -1.32 -1.26 -3.05 115.64 111.51 2wdn s THR 14 Ca 0.27 -0.70 -0.32 0.00 -1.21 0.00 0.00 61.69 59.73 2wdn s THR 14 Cb -0.18 -2.23 -0.09 0.00 -1.51 0.00 0.00 72.50 68.49 2wdn s THR 14 CO 0.17 0.48 2.22 1.21 -2.21 0.00 0.00 174.62 176.49 2wdn n GLU 15 N 4.54 1.38 -1.49 7.08 2.13 -1.00 -3.47 120.64 129.81 2wdn n GLU 15 Ca -0.19 0.36 -0.44 0.00 0.66 0.00 0.00 57.16 57.55 2wdn n GLU 15 Cb 0.51 -2.77 -0.07 0.00 0.27 0.00 0.00 31.44 29.37 2wdn n GLU 15 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2wdn n LYS 17 N 8.52 0.00 0.00 0.00 0.00 -1.26 -4.98 118.16 120.43 2wdn n LYS 17 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.76 2wdn n LYS 17 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.31 2wdn n LYS 17 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2wdn n ARG 18 N -0.29 0.00 0.00 1.64 0.00 0.26 -5.16 116.66 113.11 2wdn n ARG 18 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2wdn n ARG 18 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 2wdn n ARG 18 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2wdn n ARG 19 N 0.00 0.00 -0.76 2.89 0.00 -1.26 -4.45 116.66 113.08 2wdn n ARG 19 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.90 2wdn n ARG 19 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 32.46 32.44 2wdn n ARG 19 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2wdn n ASN 20 N 0.00 -2.23 -2.83 2.89 4.05 -1.26 -2.38 115.26 113.50 2wdn n ASN 20 Ca 0.00 0.37 -0.10 0.00 0.45 0.00 0.00 54.58 55.30 2wdn n ASN 20 Cb 0.00 -2.45 0.02 0.00 1.23 0.00 0.00 39.78 38.58 2wdn n ASN 20 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 2wdn n TYR 21 N -3.16 -2.17 0.00 1.20 4.02 -1.17 -4.16 117.16 111.71 2wdn n TYR 21 Ca -0.02 -1.96 0.00 0.00 -0.01 0.00 0.00 57.90 55.90 2wdn n TYR 21 Cb 0.29 0.85 0.00 0.00 -0.02 0.00 0.00 39.34 40.46 2wdn n TYR 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wdn n ALA 22 N -0.60 0.41 -2.63 -0.72 0.00 -1.18 -4.80 120.51 110.99 2wdn n ALA 22 Ca -0.16 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.25 2wdn n ALA 22 Cb 0.59 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.02 2wdn n ALA 22 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wdn n THR 23 N -0.24 -9.11 -1.04 0.00 -2.24 -1.26 -4.84 114.28 95.55 2wdn n THR 23 Ca 0.00 1.97 0.00 0.00 -2.27 0.00 0.00 64.05 63.75 2wdn n THR 23 Cb 0.00 -5.09 0.00 0.00 -2.10 0.00 0.00 70.33 63.14 2wdn n THR 23 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wdn n GLU 24 N 1.97 2.14 -3.41 -0.78 -0.58 0.36 -4.90 120.64 115.45 2wdn n GLU 24 Ca -0.22 0.00 -0.18 0.00 -0.42 0.00 0.00 57.16 56.34 2wdn n GLU 24 Cb 0.34 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.11 2wdn n GLU 24 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2wdn s LYS 25 N 3.44 0.34 1.34 3.49 1.02 -1.26 -3.10 119.74 125.01 2wdn s LYS 25 Ca 0.00 -0.23 -0.22 0.00 0.02 0.00 0.00 55.97 55.54 2wdn s LYS 25 Cb 0.00 -0.70 0.34 0.00 -0.52 0.00 0.00 37.83 36.95 2wdn s LYS 25 CO 0.00 -1.04 1.01 1.21 -0.92 0.00 0.00 175.35 175.61 2wdn s ASN 26 N 2.27 -0.29 -0.04 2.83 3.84 -1.10 -4.91 114.94 117.54 2wdn s ASN 26 Ca 0.10 0.72 0.05 0.00 0.21 0.00 0.00 52.86 53.95 2wdn s ASN 26 Cb -0.14 -1.00 0.08 0.00 -0.55 0.00 0.00 41.25 39.64 2wdn s ASN 26 CO -0.31 -4.88 0.94 0.29 -2.79 0.00 0.00 177.10 170.35 2wdn n LYS 27 N -5.29 1.37 