#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrl s ARG 6 N 0.00 3.43 0.00 5.55 3.00 -1.26 -1.88 118.95 127.79 2wrl s ARG 6 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 55.73 55.83 2wrl s ARG 6 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 34.95 32.56 2wrl s ARG 6 CO 0.00 -0.25 0.00 -0.89 0.00 0.00 0.00 175.30 174.16 2wrl n ILE 7 N -2.26 0.00 0.00 1.52 -0.00 -1.26 -4.53 119.36 112.83 2wrl n ILE 7 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.76 2wrl n ILE 7 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.20 2wrl n ILE 7 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 2wrl n LYS 8 N -2.00 1.97 0.00 0.38 3.00 -1.22 -3.22 118.16 117.07 2wrl n LYS 8 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2wrl n LYS 8 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 35.03 34.08 2wrl n LYS 8 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 2wrl n LEU 9 N -1.56 0.00 -4.86 3.14 -0.00 -0.79 -2.87 117.00 110.07 2wrl n LEU 9 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 56.01 55.70 2wrl n LEU 9 Cb 0.20 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.61 2wrl n LEU 9 CO 0.00 0.00 0.68 -1.48 -0.00 0.00 0.00 177.39 176.59 2wrl s LEU 10 N 0.00 3.45 0.36 1.47 2.34 -1.26 -2.09 118.68 122.95 2wrl s LEU 10 Ca 0.00 1.47 -0.16 0.00 0.06 0.00 0.00 54.13 55.50 2wrl s LEU 10 Cb 0.00 -4.46 0.04 0.00 -0.56 0.00 0.00 46.19 41.22 2wrl s LEU 10 CO 0.00 -0.71 0.75 -1.48 -1.06 0.00 0.00 176.35 173.85 2wrl s LEU 11 N -4.59 0.01 0.10 1.48 -0.00 -1.10 -4.81 118.68 109.77 2wrl s LEU 11 Ca 0.57 -1.04 0.05 0.00 -0.00 0.00 0.00 54.13 53.70 2wrl s LEU 11 Cb -0.10 2.73 -0.04 0.00 -0.00 0.00 0.00 46.19 48.78 2wrl s LEU 11 CO 0.42 -1.58 -0.13 -1.61 -0.00 0.00 0.00 176.35 173.45 2wrl s GLU 12 N -2.75 0.92 0.08 1.48 2.02 -1.17 -1.65 118.70 117.63 2wrl s GLU 12 Ca 0.15 -1.15 0.05 0.00 0.02 0.00 0.00 54.97 54.04 2wrl s GLU 12 Cb -0.05 -0.75 -0.04 0.00 0.10 0.00 0.00 34.13 33.39 2wrl s GLU 12 CO 0.11 0.14 -0.03 0.00 0.02 0.00 0.00 175.26 175.50 2wrl s THR 14 N -1.24 0.68 0.44 0.00 -1.32 -1.01 -2.19 115.64 111.00 2wrl s THR 14 Ca 0.23 -0.10 -0.25 0.00 -1.21 0.00 0.00 61.69 60.37 2wrl s THR 14 Cb -0.11 -0.75 -0.08 0.00 -1.51 0.00 0.00 72.50 70.04 2wrl s THR 14 CO 0.16 0.30 1.37 -0.70 -2.21 0.00 0.00 174.62 173.53 2wrl s GLU 15 N 1.66 3.77 0.00 7.08 2.12 -1.08 -2.91 118.70 129.33 2wrl s GLU 15 Ca 0.02 2.28 0.00 0.00 0.36 0.00 0.00 54.97 57.63 2wrl s GLU 15 Cb -0.13 -2.66 0.00 0.00 0.26 0.00 0.00 34.13 31.60 2wrl s GLU 15 CO -0.05 -0.70 0.00 0.00 -0.54 0.00 0.00 175.26 173.96 2wrl n LYS 17 N -0.29 -6.82 -0.02 0.00 4.01 -1.26 -4.76 118.16 109.02 2wrl n LYS 17 Ca 0.00 0.72 0.00 0.00 -0.51 0.00 0.00 58.31 58.52 2wrl n LYS 17 Cb 0.00 -5.70 0.00 0.00 -0.51 0.00 0.00 35.03 28.82 2wrl n LYS 17 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2wrl n ARG 18 N -4.83 0.00 0.00 1.97 3.00 -1.24 -4.55 116.66 111.02 2wrl n ARG 18 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 2wrl n ARG 18 Cb 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 32.46 32.99 2wrl n ARG 