#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nz3 n THR 2 N 0.00 -0.11 -1.68 0.00 -1.04 -1.26 -4.88 114.28 105.31 2nz3 n THR 2 Ca 0.00 0.00 -0.47 0.00 -2.04 0.00 0.00 64.05 61.54 2nz3 n THR 2 Cb 0.00 -2.09 -0.04 0.00 -1.82 0.00 0.00 70.33 66.37 2nz3 n THR 2 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nz3 n ASP 4 N 5.96 -4.85 -2.91 0.00 -0.08 -1.26 -4.50 116.55 108.91 2nz3 n ASP 4 Ca 0.21 1.61 -0.09 0.00 -1.51 0.00 0.00 54.79 55.01 2nz3 n ASP 4 Cb 0.31 -5.24 0.05 0.00 2.34 0.00 0.00 41.12 38.59 2nz3 n ASP 4 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2nz3 n LEU 5 N 1.80 0.00 0.00 -2.67 -0.00 -1.26 -4.71 117.00 110.16 2nz3 n LEU 5 Ca -0.22 -0.75 0.00 0.00 -0.00 0.00 0.00 56.01 55.04 2nz3 n LEU 5 Cb 0.34 -0.29 0.00 0.00 -0.00 0.00 0.00 43.42 43.47 2nz3 n LEU 5 CO 0.21 -0.73 0.00 0.00 -0.00 0.00 0.00 177.39 176.86 2nz3 n ALA 6 N -3.06 0.00 0.00 1.47 0.00 -1.26 -4.97 120.51 112.69 2nz3 n ALA 6 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2nz3 n ALA 6 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2nz3 n ALA 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2nz3 n SER 7 N -0.66 0.00 -0.14 0.00 2.88 -1.26 -4.96 113.62 109.49 2nz3 n SER 7 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 2nz3 n SER 7 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 2nz3 n SER 7 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 2nz3 h ILE 8 N 0.00 1.28 -1.59 2.46 3.07 -2.06 -3.08 117.51 117.59 2nz3 h ILE 8 Ca 0.00 -1.24 -0.66 0.00 1.55 0.00 0.00 64.86 64.51 2nz3 h ILE 8 Cb 0.00 1.25 -0.23 0.00 -0.27 0.00 0.00 36.82 37.57 2nz3 h ILE 8 CO 0.00 0.42 0.81 2.22 -1.05 0.00 0.00 178.15 180.54 2nz3 n PHE 9 N -4.30 2.37 0.37 0.16 1.16 -1.26 -4.60 117.46 111.37 2nz3 n PHE 9 Ca -0.01 -2.17 0.11 0.00 -1.87 0.00 0.00 57.45 53.51 2nz3 n PHE 9 Cb 0.39 -1.28 0.48 0.00 -1.61 0.00 0.00 39.48 37.45 2nz3 n PHE 9 CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 2nz3 n ASN 10 N 0.12 0.58 -0.05 5.98 2.85 -1.17 -3.33 115.26 120.25 2nz3 n ASN 10 Ca 0.52 0.66 0.00 0.00 -0.11 0.00 0.00 54.58 55.65 2nz3 n ASN 10 Cb 0.37 -0.78 0.00 0.00 1.24 0.00 0.00 39.78 40.61 2nz3 n ASN 10 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2nz3 n VAL 11 N -2.16 0.00 -0.87 3.44 0.24 -1.26 -4.22 118.33 113.50 2nz3 n VAL 11 Ca 0.02 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.20 2nz3 n VAL 11 Cb 0.20 -0.34 -0.14 0.00 -1.47 0.00 0.00 33.84 32.09 2nz3 n VAL 11 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2nz3 n ASN 12 N -0.42 4.64 0.00 -1.34 6.94 -1.21 -2.49 115.26 121.37 2nz3 n ASN 12 Ca 0.00 -2.34 0.00 0.00 -0.02 0.00 0.00 54.58 52.22 2nz3 n ASN 12 Cb 0.01 -1.22 0.00 0.00 -2.36 0.00 0.00 39.78 36.21 2nz3 n ASN 12 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2nz3 n HIS 13 N 2.65 0.00 0.08 -2.53 1.44 -1.26 -4.79 115.22 110.81 2nz3 n HIS 13 Ca 0.38 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.97 2nz3 n HIS 13 Cb 0.75 