#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r33 h ASP 20 N 6.97 0.00 -3.34 0.00 3.32 -1.91 -3.11 116.42 118.35 2r33 h ASP 20 Ca -0.34 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.11 2r33 h ASP 20 Cb 1.20 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.35 2r33 h ASP 20 CO 0.25 0.97 -0.75 -0.44 -1.72 0.00 0.00 179.24 177.55 2r33 s SER 21 N -6.17 4.07 -0.23 6.45 0.01 -1.26 -4.96 113.70 111.62 2r33 s SER 21 Ca -0.04 -1.62 -0.03 0.00 1.31 0.00 0.00 55.95 55.58 2r33 s SER 21 Cb 0.08 -1.05 0.00 0.00 0.21 0.00 0.00 66.02 65.27 2r33 s SER 21 CO 0.82 -0.37 -0.06 0.00 0.41 0.00 0.00 173.24 174.04 2r33 s VAL 23 N 1.43 3.94 -0.03 0.00 1.01 -0.64 -4.93 120.40 121.18 2r33 s VAL 23 Ca 0.04 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.07 2r33 s VAL 23 Cb -0.15 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 2r33 s VAL 23 CO -0.04 -0.12 -0.10 0.00 0.00 0.00 0.00 175.10 174.84 2r33 s THR 25 N -0.85 4.42 -0.39 0.00 -4.23 0.91 -4.92 115.64 110.58 2r33 s THR 25 Ca 0.14 1.49 0.00 0.00 -1.18 0.00 0.00 61.69 62.14 2r33 s THR 25 Cb -0.11 -3.90 0.00 0.00 1.34 0.00 0.00 72.50 69.84 2r33 s THR 25 CO 0.03 0.14 0.47 2.29 -0.54 0.00 0.00 174.62 177.01 2r33 n LYS 26 N 0.54 0.58 -2.93 3.99 0.00 -1.26 -3.44 118.16 115.63 2r33 n LYS 26 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 58.31 58.13 2r33 n LYS 26 Cb 0.51 -1.24 0.03 0.00 -0.00 0.00 0.00 35.03 34.32 2r33 n LYS 26 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2r33 n SER 27 N 0.52 2.02 -3.87 -5.58 7.64 -1.26 -5.02 113.62 108.06 2r33 n SER 27 Ca 0.00 -2.34 -0.30 0.00 1.01 0.00 0.00 58.87 57.25 2r33 n SER 27 Cb 0.23 -0.18 -0.16 0.00 -1.01 0.00 0.00 64.21 63.10 2r33 n SER 27 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2r33 s ILE 28 N -1.96 1.22 0.44 0.44 1.01 -1.26 -2.72 121.20 118.37 2r33 s ILE 28 Ca 0.35 -1.05 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 2r33 s ILE 28 Cb -0.03 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.81 2r33 s ILE 28 CO 0.22 -0.16 0.77 -2.16 0.00 0.00 0.00 174.94 173.61 2r33 s PRO 29 N 1.53 3.65 0.54 2.79 0.04 -1.26 -5.12 135.00 137.17 2r33 s PRO 29 Ca -0.04 0.32 -0.22 0.00 0.04 0.00 0.00 61.00 61.10 2r33 s PRO 29 Cb -0.18 -2.39 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 2r33 s PRO 29 CO -0.07 -0.12 1.37 -1.25 0.04 0.00 0.00 177.00 176.97 2r33 s PRO 30 N -4.30 3.15 -0.25 0.56 0.04 -1.10 -4.98 135.00 128.12 2r33 s PRO 30 Ca 0.49 2.26 0.01 0.00 0.04 0.00 0.00 61.00 63.80 2r33 s PRO 30 Cb -0.10 -2.27 0.07 0.00 0.04 0.00 0.00 34.50 32.23 2r33 s PRO 30 CO 0.38 -1.19 -0.04 -0.65 0.04 0.00 0.00 177.00 175.55 2r33 s GLN 31 N -2.89 1.60 0.17 4.56 -1.52 -1.22 -4.21 119.66 116.15 2r33 s GLN 31 Ca 0.71 -1.13 0.07 0.00 -1.95 0.00 0.00 55.36 