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2wrl n ARG 19 N -0.14 0.00 0.00 -0.14 3.00 -1.26 -4.77 116.66 113.35 2wrl n ARG 19 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2wrl n ARG 19 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.53 2wrl n ARG 19 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2wrl n ASN 20 N 1.54 0.00 -4.31 0.55 3.02 -1.26 -4.49 115.26 110.31 2wrl n ASN 20 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 2wrl n ASN 20 Cb 0.00 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.10 2wrl n ASN 20 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2wrl n TYR 21 N 0.00 0.75 0.00 3.10 4.02 -1.26 -2.64 117.16 121.13 2wrl n TYR 21 Ca 0.00 -2.51 0.00 0.00 -0.01 0.00 0.00 57.90 55.38 2wrl n TYR 21 Cb 0.00 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.12 2wrl n TYR 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wrl n ALA 22 N -1.28 0.74 -1.65 -0.72 0.00 -0.93 -4.90 120.51 111.77 2wrl n ALA 22 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2wrl n ALA 22 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2wrl n ALA 22 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wrl n THR 23 N -2.47 -6.94 0.00 0.00 -2.24 -1.26 -4.85 114.28 96.51 2wrl n THR 23 Ca 0.00 2.43 0.00 0.00 -2.27 0.00 0.00 64.05 64.21 2wrl n THR 23 Cb 0.00 -3.62 0.00 0.00 -2.10 0.00 0.00 70.33 64.61 2wrl n THR 23 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wrl n GLU 24 N 0.71 0.15 -3.74 -0.78 -0.58 -0.66 -4.89 120.64 110.85 2wrl n GLU 24 Ca 0.00 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.60 2wrl n GLU 24 Cb 0.00 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 30.78 2wrl n GLU 24 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2wrl s LYS 25 N 4.41 0.63 0.00 3.49 2.20 -1.26 -2.73 119.74 126.49 2wrl s LYS 25 Ca 0.00 0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.65 2wrl s LYS 25 Cb 0.00 0.29 0.00 0.00 -1.51 0.00 0.00 37.83 36.61 2wrl s LYS 25 CO 0.00 -0.16 0.00 0.09 -0.36 0.00 0.00 175.35 174.92 2wrl n ASN 26 N 1.69 0.00 0.00 1.43 3.02 -0.89 -4.93 115.26 115.59 2wrl n ASN 26 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 2wrl n ASN 26 Cb 0.56 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 2wrl n ASN 26 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2wrl n LYS 27 N 0.00 0.00 0.00 3.52 0.00 -1.21 -4.79 118.16 115.68 2wrl n LYS 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2wrl n LYS 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2wrl n LYS 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2wrl n ARG 28 N 0.00 0.00 -0.12 1.64 1.74 -1.20 -0.77 116.66 117.95 2wrl n ARG 28 Ca 0.00 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.03 2wrl n ARG 28 Cb 0.00 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.46 2wrl n ARG 28 CO 0.00 0.00 0.00 -2.95 -1.52 0.00 0.00 177.63 173.16 2wrl h ASN 29 N 0.00 -0.50 -3.35 0.55 7.08 -1.82 -3.22 115.58 114.32 2wrl h ASN 29 Ca 0.00 0.14 -0.54 0.00 -3.08 0.00 0.00 56.30 52.82 2wrl h ASN 29 Cb 0.00 0.30 0.21 0.00 -2.08 0.00 0.00 38.32 36.75 2wrl h ASN 29 CO 