#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 -0.15 -0.49 0.00 -1.04 -1.23 -4.73 114.28 106.64 2nz3 n THR 2 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 2nz3 n THR 2 Cb 0.00 -1.31 -0.02 0.00 -1.82 0.00 0.00 70.33 67.18 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 1.72 0.00 -3.64 0.00 8.00 -1.26 -5.11 116.55 116.26 2nz3 n ASP 4 Ca 0.05 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.48 2nz3 n ASP 4 Cb 0.48 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.51 2nz3 n ASP 4 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2nz3 s LEU 5 N -4.83 -0.35 -0.02 0.64 0.20 -1.25 -5.06 118.68 108.01 2nz3 s LEU 5 Ca 0.00 0.67 0.17 0.00 0.69 0.00 0.00 54.13 55.65 2nz3 s LEU 5 Cb 0.00 1.67 0.29 0.00 -0.43 0.00 0.00 46.19 47.72 2nz3 s LEU 5 CO 0.00 -0.11 1.12 0.00 -0.29 0.00 0.00 176.35 177.06 2nz3 n ALA 6 N 2.13 2.86 -0.60 5.97 0.00 -1.26 -4.95 120.51 124.65 2nz3 n ALA 6 Ca -0.12 -1.78 0.00 0.00 0.00 0.00 0.00 53.44 51.54 2nz3 n ALA 6 Cb 0.56 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.40 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 0.25 0.00 0.14 0.00 2.88 -1.26 -2.00 113.62 113.63 2nz3 n SER 7 Ca -0.06 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.50 2nz3 n SER 7 Cb 0.98 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 64.80 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 1.22 -0.58 2.46 3.07 -2.07 -2.82 117.51 118.78 2nz3 h ILE 8 Ca 0.00 -1.02 -0.34 0.00 1.55 0.00 0.00 64.86 65.05 2nz3 h ILE 8 Cb 0.00 1.42 -0.17 0.00 -0.27 0.00 0.00 36.82 37.80 2nz3 h ILE 8 CO 0.00 0.31 0.43 2.22 -1.05 0.00 0.00 178.15 180.06 2nz3 n PHE 9 N -4.19 1.82 -0.04 0.16 1.16 -0.84 -4.45 117.46 111.08 2nz3 n PHE 9 Ca -0.01 -1.62 0.12 0.00 -1.87 0.00 0.00 57.45 54.07 2nz3 n PHE 9 Cb 0.34 -0.81 0.54 0.00 -1.61 0.00 0.00 39.48 37.94 2nz3 n PHE 9 CO 0.00 0.00 0.00 -0.97 -1.87 0.00 0.00 176.76 173.92 2nz3 h ASN 10 N 0.96 0.28 0.00 5.98 -0.73 -1.23 -1.71 115.58 119.13 2nz3 h ASN 10 Ca 0.36 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.54 2nz3 h ASN 10 Cb 1.63 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 40.17 2nz3 h ASN 10 CO 0.75 0.17 0.13 1.33 -0.37 0.00 0.00 177.43 179.44 2nz3 n VAL 11 N -4.46 1.33 -0.51 2.57 0.24 -1.26 -3.49 118.33 112.74 2nz3 n VAL 11 Ca 0.08 0.58 -0.02 0.00 -2.04 0.00 0.00 64.34 62.94 2nz3 n VAL 11 Cb 0.36 -1.58 -0.03 0.00 -1.47 0.00 0.00 33.84 31.13 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 -1.63 4.48 0.00 -1.34 2.04 -0.65 -3.24 115.26 114.93 2nz3 n ASN 12 Ca -0.00 -2.21 0.00 0.00 -0.44 0.00 0.00 54.58 51.92 2nz3 n ASN 12 Cb 0.13 -1.00 0.00 0.00 -2.53 0.00 0.00 39.78 36.38 2nz3 n ASN 12 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2nz3 n HIS 13 N 1.79 -0.08 0.03 -2.53 1.44 -1.23 -4.54 115.22 110.09 2nz3 n HIS 13 Ca 0.07 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.66 