0.00 0.43 4.76 -1.26 -3.63 118.16 114.54 2wdn n LYS 27 Ca 0.13 -1.52 0.00 0.00 -2.87 0.00 0.00 58.31 54.05 2wdn n LYS 27 Cb 0.60 -0.95 0.00 0.00 -1.84 0.00 0.00 35.03 32.83 2wdn n LYS 27 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2wdn n ARG 28 N -0.58 0.00 0.37 1.97 5.12 -1.26 -3.58 116.66 118.70 2wdn n ARG 28 Ca 0.05 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.78 2wdn n ARG 28 Cb 0.49 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.70 2wdn n ARG 28 CO 0.00 0.00 0.00 -0.91 -1.93 0.00 0.00 177.63 174.79 2wdn h ASN 29 N 0.00 -1.19 -3.17 0.55 2.35 -1.99 -3.35 115.58 108.78 2wdn h ASN 29 Ca 0.00 0.08 -0.54 0.00 -0.55 0.00 0.00 56.30 55.28 2wdn h ASN 29 Cb 0.00 0.36 0.21 0.00 0.05 0.00 0.00 38.32 38.94 2wdn h ASN 29 CO 0.00 -0.68 -0.67 0.35 -1.65 0.00 0.00 177.43 174.77 2wdn n THR 30 N -5.58 0.52 0.00 2.81 -2.24 -1.23 -4.28 114.28 104.28 2wdn n THR 30 Ca -0.13 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2wdn n THR 30 Cb 0.46 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 2wdn n THR 30 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2wdn n PRO 31 N -0.90 0.00 -3.45 -0.78 -0.02 -1.26 -4.69 135.00 123.90 2wdn n PRO 31 Ca 0.07 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.43 2wdn n PRO 31 Cb 0.53 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.98 2wdn n PRO 31 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2wdn s ASN 32 N 0.00 -0.54 0.00 2.55 2.47 -1.26 -4.31 114.94 113.85 2wdn s ASN 32 Ca 0.00 -0.01 0.00 0.00 0.42 0.00 0.00 52.86 53.27 2wdn s ASN 32 Cb 0.00 0.58 0.00 0.00 -1.45 0.00 0.00 41.25 40.38 2wdn s ASN 32 CO 0.00 -0.94 0.00 0.29 -3.72 0.00 0.00 177.10 172.73 2wdn n LYS 33 N -0.31 0.00 -3.77 0.43 4.76 -1.26 -4.97 118.16 113.04 2wdn n LYS 33 Ca -0.17 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.00 2wdn n LYS 33 Cb 0.65 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.86 2wdn n LYS 33 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 2wdn n LEU 34 N -0.25 -2.72 -4.56 -0.35 0.00 -1.26 -4.83 117.00 103.03 2wdn n LEU 34 Ca 0.00 -0.98 -0.38 0.00 0.00 0.00 0.00 56.01 54.65 2wdn n LEU 34 Cb 0.00 -2.39 -0.03 0.00 0.00 0.00 0.00 43.42 40.99 2wdn n LEU 34 CO 0.00 0.44 1.42 -0.70 0.00 0.00 0.00 177.39 178.55 2wdn s GLU 35 N -6.15 3.30 0.06 1.96 2.56 -1.26 -4.96 118.70 114.21 2wdn s GLU 35 Ca 0.23 -0.79 0.09 0.00 0.00 0.00 0.00 54.97 54.51 2wdn s GLU 35 Cb -0.08 -5.13 -0.03 0.00 2.00 0.00 0.00 34.13 30.89 2wdn s GLU 35 CO 0.86 -2.46 -0.26 -0.48 -0.56 0.00 0.00 175.26 172.36 2wdn s LEU 36 N 6.26 2.20 -0.29 2.70 2.34 -1.26 -4.07 118.68 126.55 2wdn s LEU 36 Ca 0.50 -0.62 -0.17 0.00 0.06 0.00 0.00 54.13 53.91 2wdn s LEU 36 Cb -0.03 -1.23 0.16 0.00 -0.56 0.00 0.00 46.19 44.53 2wdn s LEU 36 CO -0.04 0.23 1.05 -0.13 -1.06 0.00 0.00 176.35 176.40 2wdn s ARG 37 N -1.40 0.30 -0.11 1.48 0.52 -0.98 -5.06 118.95 113.70 2wdn s ARG 37 Ca 0.12 0.51 -0.32 0.00 -0.52 0.00 0.00 55.73 55.52 2wdn s ARG 37 Cb -0.10 0.07 -0.10 0.00 0.52 0.00 0.00 34.95 35.34 2wdn s ARG 37 CO 0.03 -0.06 2.00 1.17 0.02 0.00 0.00 175.30 178.46 2wdn n LYS 38 N 3.46 2.20 0.00 3.54 4.81 -1.21 -4.19 118.16 126.77 2wdn n LYS 38 Ca -0.18 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 2wdn n LYS 38 Cb 0.57 -2.83 0.00 0.00 0.02 0.00 0.00 35.03 32.80 2wdn n LYS 38 