53.06 2r33 s GLN 31 Cb -0.41 -2.64 -0.04 0.00 -0.22 0.00 0.00 33.01 29.70 2r33 s GLN 31 CO 0.49 -0.66 -0.01 0.00 -0.25 0.00 0.00 175.29 174.85 2r33 s HIS 33 N -1.68 -0.55 -0.10 0.00 -3.43 -0.84 -1.16 115.29 107.53 2r33 s HIS 33 Ca 0.27 0.93 -0.18 0.00 -0.80 0.00 0.00 55.06 55.27 2r33 s HIS 33 Cb -0.09 0.34 -0.04 0.00 -1.43 0.00 0.00 32.58 31.35 2r33 s HIS 33 CO 0.18 -0.56 0.49 0.00 -2.00 0.00 0.00 174.74 172.85 2r33 n THR 35 N 3.54 0.00 -1.49 0.00 -2.24 -0.51 -4.44 114.28 109.13 2r33 n THR 35 Ca -0.07 -0.29 -0.44 0.00 -2.27 0.00 0.00 64.05 60.98 2r33 n THR 35 Cb 0.52 1.21 -0.01 0.00 -2.10 0.00 0.00 70.33 69.94 2r33 n THR 35 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2r33 n ASN 36 N 0.19 -0.17 -4.27 3.42 5.03 -1.26 -4.97 115.26 113.23 2r33 n ASN 36 Ca 0.11 1.04 -0.34 0.00 0.87 0.00 0.00 54.58 56.26 2r33 n ASN 36 Cb 0.48 -1.15 -0.15 0.00 -1.02 0.00 0.00 39.78 37.94 2r33 n ASN 36 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2r33 s ILE 37 N -1.24 2.82 0.20 2.41 -1.09 -1.26 -4.40 121.20 118.64 2r33 s ILE 37 Ca 0.62 -0.71 0.11 0.00 -2.23 0.00 0.00 60.65 58.44 2r33 s ILE 37 Cb -0.69 -2.22 -0.04 0.00 -1.58 0.00 0.00 42.46 37.93 2r33 s ILE 37 CO 0.58 0.50 -0.18 -0.13 -1.23 0.00 0.00 174.94 174.48 2r33 s ARG 38 N 0.98 1.74 0.10 2.79 0.52 -0.00 -4.88 118.95 120.20 2r33 s ARG 38 Ca -0.02 -1.46 -0.18 0.00 -0.52 0.00 0.00 55.73 53.55 2r33 s ARG 38 Cb -0.15 -1.95 -0.06 0.00 0.52 0.00 0.00 34.95 33.31 2r33 s ARG 38 CO -0.02 0.40 1.58 -0.07 0.02 0.00 0.00 175.30 177.21 2r33 h LEU 39 N 2.97 0.47 -1.27 2.53 -0.00 -1.86 0.95 115.31 119.09 2r33 h LEU 39 Ca -0.46 -0.26 0.00 0.00 -0.00 0.00 0.00 57.88 57.17 2r33 h LEU 39 Cb 1.21 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 2r33 h LEU 39 CO 0.52 0.61 -0.00 0.59 -0.00 0.00 0.00 178.44 180.15 2r33 n ASN 40 N -4.64 0.27 -3.39 -0.43 3.02 -1.26 -3.88 115.26 104.95 2r33 n ASN 40 Ca -0.02 -1.13 -0.06 0.00 -0.03 0.00 0.00 54.58 53.34 2r33 n ASN 40 Cb 0.21 -0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.39 2r33 n ASN 40 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2r33 s SER 41 N -0.13 -0.08 0.45 6.41 0.01 -1.26 -5.01 113.70 114.09 2r33 s SER 41 Ca 0.00 -0.75 0.07 0.00 1.31 0.00 0.00 55.95 56.57 2r33 s SER 41 Cb 0.00 0.64 -0.02 0.00 0.21 0.00 0.00 66.02 66.86 2r33 s SER 41 CO 0.00 -1.25 0.29 0.00 0.41 0.00 0.00 173.24 172.69 2r33 s HIS 43 N -2.63 -0.29 0.29 0.00 -3.43 -1.26 -4.94 115.29 103.02 2r33 s HIS 43 Ca 0.39 0.41 0.09 0.00 -0.80 0.00 0.00 55.06 55.16 2r33 s HIS 43 Cb 0.00 -3.28 0.43 0.00 -1.43 0.00 0.00 32.58 28.30 2r33 s HIS 43 CO 0.23 -4.49 1.66 1.03 -2.00 0.00 0.00 174.74 171.17 2r33 h SER 44 N -3.03 0.08 -0.24 7.38 0.87 -1.97 -3.20 113.55 113.43 2r33 h SER 44 Ca -0.42 