#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cwx n THR 2 N 0.00 4.54 -3.00 6.66 -2.24 -1.26 -4.76 114.28 114.23 1cwx n THR 2 Ca 0.00 -4.83 0.04 0.00 -2.27 0.00 0.00 64.05 56.99 1cwx n THR 2 Cb 0.00 -2.34 0.00 0.00 -2.10 0.00 0.00 70.33 65.89 1cwx n THR 2 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1cwx s ASN 3 N 0.80 -0.27 0.49 3.42 2.47 -1.26 -5.16 114.94 115.43 1cwx s ASN 3 Ca 0.38 -0.03 -0.19 0.00 0.42 0.00 0.00 52.86 53.44 1cwx s ASN 3 Cb 0.05 0.85 -0.09 0.00 -1.45 0.00 0.00 41.25 40.61 1cwx s ASN 3 CO 0.02 -0.04 1.00 -2.16 -3.72 0.00 0.00 177.10 172.20 1cwx s PRO 4 N 2.59 3.91 -0.44 0.43 0.04 -1.26 -5.03 135.00 135.24 1cwx s PRO 4 Ca 0.24 1.19 -0.13 0.00 0.04 0.00 0.00 61.00 62.34 1cwx s PRO 4 Cb 0.01 -2.12 0.06 0.00 0.04 0.00 0.00 34.50 32.49 1cwx s PRO 4 CO -0.20 -0.32 0.32 0.15 0.04 0.00 0.00 177.00 177.00 1cwx s LYS 5 N -3.46 2.85 -0.10 4.56 -0.14 -1.26 -5.05 119.74 117.14 1cwx s LYS 5 Ca 0.64 -1.32 -0.30 0.00 -1.36 0.00 0.00 55.97 53.63 1cwx s LYS 5 Cb -0.13 -3.97 -0.02 0.00 -1.68 0.00 0.00 37.83 32.04 1cwx s LYS 5 CO 0.22 -0.94 1.12 -1.25 -0.76 0.00 0.00 175.35 173.74 1cwx s PRO 6 N 1.57 4.36 -1.22 -1.68 0.04 -1.26 -4.96 135.00 131.85 1cwx s PRO 6 Ca 0.04 1.54 -0.17 0.00 0.04 0.00 0.00 61.00 62.45 1cwx s PRO 6 Cb -0.23 -3.58 0.11 0.00 0.04 0.00 0.00 34.50 30.84 1cwx s PRO 6 CO 0.06 -0.44 1.57 -0.65 0.04 0.00 0.00 177.00 177.57 1cwx s GLN 7 N 2.35 3.96 -0.29 4.56 -1.52 -1.26 -4.96 119.66 122.50 1cwx s GLN 7 Ca 0.52 -2.09 -0.15 0.00 -1.95 0.00 0.00 55.36 51.68 1cwx s GLN 7 Cb -0.21 -5.32 -0.03 0.00 -0.22 0.00 0.00 33.01 27.23 1cwx s GLN 7 CO 0.18 -2.06 0.39 0.50 -0.25 0.00 0.00 175.29 174.06 1cwx s ARG 8 N 3.31 3.90 0.00 2.91 3.52 -1.26 -4.88 118.95 126.45 1cwx s ARG 8 Ca 0.48 -0.05 0.00 0.00 -0.13 0.00 0.00 55.73 56.03 1cwx s ARG 8 Cb 0.01 -3.70 0.00 0.00 -1.56 0.00 0.00 34.95 29.70 1cwx s ARG 8 CO 0.02 -0.36 0.00 1.17 -0.81 0.00 0.00 175.30 175.33 1cwx n LYS 9 N 5.39 0.00 0.00 5.12 4.81 -1.26 -5.04 118.16 127.17 1cwx n LYS 9 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.36 1cwx n LYS 9 Cb 0.50 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.55 1cwx n LYS 9 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1cwx n THR 10 N 0.00 0.00 -1.74 3.15 -1.04 -1.26 -4.91 114.28 108.47 1cwx n THR 10 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1cwx n THR 10 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1cwx n THR 10 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1cwx n LYS 11 N 0.00 -4.83 -0.75 -2.82 4.81 -1.26 -4.88 118.16 108.44 1cwx n LYS 11 Ca 0.00 3.48 0.10 0.00 -0.87 0.00 0.00 58.31 61.02 1cwx n LYS 11 Cb 0.00 -3.80 -0.03 0.00 0.02 0.00 0.00 35.03 31.22 1cwx n LYS 11 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1cwx n ARG 12 N 0.69 -1.50 