2nz3 n HIS 13 Cb 0.49 0.03 -0.09 0.00 0.12 0.00 0.00 29.99 30.54 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 -0.07 -0.20 1.59 0.00 -1.80 -0.42 119.26 118.37 2nz3 h ALA 14 Ca 0.00 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 2nz3 h ALA 14 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2nz3 h ALA 14 CO 0.00 -0.35 -0.65 -0.07 0.00 0.00 0.00 179.25 178.17 2nz3 h LEU 15 N -0.44 0.84 0.55 0.00 -0.00 -1.91 -2.38 115.31 111.98 2nz3 h LEU 15 Ca -0.01 -0.50 -0.02 0.00 -0.00 0.00 0.00 57.88 57.36 2nz3 h LEU 15 Cb 0.39 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 40.79 2nz3 h LEU 15 CO 0.01 1.28 -0.43 0.00 -0.00 0.00 0.00 178.44 179.29 2nz3 h ALA 17 N -0.71 1.00 -0.82 0.00 0.00 -1.15 -2.58 119.26 115.00 2nz3 h ALA 17 Ca -0.06 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.77 2nz3 h ALA 17 Cb 0.82 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2nz3 h ALA 17 CO 0.00 0.54 0.49 0.00 0.00 0.00 0.00 179.25 180.28 2nz3 h ALA 18 N 1.21 1.12 -0.71 0.00 0.00 -1.22 0.60 119.26 120.26 2nz3 h ALA 18 Ca 0.27 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2nz3 h ALA 18 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2nz3 h ALA 18 CO -0.04 0.21 0.27 1.12 0.00 0.00 0.00 179.25 180.82 2nz3 h HIS 19 N 0.90 1.07 0.17 0.00 -0.00 -0.66 0.06 115.15 116.69 2nz3 h HIS 19 Ca 0.36 -0.08 -0.01 0.00 -0.00 0.00 0.00 60.37 60.65 2nz3 h HIS 19 Cb 0.19 -0.32 0.00 0.00 -0.00 0.00 0.00 27.41 27.28 2nz3 h HIS 19 CO -0.04 0.82 -0.08 0.00 -0.00 0.00 0.00 177.93 178.63 2nz3 h ILE 21 N -0.49 0.85 -0.79 0.00 2.04 -0.71 -0.09 117.51 118.32 2nz3 h ILE 21 Ca -0.02 -0.20 0.05 0.00 1.00 0.00 0.00 64.86 65.68 2nz3 h ILE 21 Cb 0.38 0.20 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 2nz3 h ILE 21 CO 0.04 0.11 0.52 0.00 0.00 0.00 0.00 178.15 178.81 2nz3 h ALA 22 N 1.62 1.57 -0.22 1.87 0.00 -0.76 0.55 119.26 123.89 2nz3 h ALA 22 Ca 0.39 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.19 2nz3 h ALA 22 Cb 0.69 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 2nz3 h ALA 22 CO -0.15 0.33 0.10 0.54 0.00 0.00 0.00 179.25 180.07 2nz3 n ARG 23 N -4.46 1.67 -1.72 0.00 1.74 -0.14 -4.79 116.66 108.95 2nz3 n ARG 23 Ca 0.11 -0.85 -0.16 0.00 -0.77 0.00 0.00 57.85 56.18 2nz3 n ARG 23 Cb 0.16 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.05 2nz3 n ARG 23 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2nz3 n ARG 24 N 0.10 -1.13 -3.26 5.56 1.74 0.18 -5.00 116.66 114.85 2nz3 n ARG 24 Ca 0.13 0.95 -0.20 0.00 -0.77 0.00 0.00 57.85 57.95 2nz3 n ARG 24 Cb 0.69 -5.18 0.00 0.00 -1.02 0.00 0.00 32.46 26.95 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 3.15 0.07 -1.55 1.51 -0.63 -4.97 117.35 112.29 2nz3 s TYR 25 Ca 0.00 -0.04 -0.17 0.00 -1.01 0.00 0.00 57.07 55.84 2nz3 s TYR 25 Cb 0.00 -2.14 -0.11 0.00 -0.11 0.00 0.00 41.96 39.60 2nz3 