#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p00 s LYS 2 N 0.00 0.51 -0.00 -1.24 2.47 -0.52 -4.72 119.74 116.24 1p00 s LYS 2 Ca 0.00 0.48 -0.30 0.00 -1.56 0.00 0.00 55.97 54.59 1p00 s LYS 2 Cb 0.00 0.10 -0.05 0.00 -1.46 0.00 0.00 37.83 36.41 1p00 s LYS 2 CO 0.00 -0.99 1.39 -1.17 0.16 0.00 0.00 175.35 174.75 1p00 s LEU 3 N 2.74 4.31 0.00 5.43 2.96 -1.26 0.04 118.68 132.91 1p00 s LEU 3 Ca 0.11 2.10 0.00 0.00 -0.22 0.00 0.00 54.13 56.12 1p00 s LEU 3 Cb -0.11 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.02 1p00 s LEU 3 CO -0.26 -0.71 0.00 2.30 -1.32 0.00 0.00 176.35 176.36 1p00 n ILE 4 N 4.66 0.00 -0.71 6.68 -5.35 -0.88 -4.96 119.36 118.79 1p00 n ILE 4 Ca 0.13 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.37 1p00 n ILE 4 Cb 0.44 0.74 0.00 0.00 -1.74 0.00 0.00 39.64 39.08 1p00 n ILE 4 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1p00 n GLY 5 N 1.68 -0.75 2.87 3.28 0.00 -1.25 -4.98 105.19 106.04 1p00 n GLY 5 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 1p00 n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p00 s SER 6 N -4.00 0.31 -0.16 1.61 0.01 0.24 -1.46 113.70 110.25 1p00 s SER 6 Ca 0.00 -0.03 -0.02 0.00 1.31 0.00 0.00 55.95 57.20 1p00 s SER 6 Cb 0.00 -0.10 -0.01 0.00 0.21 0.00 0.00 66.02 66.12 1p00 s SER 6 CO 0.00 -0.03 2.56 0.00 0.41 0.00 0.00 173.24 176.19 1p00 s VAL 8 N -0.71 0.05 0.21 0.00 0.11 -1.26 -4.86 120.40 113.94 1p00 s VAL 8 Ca 0.35 0.04 -0.30 0.00 -2.93 0.00 0.00 61.98 59.15 1p00 s VAL 8 Cb 0.21 -0.10 -0.09 0.00 -1.53 0.00 0.00 36.38 34.87 1p00 s VAL 8 CO -0.04 0.06 1.40 0.86 -3.33 0.00 0.00 175.10 174.05 1p00 s TRP 9 N 0.41 3.12 0.00 1.54 -0.00 -1.26 -3.04 118.94 119.71 1p00 s TRP 9 Ca -0.04 1.05 0.00 0.00 -0.00 0.00 0.00 56.10 57.11 1p00 s TRP 9 Cb -0.06 -3.75 0.00 0.00 -0.00 0.00 0.00 33.47 29.67 1p00 s TRP 9 CO -0.01 -2.45 0.00 0.41 -0.00 0.00 0.00 176.95 174.90 1p00 n GLY 10 N 2.51 3.10 3.77 5.86 0.00 -1.26 -5.08 105.19 114.10 1p00 n GLY 10 Ca 0.08 -1.10 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 1p00 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p00 s ALA 11 N -0.10 3.38 0.00 4.61 0.00 -1.17 -4.85 121.76 123.62 1p00 s ALA 11 Ca 0.00 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1p00 s ALA 11 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1p00 s ALA 11 CO 0.00 -0.85 0.89 1.33 0.00 0.00 0.00 175.76 177.13 1p00 n VAL 12 N 0.35 0.89 -2.64 0.00 0.24 -1.26 -2.45 118.33 113.46 1p00 n VAL 12 Ca 0.02 -0.07 -0.03 0.00 -2.04 0.00 0.00 64.34 62.23 1p00 n VAL 12 Cb 0.42 -0.97 0.09 0.00 -1.47 0.00 0.00 33.84 31.91 1p00 n VAL 12 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1p00 n ASN 13 N 0.80 -1.24 -4.73 -1.34 0.23 -1.26 -5.05 115.26 102.67 1p00 n ASN 13 Ca 0.00 -1.98 -0.42 0.00 -0.53 0.00 0.00 54.58 51.66 1p00 n ASN 13 Cb 0.38 0.65 -0.03 0.00 -2.08 0.00 0.00 39.78 38.70 1p00 n ASN 13 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1p00 s TYR 14 N 0.11 3.05 -0.14 -2.53 5.04 -1.02 -0.59 117.35 121.27 1p00 s TYR 14 Ca 0.09 0.74 0.01 0.00 -2.44 0.00 0.00 57.07 55.48 1p00 s TYR 14 Cb 0.32 -3.90 0.02 0.00 0.35 0.00 0.00 41.96 38.74 1p00 s TYR 14 CO -0.09 -3.20 -0.17 0.95 -1.34 0.00 0.00 175.55 171.70 1p00 s THR 