0.07 1.64 5.12 -1.26 -4.98 116.66 116.45 1cwx n ARG 12 Ca 0.00 0.99 0.00 0.00 -1.93 0.00 0.00 57.85 56.91 1cwx n ARG 12 Cb 0.00 -1.83 0.00 0.00 -1.16 0.00 0.00 32.46 29.47 1cwx n ARG 12 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1cwx n ASN 13 N -4.37 -0.85 -3.75 0.55 5.15 -1.26 -5.02 115.26 105.71 1cwx n ASN 13 Ca 0.01 0.27 -0.28 0.00 -0.60 0.00 0.00 54.58 53.98 1cwx n ASN 13 Cb 0.34 0.99 -0.11 0.00 -0.53 0.00 0.00 39.78 40.47 1cwx n ASN 13 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1cwx n THR 14 N -2.86 1.15 -3.86 -0.44 -1.04 -1.26 -5.03 114.28 100.93 1cwx n THR 14 Ca 0.00 -4.63 -0.35 0.00 -2.04 0.00 0.00 64.05 57.03 1cwx n THR 14 Cb 0.00 -2.08 -0.13 0.00 -1.82 0.00 0.00 70.33 66.30 1cwx n THR 14 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1cwx s ASN 15 N -1.29 5.07 0.92 8.00 2.47 -1.26 -5.09 114.94 123.75 1cwx s ASN 15 Ca 0.28 -1.92 -0.14 0.00 0.42 0.00 0.00 52.86 51.49 1cwx s ASN 15 Cb -0.00 -1.76 0.16 0.00 -1.45 0.00 0.00 41.25 38.20 1cwx s ASN 15 CO -0.16 -0.45 1.23 -0.13 -3.72 0.00 0.00 177.10 173.87 1cwx s ARG 16 N 1.10 0.99 0.00 0.43 0.52 -1.26 -4.76 118.95 115.97 1cwx s ARG 16 Ca 0.06 -0.11 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 1cwx s ARG 16 Cb -0.21 -1.86 0.00 0.00 0.52 0.00 0.00 34.95 33.40 1cwx s ARG 16 CO -0.05 -2.23 0.00 0.54 0.02 0.00 0.00 175.30 173.59 1cwx n ARG 17 N -3.70 0.00 0.17 3.54 5.12 -1.26 -4.85 116.66 115.68 1cwx n ARG 17 Ca 0.11 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 56.09 1cwx n ARG 17 Cb 0.60 0.00 0.15 0.00 -1.16 0.00 0.00 32.46 32.05 1cwx n ARG 17 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1cwx h PRO 18 N 0.00 0.00 -1.55 5.56 0.13 -2.00 -3.14 132.00 131.00 1cwx h PRO 18 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.80 1cwx h PRO 18 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 1cwx h PRO 18 CO 0.00 0.38 0.41 1.04 -0.23 0.00 0.00 178.00 179.60 1cwx n GLN 19 N -3.26 1.84 0.00 0.86 6.02 -1.26 -3.60 117.38 117.97 1cwx n GLN 19 Ca 0.02 -1.60 0.00 0.00 -0.01 0.00 0.00 57.00 55.41 1cwx n GLN 19 Cb 0.63 -1.64 0.00 0.00 1.02 0.00 0.00 30.24 30.25 1cwx n GLN 19 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1cwx n ASP 20 N 0.39 0.00 0.00 1.08 2.03 -1.22 -4.72 116.55 114.11 1cwx n ASP 20 Ca 0.31 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.73 1cwx n ASP 20 Cb 0.58 0.11 0.66 0.00 -0.72 0.00 0.00 41.12 41.74 1cwx n ASP 20 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1cwx n VAL 21 N -1.81 0.00 0.18 5.18 0.31 -1.19 -1.40 118.33 119.61 1cwx n VAL 21 Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.44 1cwx n VAL 21 Cb 0.00 -0.47 0.21 0.00 -0.91 0.00 0.00 33.84 32.67 1cwx n VAL 21 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1cwx n LYS 22 N -0.90 2.44 -3.67 5.55 2.85 -1.24 -4.24 118.16 118.95 1cwx n LYS 22 Ca 0.17 -2.24 -0.23 0.00 -1.05 0.00 0.00 58.31 54.95 1cwx n LYS 22 Cb 0.08 -1.48 0.01 0.00 -0.65 0.00 0.00 35.03 32.98 1cwx n LYS 22 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1cwx n PHE 23 N 1.37 -2.14 -1.15 5.58 3.01 -0.49 0.93 117.46 124.57 1cwx n PHE 23 Ca 0.18 0.78 -0.11 0.00 1.01 0.00 0.00 57.45 59.31 1cwx n PHE 23 Cb 0.57 -3.09 0.08 0.00 -0.01 0.00 0.00 39.48 37.03 1cwx n PHE 23 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1cwx n PRO 24 N -2.87 -0.85 -2.27 -1.08 -0.04 -1.26 -1.30 135.00 125.32 1cwx n PRO 24 Ca -0.22 -0.71 -0.15 0.00 -0.04 0.00 0.00 63.50 62.39 1cwx n PRO 24 Cb 0.63 -0.52 -0.01 0.00 -0.04 0.00 0.00 33.50 33.56 1cwx n PRO 24 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cwx n GLY 25 N 1.27 -0.22 0.00 0.55 0.00 -1.26 -4.40 105.19 101.13 1cwx n GLY 25 Ca 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1cwx n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cwx n GLY 26 N -1.02 -0.80 0.00 -0.02 0.00 -1.26 -5.05 105.19 97.05 1cwx n GLY 26 Ca -0.17 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1cwx n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cwx n GLY 27 N 0.00 0.43 0.34 -0.02 0.00 -1.21 -5.06 105.19 99.67 1cwx n GLY 27 Ca 0.00 -0.62 0.02 0.00 0.00 0.00 0.00 46.02 45.42 1cwx n GLY 27 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1cwx n GLN 28 N 0.00 0.38 0.05 1.61 6.02 -0.42 -4.81 117.38 120.20 1cwx n GLN 28 Ca 0.00 -1.30 0.20 0.00 -0.01 0.00 0.00 57.00 55.88 1cwx n GLN 28 Cb 0.00 -0.73 0.72 0.00 1.02 0.00 0.00 30.24 31.25 1cwx n GLN 28 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 1cwx h ILE 29 N 4.83 0.65 -0.15 5.09 -0.00 0.54 0.22 117.51 128.68 1cwx h ILE 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 1cwx h ILE 29 Cb 1.24 0.74 0.00 0.00 -0.00 0.00 0.00 36.82 38.80 1cwx h ILE 29 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 178.15 178.67 1cwx n VAL 30 N -4.20 0.48 0.00 2.19 0.31 -1.26 -3.61 118.33 112.24 1cwx n VAL 30 Ca 0.08 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1cwx n VAL 30 Cb 0.56 -0.23 0.00 0.00 -0.91 0.00 0.00 33.84 33.27 1cwx n VAL 30 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1cwx n GLY 31 N 0.39 0.00 0.21 2.92 0.00 0.65 -4.76 105.19 104.61 1cwx n GLY 31 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.20 1cwx n GLY 31 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1cwx h GLY 32 N 0.00 0.00 2.00 -0.02 0.00 -1.37 0.21 103.07 103.89 1cwx h GLY 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1cwx h GLY 32 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.92 1cwx n VAL 33 N -3.07 0.64 0.31 4.60 0.31 -1.24 -0.94 118.33 118.94 1cwx n VAL 33 Ca 0.04 0.12 0.09 0.00 -0.01 0.00 0.00 64.34 64.58 1cwx n VAL 33 Cb 0.53 -0.83 -0.12 