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.79 2nz3 n HIS 13 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2nz3 h ALA 14 N 0.00 0.33 0.19 1.59 0.00 -1.76 -3.11 119.26 116.51 2nz3 h ALA 14 Ca 0.00 -0.77 -0.01 0.00 0.00 0.00 0.00 54.91 54.13 2nz3 h ALA 14 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2nz3 h ALA 14 CO 0.00 0.91 -0.09 1.25 0.00 0.00 0.00 179.25 181.32 2nz3 h LEU 15 N 0.14 -0.22 -0.34 0.00 6.46 -1.86 -0.50 115.31 118.98 2nz3 h LEU 15 Ca -0.08 -0.16 0.04 0.00 -0.12 0.00 0.00 57.88 57.56 2nz3 h LEU 15 Cb 1.68 0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 41.63 2nz3 h LEU 15 CO 0.16 0.04 0.10 0.00 -0.62 0.00 0.00 178.44 178.13 2nz3 h ALA 17 N 1.23 0.95 -0.74 0.00 0.00 -1.52 -2.28 119.26 116.90 2nz3 h ALA 17 Ca 0.16 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2nz3 h ALA 17 Cb 0.15 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2nz3 h ALA 17 CO -0.18 0.32 0.45 0.00 0.00 0.00 0.00 179.25 179.85 2nz3 h ALA 18 N 1.29 0.98 -0.56 0.00 0.00 -0.39 0.16 119.26 120.74 2nz3 h ALA 18 Ca 0.28 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.21 2nz3 h ALA 18 Cb -0.07 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 2nz3 h ALA 18 CO -0.08 0.21 0.33 1.25 0.00 0.00 0.00 179.25 180.96 2nz3 h HIS 19 N 0.86 0.62 -0.12 0.00 6.17 -0.74 -0.93 115.15 121.01 2nz3 h HIS 19 Ca 0.31 0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.39 2nz3 h HIS 19 Cb 0.08 -0.20 -0.00 0.00 2.52 0.00 0.00 27.41 29.81 2nz3 h HIS 19 CO -0.05 0.34 0.02 0.00 0.71 0.00 0.00 177.93 178.96 2nz3 h ILE 21 N -0.02 0.74 -0.73 0.00 2.04 -0.28 0.18 117.51 119.43 2nz3 h ILE 21 Ca 0.04 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.64 2nz3 h ILE 21 Cb 0.29 -0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.21 2nz3 h ILE 21 CO 0.00 0.14 0.49 0.00 0.00 0.00 0.00 178.15 178.78 2nz3 h ALA 22 N 1.63 1.48 -0.24 1.87 0.00 -0.95 -0.96 119.26 122.09 2nz3 h ALA 22 Ca 0.56 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.36 2nz3 h ALA 22 Cb 0.85 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2nz3 h ALA 22 CO -0.36 0.48 0.08 0.54 0.00 0.00 0.00 179.25 179.99 2nz3 n ARG 23 N -4.42 2.00 -2.01 0.00 5.12 0.43 -4.81 116.66 112.96 2nz3 n ARG 23 Ca 0.08 -1.04 -0.14 0.00 -1.93 0.00 0.00 57.85 54.83 2nz3 n ARG 23 Cb 0.03 -1.63 -0.02 0.00 -1.16 0.00 0.00 32.46 29.68 2nz3 n ARG 23 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2nz3 n ARG 24 N 0.12 -1.06 -4.04 5.56 1.74 -0.36 -5.01 116.66 113.60 2nz3 n ARG 24 Ca 0.13 0.76 -0.22 0.00 -0.77 0.00 0.00 57.85 57.75 2nz3 n ARG 24 Cb 0.68 -4.98 -0.03 0.00 -1.02 0.00 0.00 32.46 27.11 2nz3 n ARG 24 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2nz3 s TYR 25 N -2.64 3.27 0.16 -1.55 1.51 -0.01 -4.97 117.35 113.13 2nz3 s TYR 25 Ca 0.00 -0.05 -0.10 0.00 -1.01 0.00 0.00 57.07 55.90 2nz3 s TYR 25 Cb 0.00 -1.49 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 2nz3 s TYR 25 CO 0.00 0.49 1.55 -0.09 -1.11 0.00 