s TYR 25 CO 0.00 -0.17 1.38 0.00 -1.11 0.00 0.00 175.55 175.66 2nz3 h ARG 26 N 0.68 0.53 0.00 -0.62 3.08 -1.91 -3.19 114.38 112.96 2nz3 h ARG 26 Ca -0.46 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.31 2nz3 h ARG 26 Cb 1.26 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.32 2nz3 h ARG 26 CO 0.54 0.87 0.00 0.41 -1.07 0.00 0.00 179.97 180.72 2nz3 n GLY 27 N 0.18 0.43 3.52 0.04 0.00 -1.26 -4.60 105.19 103.50 2nz3 n GLY 27 Ca -0.05 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.53 0.12 -0.02 0.00 -1.26 0.33 107.32 105.95 2nz3 s GLY 28 Ca 0.00 2.11 -0.11 0.00 0.00 0.00 0.00 44.72 46.72 2nz3 s GLY 28 CO 0.00 2.14 0.45 -2.52 0.00 0.00 0.00 173.10 173.18 2nz3 s TYR 29 N 1.52 3.57 -0.12 1.90 1.13 -1.25 -0.57 117.35 123.53 2nz3 s TYR 29 Ca -0.10 0.86 -0.30 0.00 -1.41 0.00 0.00 57.07 56.13 2nz3 s TYR 29 Cb -0.06 -2.22 -0.02 0.00 -1.10 0.00 0.00 41.96 38.56 2nz3 s TYR 29 CO -0.17 0.47 1.28 0.00 -2.51 0.00 0.00 175.55 174.62 2nz3 n ASN 31 N 6.16 0.62 -0.06 0.00 6.94 -1.25 -4.87 115.26 122.80 2nz3 n ASN 31 Ca 0.13 -1.71 0.10 0.00 -0.02 0.00 0.00 54.58 53.09 2nz3 n ASN 31 Cb 0.45 -0.76 0.49 0.00 -2.36 0.00 0.00 39.78 37.60 2nz3 n ASN 31 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2nz3 h SER 32 N -1.09 0.38 -0.19 0.53 0.02 -1.95 -0.33 113.55 110.93 2nz3 h SER 32 Ca -0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2nz3 h SER 32 Cb 1.08 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2nz3 h SER 32 CO 0.29 0.24 0.00 0.29 -1.14 0.00 0.00 176.83 176.51 2nz3 n LYS 33 N -4.47 1.50 -3.66 3.45 4.76 -1.26 -4.92 118.16 113.56 2nz3 n LYS 33 Ca 0.08 -0.78 -0.22 0.00 -2.87 0.00 0.00 58.31 54.52 2nz3 n LYS 33 Cb 0.31 -1.23 0.05 0.00 -1.84 0.00 0.00 35.03 32.32 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 0.09 -1.75 -2.65 7.82 0.00 -0.13 -5.00 120.51 118.88 2nz3 n ALA 34 Ca 0.10 0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.26 2nz3 n ALA 34 Cb 0.20 -3.16 -0.09 0.00 0.00 0.00 0.00 19.45 16.40 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 -3.46 3.82 -1.13 0.00 1.01 -1.26 -3.88 120.40 115.50 2nz3 s VAL 35 Ca 0.23 -0.99 -0.22 0.00 0.00 0.00 0.00 61.98 61.00 2nz3 s VAL 35 Cb -0.11 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 2nz3 s VAL 35 CO 0.78 0.18 1.82 0.00 0.00 0.00 0.00 175.10 177.88 2nz3 n VAL 37 N 7.35 3.73 -1.84 0.00 0.31 -1.24 -4.93 118.33 121.71 2nz3 n VAL 37 Ca 0.43 -2.16 -0.41 0.00 -0.01 0.00 0.00 64.34 62.20 2nz3 n VAL 37 Cb 0.47 -2.40 -0.01 0.00 -0.91 0.00 0.00 33.84 30.99 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 3.34 -0.66 0.00 0.00 2.47 -0.49 -3.47 114.38 115.57 2nz3 h ARG 39 Ca -0.50 0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.26 2nz3 h ARG 39 Cb 1.23 0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.70 2nz3 h ARG 39 CO 0.67 -0.37 0.00 -1.71 0.56 0.00 0.00 179.97 179.12