0.00 -0.91 0.00 0.00 33.84 32.50 1cwx n VAL 33 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1cwx n TYR 34 N -1.69 0.00 1.17 3.52 4.02 -0.47 -3.93 117.16 119.79 1cwx n TYR 34 Ca 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.04 1cwx n TYR 34 Cb 0.26 -0.25 0.36 0.00 -0.02 0.00 0.00 39.34 39.69 1cwx n TYR 34 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1cwx n LEU 35 N -1.85 1.79 -0.00 7.72 4.77 0.62 -3.98 117.00 126.07 1cwx n LEU 35 Ca -0.01 -0.74 -0.17 0.00 -0.03 0.00 0.00 56.01 55.06 1cwx n LEU 35 Cb 0.39 -0.11 -0.12 0.00 -2.33 0.00 0.00 43.42 41.25 1cwx n LEU 35 CO 0.37 0.37 0.26 -0.07 -1.33 0.00 0.00 177.39 176.99 1cwx h LEU 36 N 2.38 0.40 0.04 2.23 3.38 -1.48 -1.96 115.31 120.31 1cwx h LEU 36 Ca 0.00 -0.81 -0.00 0.00 0.09 0.00 0.00 57.88 57.16 1cwx h LEU 36 Cb 0.52 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1cwx h LEU 36 CO 0.00 1.17 -0.02 1.55 0.09 0.00 0.00 178.44 181.23 1cwx h PRO 37 N -0.31 -0.05 -0.90 1.13 0.13 -1.82 -3.29 132.00 126.88 1cwx h PRO 37 Ca -0.07 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.99 1cwx h PRO 37 Cb 1.27 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.37 1cwx h PRO 37 CO 0.10 0.47 0.09 2.89 -0.23 0.00 0.00 178.00 181.32 1cwx n ARG 38 N -4.74 2.12 -1.53 0.86 1.85 -1.26 -4.88 116.66 109.08 1cwx n ARG 38 Ca -0.06 -1.16 -0.30 0.00 -1.00 0.00 0.00 57.85 55.32 1cwx n ARG 38 Cb 0.27 -1.67 -0.11 0.00 -1.05 0.00 0.00 32.46 29.90 1cwx n ARG 38 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 1cwx n ARG 39 N 0.11 0.43 -3.09 2.89 0.00 -0.74 -3.38 116.66 112.89 1cwx n ARG 39 Ca 0.15 -0.17 -0.00 0.00 -0.00 0.00 0.00 57.85 57.82 1cwx n ARG 39 Cb 0.72 -2.44 0.00 0.00 0.00 0.00 0.00 32.46 30.74 1cwx n ARG 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1cwx n GLY 40 N 6.22 -0.99 3.88 5.14 0.00 -1.26 -4.95 105.19 113.22 1cwx n GLY 40 Ca 0.54 0.12 -0.30 0.00 0.00 0.00 0.00 46.02 46.38 1cwx n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1cwx s PRO 41 N -1.17 0.11 0.00 1.61 0.04 -1.22 -4.99 135.00 129.38 1cwx s PRO 41 Ca 0.00 -0.44 0.20 0.00 0.04 0.00 0.00 61.00 60.80 1cwx s PRO 41 Cb -0.00 -1.79 0.31 0.00 0.04 0.00 0.00 34.50 33.06 1cwx s PRO 41 CO 0.19 -2.77 1.26 -2.13 0.04 0.00 0.00 177.00 173.59 1cwx n ARG 42 N -4.01 2.15 -2.88 4.56 0.63 -1.26 -4.52 116.66 111.34 1cwx n ARG 42 Ca 0.16 -1.99 -0.26 0.00 -0.92 0.00 0.00 57.85 54.84 1cwx n ARG 42 Cb 0.59 -1.42 -0.03 0.00 0.45 0.00 0.00 32.46 32.05 1cwx n ARG 42 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1cwx n LEU 43 N 1.20 4.14 0.00 6.15 4.77 -1.26 -5.34 117.00 126.66 1cwx n LEU 43 Ca 0.15 -5.50 0.00 0.00 -0.03 0.00 0.00 56.01 50.63 1cwx n LEU 43 Cb 0.52 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1cwx n LEU 43 CO 0.13 2.31 0.00 0.61 -1.33 0.00 0.00 177.39 179.12