15 N 0.82 1.76 0.03 4.34 -4.23 -0.07 -4.90 115.64 113.39 1p00 s THR 15 Ca 0.67 -0.78 -0.18 0.00 -1.18 0.00 0.00 61.69 60.22 1p00 s THR 15 Cb -0.43 -1.60 -0.22 0.00 1.34 0.00 0.00 72.50 71.59 1p00 s THR 15 CO 0.35 0.49 1.16 0.77 -0.54 0.00 0.00 174.62 176.84 1p00 h SER 16 N 7.66 0.63 -2.75 3.99 4.64 -1.94 -3.39 113.55 122.37 1p00 h SER 16 Ca -0.36 -0.72 -0.60 0.00 -0.47 0.00 0.00 61.79 59.64 1p00 h SER 16 Cb 1.16 -0.19 -0.39 0.00 -0.31 0.00 0.00 62.40 62.67 1p00 h SER 16 CO 0.54 1.26 -0.82 0.20 -0.87 0.00 0.00 176.83 177.14 1p00 s ASN 17 N -6.82 2.78 0.23 4.97 -0.87 -1.26 -5.00 114.94 108.97 1p00 s ASN 17 Ca -0.12 -3.12 -0.13 0.00 -1.57 0.00 0.00 52.86 47.92 1p00 s ASN 17 Cb 0.05 -0.83 0.30 0.00 -0.02 0.00 0.00 41.25 40.75 1p00 s ASN 17 CO 0.84 -0.18 1.60 0.00 -2.57 0.00 0.00 177.10 176.79 1p00 h ARG 19 N -0.02 -0.06 -0.70 0.00 2.43 -1.88 -1.10 114.38 113.04 1p00 h ARG 19 Ca 0.36 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.50 1p00 h ARG 19 Cb 0.57 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 1p00 h ARG 19 CO -0.80 -0.04 0.29 0.00 -1.51 0.00 0.00 179.97 177.91 1p00 h ALA 20 N 0.97 0.91 -0.15 2.80 0.00 -1.53 -1.27 119.26 121.00 1p00 h ALA 20 Ca 0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1p00 h ALA 20 Cb 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1p00 h ALA 20 CO -0.09 0.52 0.09 0.93 0.00 0.00 0.00 179.25 180.70 1p00 h GLU 21 N 0.99 0.20 -0.43 0.00 4.39 -0.30 0.34 114.58 119.78 1p00 h GLU 21 Ca 0.23 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 1p00 h GLU 21 Cb 0.19 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1p00 h GLU 21 CO -0.02 0.17 0.18 0.00 -1.16 0.00 0.00 179.01 178.17 1p00 h LYS 23 N 0.55 0.88 -0.48 0.00 1.57 -1.00 0.15 116.57 118.24 1p00 h LYS 23 Ca 0.14 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1p00 h LYS 23 Cb 0.18 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1p00 h LYS 23 CO -0.01 0.75 0.24 -0.09 -0.57 0.00 0.00 179.45 179.77 1p00 h ARG 24 N 0.86 0.69 0.24 3.15 9.65 0.11 -3.18 114.38 125.91 1p00 h ARG 24 Ca 0.20 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.97 1p00 h ARG 24 Cb 0.23 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1p00 h ARG 24 CO -0.01 0.58 -0.12 0.00 2.80 0.00 0.00 179.97 183.22 1p00 h ARG 25 N 0.64 -0.31 0.00 0.20 3.08 -0.75 -3.47 114.38 113.76 1p00 h ARG 25 Ca 0.17 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1p00 h ARG 25 Cb 0.11 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1p00 h ARG 25 CO -0.02 0.04 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 1p00 n GLY 26 N -0.07 0.00 3.46 0.04 0.00 0.19 -5.11 105.19 103.70 1p00 n GLY 26 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 1p00 n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1p00 s TYR 27 N 0.00 2.26 0.20 1.61 1.51 0.28 -4.98 117.35 118.23 1p00 s TYR 27 Ca 0.00 -0.35 -0.10 0.00 -1.01 0.00 0.00 57.07 55.61 1p00 s TYR 27 Cb 0.00 -1.00 0.20 0.00 -0.11 0.00 0.00 41.96 41.05 1p00 s TYR 27 CO 0.00 0.67 1.83 0.87 -1.11 0.00 0.00 175.55 177.81 1p00 h LYS 28 N 2.43 0.74 0.00 -0.62 1.57 -1.74 -3.35 116.57 115.60 1p00 h LYS 28 Ca -0.41 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1p00 h LYS 28 Cb 1.25 