0.00 -0.18 -0.53 1.07 -2.08 0.00 0.00 177.43 175.71 2wrl n THR 30 N -5.34 0.51 -0.48 6.14 5.66 0.05 -4.07 114.28 116.74 2wrl n THR 30 Ca 0.02 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 2wrl n THR 30 Cb 0.25 -0.65 0.00 0.00 -1.55 0.00 0.00 70.33 68.38 2wrl n THR 30 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2wrl n PRO 31 N -1.41 0.00 -3.36 1.09 -0.02 -1.26 -4.72 135.00 125.32 2wrl n PRO 31 Ca 0.08 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.54 2wrl n PRO 31 Cb 0.53 -0.48 -0.04 0.00 -0.02 0.00 0.00 33.50 33.49 2wrl n PRO 31 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2wrl s ASN 32 N 0.09 -0.86 0.00 2.55 0.01 -1.22 -5.01 114.94 110.50 2wrl s ASN 32 Ca 0.00 0.91 0.00 0.00 -0.71 0.00 0.00 52.86 53.06 2wrl s ASN 32 Cb 0.00 1.88 0.00 0.00 0.41 0.00 0.00 41.25 43.54 2wrl s ASN 32 CO 0.00 -0.26 0.00 1.17 -1.51 0.00 0.00 177.10 176.50 2wrl n LYS 33 N 5.42 0.00 -4.29 -0.60 4.81 -1.26 -4.62 118.16 117.62 2wrl n LYS 33 Ca -0.05 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.09 2wrl n LYS 33 Cb 0.50 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.45 2wrl n LYS 33 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2wrl s LEU 34 N 0.00 2.87 0.50 3.14 1.43 -1.26 -5.00 118.68 120.36 2wrl s LEU 34 Ca 0.00 -0.46 -0.19 0.00 -1.03 0.00 0.00 54.13 52.45 2wrl s LEU 34 Cb 0.00 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.45 2wrl s LEU 34 CO 0.00 0.18 1.01 -0.70 0.23 0.00 0.00 176.35 177.08 2wrl s GLU 35 N -2.13 3.81 -0.30 1.70 2.56 -1.26 -4.90 118.70 118.18 2wrl s GLU 35 Ca 0.19 1.19 -0.14 0.00 0.00 0.00 0.00 54.97 56.21 2wrl s GLU 35 Cb -0.11 -2.11 0.18 0.00 2.00 0.00 0.00 34.13 34.10 2wrl s GLU 35 CO 0.12 -0.40 1.13 -1.17 -0.56 0.00 0.00 175.26 174.37 2wrl s LEU 36 N -3.77 -0.22 -0.17 2.70 2.96 -1.26 -2.25 118.68 116.66 2wrl s LEU 36 Ca 0.64 0.05 -0.11 0.00 -0.22 0.00 0.00 54.13 54.48 2wrl s LEU 36 Cb -0.13 1.15 0.06 0.00 0.50 0.00 0.00 46.19 47.76 2wrl s LEU 36 CO 0.25 -0.04 0.43 0.00 -1.32 0.00 0.00 176.35 175.67 2wrl s ARG 37 N 2.98 0.44 0.07 1.98 1.70 -1.10 -5.01 118.95 120.00 2wrl s ARG 37 Ca 0.23 0.77 -0.36 0.00 -0.47 0.00 0.00 55.73 55.90 2wrl s ARG 37 Cb -0.02 0.05 -0.18 0.00 -0.57 0.00 0.00 34.95 34.22 2wrl s ARG 37 CO -0.20 -0.14 1.04 1.17 -1.08 0.00 0.00 175.30 176.10 2wrl n LYS 38 N 3.94 0.37 -3.59 3.89 4.81 -1.19 -4.34 118.16 122.06 2wrl n LYS 38 Ca -0.21 0.13 -0.15 0.00 -0.87 0.00 0.00 58.31 57.21 2wrl n LYS 38 Cb 0.56 -1.57 -0.06 0.00 0.02 0.00 0.00 35.03 33.97 2wrl n LYS 38 CO 0.00 0.00 0.00 -0.47 1.17 0.00 0.00 177.40 178.10 2wrl s TYR 39 N -0.12 -0.45 -0.23 5.64 5.04 -1.23 -4.91 117.35 121.08 2wrl s TYR 39 Ca 0.83 0.65 -0.12 0.00 -2.44 0.00 0.00 57.07 55.99 2wrl s TYR 39 Cb -1.10 0.32 -0.05 0.00 0.35 0.00 0.00 41.96 41.48 2wrl s TYR 39 CO 0.54 -0.58 0.21 0.00 -1.34 0.00 0.00 175.55 174.39 2wrl s PRO 41 N 1.09 3.14 0.03 0.00 0.04 -1.18 -4.98 135.00 133.14 2wrl s PRO 41 Ca 0.10 -0.66 -0.05 0.00 0.04 0.00 0.00 61.00 60.43 2wrl s PRO 41 Cb -0.14 -2.59 -0.01 0.00 0.04 0.00 0.00 34.50 31.80 2wrl s PRO 41 CO 0.05 0.35 0.51 1.87 0.04 