0.00 175.55 176.39 2nz3 h ARG 26 N 1.47 0.99 0.00 -0.62 9.65 -1.91 -3.01 114.38 120.95 2nz3 h ARG 26 Ca -0.50 -0.42 0.00 0.00 -1.10 0.00 0.00 59.98 57.96 2nz3 h ARG 26 Cb 1.23 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2nz3 h ARG 26 CO 0.62 1.09 0.00 0.41 2.80 0.00 0.00 179.97 184.89 2nz3 n GLY 27 N -0.12 0.54 3.12 2.80 0.00 -1.26 -4.60 105.19 105.67 2nz3 n GLY 27 Ca 0.00 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 2nz3 n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nz3 s GLY 28 N 0.00 0.59 0.01 -0.02 0.00 -1.26 -1.83 107.32 104.81 2nz3 s GLY 28 Ca 0.00 -1.25 0.01 0.00 0.00 0.00 0.00 44.72 43.48 2nz3 s GLY 28 CO 0.00 -1.36 -0.05 -2.52 0.00 0.00 0.00 173.10 169.17 2nz3 s TYR 29 N -3.72 0.44 -0.16 1.90 -0.85 -1.17 -4.88 117.35 108.91 2nz3 s TYR 29 Ca 0.08 -0.24 -0.29 0.00 -0.52 0.00 0.00 57.07 56.10 2nz3 s TYR 29 Cb 0.06 -0.28 -0.01 0.00 0.38 0.00 0.00 41.96 42.12 2nz3 s TYR 29 CO -0.08 -0.05 1.08 0.00 -1.52 0.00 0.00 175.55 174.99 2nz3 n ASN 31 N 5.79 0.00 -0.07 0.00 6.94 -0.98 -4.73 115.26 122.21 2nz3 n ASN 31 Ca 0.11 0.00 -0.01 0.00 -0.02 0.00 0.00 54.58 54.66 2nz3 n ASN 31 Cb 0.47 0.00 0.26 0.00 -2.36 0.00 0.00 39.78 38.15 2nz3 n ASN 31 CO 0.00 0.00 0.00 -1.28 -1.03 0.00 0.00 177.26 174.95 2nz3 h SER 32 N 0.00 0.64 -0.29 0.53 0.87 -1.96 -1.46 113.55 111.87 2nz3 h SER 32 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2nz3 h SER 32 Cb 0.00 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.80 2nz3 h SER 32 CO 0.00 0.63 0.00 0.29 -0.53 0.00 0.00 176.83 177.22 2nz3 n LYS 33 N -4.31 2.14 -2.09 2.24 4.76 -1.26 -4.88 118.16 114.77 2nz3 n LYS 33 Ca 0.03 -1.25 -0.18 0.00 -2.87 0.00 0.00 58.31 54.04 2nz3 n LYS 33 Cb 0.20 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.87 2nz3 n LYS 33 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2nz3 n ALA 34 N 0.37 -0.53 -2.10 7.82 0.00 -0.55 -4.96 120.51 120.57 2nz3 n ALA 34 Ca 0.11 0.20 -0.39 0.00 0.00 0.00 0.00 53.44 53.36 2nz3 n ALA 34 Cb 0.44 -1.91 -0.06 0.00 0.00 0.00 0.00 19.45 17.91 2nz3 n ALA 34 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2nz3 s VAL 35 N -2.77 4.52 -1.05 0.00 1.01 -1.26 -4.38 120.40 116.47 2nz3 s VAL 35 Ca 0.00 1.51 -0.23 0.00 0.00 0.00 0.00 61.98 63.26 2nz3 s VAL 35 Cb 0.00 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 2nz3 s VAL 35 CO 0.00 0.54 1.90 0.00 0.00 0.00 0.00 175.10 177.54 2nz3 n VAL 37 N 7.71 3.45 -2.41 0.00 0.31 -0.06 -4.79 118.33 122.55 2nz3 n VAL 37 Ca 0.42 -3.47 -0.41 0.00 -0.01 0.00 0.00 64.34 60.87 2nz3 n VAL 37 Cb 0.47 -2.37 -0.03 0.00 -0.91 0.00 0.00 33.84 31.00 2nz3 n VAL 37 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2nz3 h ARG 39 N 5.86 -0.77 0.00 0.00 3.08 -1.73 -3.48 114.38 117.34 2nz3 h ARG 39 Ca -0.43 0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.67 2nz3 h ARG 39 Cb 1.21 0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.44 2nz3 h ARG 39 CO 0.77 -0.50 0.00 -1.71 -1.07 0.00 0.00 179.97 177.46