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1p00 h LYS 28 CO 0.58 0.49 0.00 0.41 -0.57 0.00 0.00 179.45 180.36 1p00 n GLY 29 N -1.28 2.28 3.62 3.86 0.00 -1.21 -4.89 105.19 107.57 1p00 n GLY 29 Ca 0.07 -0.38 -0.04 0.00 0.00 0.00 0.00 46.02 45.68 1p00 n GLY 29 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p00 s GLY 30 N -0.01 -0.14 -0.27 -0.02 0.00 -1.26 -0.87 107.32 104.75 1p00 s GLY 30 Ca 0.00 2.13 -0.25 0.00 0.00 0.00 0.00 44.72 46.60 1p00 s GLY 30 CO 0.00 0.82 0.75 -2.38 0.00 0.00 0.00 173.10 172.29 1p00 s HIS 31 N -1.70 -0.76 -0.16 1.90 -3.43 -0.04 -4.05 115.29 107.04 1p00 s HIS 31 Ca 0.08 1.86 -0.20 0.00 -0.80 0.00 0.00 55.06 56.00 1p00 s HIS 31 Cb -0.01 0.28 -0.03 0.00 -1.43 0.00 0.00 32.58 31.39 1p00 s HIS 31 CO -0.05 -0.37 0.58 0.00 -2.00 0.00 0.00 174.74 172.90 1p00 n GLY 33 N 3.61 3.60 7.00 0.00 0.00 0.12 -4.79 105.19 114.74 1p00 n GLY 33 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1p00 n GLY 33 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p00 n SER 34 N 0.00 0.00 -4.66 1.61 2.88 -1.26 -1.66 113.62 110.53 1p00 n SER 34 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1p00 n SER 34 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1p00 n SER 34 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1p00 n PHE 35 N 8.36 2.43 -1.28 0.66 7.35 -1.26 -1.72 117.46 132.00 1p00 n PHE 35 Ca 0.00 -0.29 -0.12 0.00 -0.76 0.00 0.00 57.45 56.28 1p00 n PHE 35 Cb 0.00 -2.77 -0.05 0.00 0.35 0.00 0.00 39.48 37.01 1p00 n PHE 35 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1p00 n ALA 36 N 7.74 -0.18 -2.71 3.13 0.00 -1.26 -1.84 120.51 125.39 1p00 n ALA 36 Ca 0.22 0.19 -0.19 0.00 0.00 0.00 0.00 53.44 53.66 1p00 n ALA 36 Cb 0.39 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1p00 n ALA 36 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1p00 n ASN 37 N -0.62 -5.08 -0.08 0.00 3.02 -0.70 -4.86 115.26 106.94 1p00 n ASN 37 Ca -0.12 -0.08 -0.10 0.00 -0.03 0.00 0.00 54.58 54.25 1p00 n ASN 37 Cb 0.49 -4.21 -0.15 0.00 -0.61 0.00 0.00 39.78 35.30 1p00 n ASN 37 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1p00 n VAL 38 N -3.95 1.46 -1.94 2.41 0.24 -0.76 -3.71 118.33 112.07 1p00 n VAL 38 Ca -0.15 -0.82 -0.42 0.00 -2.04 0.00 0.00 64.34 60.91 1p00 n VAL 38 Cb 0.63 -0.70 -0.03 0.00 -1.47 0.00 0.00 33.84 32.27 1p00 n VAL 38 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1p00 s ASN 39 N -5.74 6.61 -0.34 -1.34 0.01 -0.66 0.10 114.94 113.58 1p00 s ASN 39 Ca -0.10 2.48 -0.18 0.00 -0.71 0.00 0.00 52.86 54.35 1p00 s ASN 39 Cb 0.07 -2.57 -0.01 0.00 0.41 0.00 0.00 41.25 39.16 1p00 s ASN 39 CO 0.81 -0.88 0.51 0.00 -1.51 0.00 0.00 177.10 176.04 1p00 s TRP 41 N 2.38 2.90 0.24 0.00 0.52 -0.07 -2.08 118.94 122.82 1p00 s TRP 41 Ca 0.19 -1.27 -0.30 0.00 0.02 0.00 0.00 56.10 54.74 1p00 s TRP 41 Cb -0.15 -2.03 -0.09 0.00 -1.15 0.00 0.00 33.47 30.05 1p00 s TRP 41 CO 0.13 -0.67 1.06 0.00 0.02 0.00 0.00 176.95 177.49 1p00 s GLU 43 N -1.04 4.09 0.00 0.00 0.41 -0.05 -1.43 118.70 120.68 1p00 s GLU 43 Ca 0.45 1.96 0.00 0.00 -0.41 0.00 0.00 54.97 56.97 1p00 s GLU 43 Cb -0.30 -3.96 0.00 0.00 -1.78 0.00 0.00 34.13 28.09 1p00 s GLU 43 CO 0.37 -0.94 0.23 0.25 -0.49 0.00 0.00 175.26 174.68