0.00 0.00 177.00 179.82 2wrl n TRP 42 N 3.12 -0.07 -1.54 0.56 -0.00 -1.26 -3.51 117.44 114.74 2wrl n TRP 42 Ca -0.18 0.20 -0.32 0.00 -0.00 0.00 0.00 57.50 57.20 2wrl n TRP 42 Cb 0.53 -0.33 -0.08 0.00 -0.00 0.00 0.00 31.31 31.42 2wrl n TRP 42 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2wrl n ARG 44 N 8.56 0.00 0.00 0.00 1.74 -1.23 -5.00 116.66 120.74 2wrl n ARG 44 Ca 0.48 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 2wrl n ARG 44 Cb 0.38 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.82 2wrl n ARG 44 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2wrl n LYS 45 N 1.81 1.19 -3.46 5.56 5.02 -1.26 -4.87 118.16 122.14 2wrl n LYS 45 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.95 2wrl n LYS 45 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 2wrl n LYS 45 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2wrl s HIS 46 N 4.11 3.57 0.00 2.13 3.76 -1.26 -3.10 115.29 124.49 2wrl s HIS 46 Ca 0.00 0.91 0.00 0.00 -0.15 0.00 0.00 55.06 55.82 2wrl s HIS 46 Cb 0.00 -2.26 0.00 0.00 1.11 0.00 0.00 32.58 31.43 2wrl s HIS 46 CO 0.00 0.44 0.00 -2.37 -0.85 0.00 0.00 174.74 171.96 2wrl n THR 47 N 0.70 0.00 0.00 1.30 5.66 0.23 -4.93 114.28 117.24 2wrl n THR 47 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2wrl n THR 47 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 2wrl n THR 47 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 2wrl n VAL 48 N 0.00 0.00 -0.34 1.08 0.24 -1.26 -3.66 118.33 114.39 2wrl n VAL 48 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2wrl n VAL 48 Cb 0.00 -0.17 0.00 0.00 -1.47 0.00 0.00 33.84 32.20 2wrl n VAL 48 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2wrl n HIS 49 N -2.30 -0.94 -4.17 6.34 8.25 -1.15 -3.15 115.22 118.11 2wrl n HIS 49 Ca 0.00 0.51 -0.11 0.00 -0.26 0.00 0.00 57.72 57.86 2wrl n HIS 49 Cb 0.00 -1.27 -0.10 0.00 1.12 0.00 0.00 29.99 29.74 2wrl n HIS 49 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2wrl s ARG 50 N -4.59 1.07 1.25 -0.41 1.70 -1.19 -2.73 118.95 114.05 2wrl s ARG 50 Ca 0.00 -1.52 -0.21 0.00 -0.47 0.00 0.00 55.73 53.53 2wrl s ARG 50 Cb 0.00 0.26 0.31 0.00 -0.57 0.00 0.00 34.95 34.95 2wrl s ARG 50 CO 0.00 -0.33 1.10 -2.00 -1.08 0.00 0.00 175.30 173.00 2wrl s GLU 51 N -4.10 -1.63 0.00 3.89 2.12 -0.96 -2.39 118.70 115.64 2wrl s GLU 51 Ca 0.31 -0.17 0.00 0.00 0.36 0.00 0.00 54.97 55.46 2wrl s GLU 51 Cb 0.07 -1.56 0.00 0.00 0.26 0.00 0.00 34.13 32.90 2wrl s GLU 51 CO 0.07 -3.96 0.00 1.55 -0.54 0.00 0.00 175.26 172.38 2wrl n VAL 52 N -4.91 0.00 -1.71 3.70 3.14 -0.87 -4.75 118.33 112.92 2wrl n VAL 52 Ca 0.15 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.53 2wrl n VAL 52 Cb 0.60 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.38 2wrl n VAL 52 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2wrl n LYS 53 N -1.01 0.00 0.00 1.45 3.00 -1.26 -3.04 118.16 117.30 2wrl n LYS 53 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.37 2wrl n LYS 53 Cb 0.00 0.00 0.37 0.00 0.00 0.00 0.00 35.03 35.40 2wrl n LYS 53 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.40 177.84