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 2wdn n TYR 39 N 8.14 0.00 0.00 5.64 9.36 -1.10 -4.99 117.16 134.21 2wdn n TYR 39 Ca 0.25 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.47 2wdn n TYR 39 Cb 0.34 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.05 2wdn n TYR 39 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wdn s PRO 41 N 0.00 2.98 0.49 0.00 0.04 -1.26 -4.97 135.00 132.27 2wdn s PRO 41 Ca 0.00 -0.74 0.28 0.00 0.04 0.00 0.00 61.00 60.58 2wdn s PRO 41 Cb 0.00 -2.74 1.16 0.00 0.04 0.00 0.00 34.50 32.96 2wdn s PRO 41 CO 0.00 0.53 1.92 2.35 0.04 0.00 0.00 177.00 181.84 2wdn h TRP 42 N 2.80 0.00 -0.16 0.56 -0.00 -2.00 -3.34 115.95 113.81 2wdn h TRP 42 Ca -0.47 0.00 -0.59 0.00 -0.00 0.00 0.00 58.89 57.83 2wdn h TRP 42 Cb 1.18 0.00 0.01 0.00 -0.00 0.00 0.00 29.16 30.35 2wdn h TRP 42 CO 0.59 0.14 2.13 0.00 -0.00 0.00 0.00 178.44 181.30 2wdn n ARG 44 N 7.26 -3.60 -1.79 0.00 5.12 -1.25 -4.97 116.66 117.44 2wdn n ARG 44 Ca 0.49 2.60 -0.33 0.00 -1.93 0.00 0.00 57.85 58.68 2wdn n ARG 44 Cb 0.42 -2.85 0.04 0.00 -1.16 0.00 0.00 32.46 28.91 2wdn n ARG 44 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2wdn s LYS 45 N -2.66 2.86 0.14 5.56 -0.14 -1.25 -4.39 119.74 119.86 2wdn s LYS 45 Ca 0.00 1.36 -0.02 0.00 -1.36 0.00 0.00 55.97 55.95 2wdn s LYS 45 Cb 0.00 -1.96 0.03 0.00 -1.68 0.00 0.00 37.83 34.22 2wdn s LYS 45 CO 0.00 -1.20 0.18 -2.39 -0.76 0.00 0.00 175.35 171.18 2wdn n HIS 46 N -2.38 -3.84 -4.11 3.18 1.44 -1.26 -4.99 115.22 103.26 2wdn n HIS 46 Ca 0.10 -0.16 -0.28 0.00 -2.01 0.00 0.00 57.72 55.38 2wdn n HIS 46 Cb 0.52 -0.14 -0.03 0.00 0.12 0.00 0.00 29.99 30.46 2wdn n HIS 46 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2wdn s THR 47 N -1.38 1.55 -0.13 0.61 2.01 -1.26 -5.10 115.64 111.93 2wdn s THR 47 Ca 0.10 -1.62 0.08 0.00 0.31 0.00 0.00 61.69 60.57 2wdn s THR 47 Cb -0.00 -2.17 -0.14 0.00 0.01 0.00 0.00 72.50 70.20 2wdn s THR 47 CO 0.07 0.00 -0.01 0.55 -0.69 0.00 0.00 174.62 174.55 2wdn n VAL 48 N -1.63 0.88 -1.62 3.82 3.14 -1.26 -2.71 118.33 118.95 2wdn n VAL 48 Ca -0.06 -0.48 0.00 0.00 -2.96 0.00 0.00 64.34 60.84 2wdn n VAL 48 Cb 0.65 -0.77 0.00 0.00 -1.06 0.00 0.00 33.84 32.65 2wdn n VAL 48 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 2wdn n HIS 49 N -2.60 -4.45 0.00 1.45 8.25 -1.23 -2.32 115.22 114.33 2wdn n HIS 49 Ca -0.23 2.37 0.00 0.00 -0.26 0.00 0.00 57.72 59.60 2wdn n HIS 49 Cb 0.88 -3.55 0.00 0.00 1.12 0.00 0.00 29.99 28.44 2wdn n HIS 49 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2wdn n ARG 50 N -0.81 0.16 0.00 -0.41 5.12 -1.23 -3.18 116.66 116.31 2wdn n ARG 50 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2wdn n ARG 50 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2wdn n ARG 50 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2wdn n GLU 51 N 0.00 0.30 0.00 5.56 1.02 -1.26 -4.20 120.64 122.07 2wdn n GLU 51 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2wdn n GLU 51 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2wdn n GLU 51 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2wdn n VAL 52 N 0.00 0.00 0.00 2.62 0.31 -1.25 -4.28 118.33 115.72 2wdn n VAL 52 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2wdn n VAL 52 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2wdn n VAL 52 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80