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2r33 h SER 44 Cb 1.30 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2r33 h SER 44 CO 0.27 0.60 0.00 0.61 -0.53 0.00 0.00 176.83 177.78 2r33 n GLY 45 N 0.05 0.32 3.65 5.77 0.00 -1.26 -4.90 105.19 108.83 2r33 n GLY 45 Ca -0.02 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 2r33 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r33 h LYS 47 N 7.78 0.17 -4.44 0.00 1.63 -1.92 -3.44 116.57 116.34 2r33 h LYS 47 Ca -0.21 -0.19 -0.63 0.00 -0.85 0.00 0.00 60.65 58.77 2r33 h LYS 47 Cb 1.07 0.06 -0.39 0.00 -0.60 0.00 0.00 32.23 32.36 2r33 h LYS 47 CO 0.99 0.94 -0.76 0.45 -3.45 0.00 0.00 179.45 177.63 2r33 s SER 48 N -6.34 4.32 -0.19 4.20 0.15 -1.26 -5.06 113.70 109.51 2r33 s SER 48 Ca -0.16 -1.65 -0.07 0.00 0.70 0.00 0.00 55.95 54.78 2r33 s SER 48 Cb 0.01 -1.36 -0.04 0.00 -1.71 0.00 0.00 66.02 62.92 2r33 s SER 48 CO 0.74 -0.31 0.04 0.00 1.20 0.00 0.00 173.24 174.92 2r33 s LEU 50 N 0.67 2.93 -0.08 0.00 0.20 -0.10 -4.96 118.68 117.34 2r33 s LEU 50 Ca 0.02 -0.37 0.02 0.00 0.69 0.00 0.00 54.13 54.49 2r33 s LEU 50 Cb -0.13 -1.75 -0.02 0.00 -0.43 0.00 0.00 46.19 43.86 2r33 s LEU 50 CO 0.02 -0.01 -0.13 0.00 -0.29 0.00 0.00 176.35 175.94 2r33 s THR 52 N -0.40 1.88 -1.23 0.00 2.01 0.03 -4.99 115.64 112.94 2r33 s THR 52 Ca 0.05 -0.95 -0.13 0.00 0.31 0.00 0.00 61.69 60.96 2r33 s THR 52 Cb -0.12 -1.61 0.16 0.00 0.01 0.00 0.00 72.50 70.94 2r33 s THR 52 CO 0.02 0.52 1.53 2.22 -0.69 0.00 0.00 174.62 178.22 2r33 n PHE 53 N 3.19 4.68 -0.11 4.92 -0.00 -1.26 -2.37 117.46 126.50 2r33 n PHE 53 Ca -0.18 -3.24 -0.23 0.00 -0.00 0.00 0.00 57.45 53.80 2r33 n PHE 53 Cb 0.52 -2.20 -0.08 0.00 -0.00 0.00 0.00 39.48 37.73 2r33 n PHE 53 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 2r33 n SER 54 N 5.66 1.66 -4.79 5.98 3.41 -1.26 -5.06 113.62 119.21 2r33 n SER 54 Ca 0.38 0.29 -0.37 0.00 -0.26 0.00 0.00 58.87 58.91 2r33 n SER 54 Cb 0.42 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.63 2r33 n SER 54 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2r33 s GLY 57 N -5.33 2.31 -0.29 5.00 0.00 -1.26 -5.22 107.32 102.52 2r33 s GLY 57 Ca -0.31 -0.39 0.03 0.00 0.00 0.00 0.00 44.72 44.05 2r33 s GLY 57 CO 0.40 0.23 0.51 -0.56 0.00 0.00 0.00 173.10 173.68 2r33 s SER 58 N -0.28 -0.71 -0.07 1.64 0.01 -1.00 -4.78 113.70 108.51 2r33 s SER 58 Ca 0.19 0.09 0.02 0.00 1.31 0.00 0.00 55.95 57.56 2r33 s SER 58 Cb -0.14 1.64 -0.03 0.00 0.21 0.00 0.00 66.02 67.70 2r33 s SER 58 CO 0.08 -0.31 -0.10 0.00 0.41 0.00 0.00 173.24 173.31 2r33 s ARG 60 N -0.64 0.44 -0.17 0.00 3.00 -0.18 -0.82 118.95 120.57 2r33 s ARG 60 Ca 0.10 0.00 -0.24 0.00 -1.00 0.00 0.00 55.73 54.59 2r33 s ARG 60 Cb -0.11 0.20 -0.02 0.00 0.00 0.00 0.00 34.95 35.02 2r33 s ARG 60 CO 0.01 -0.10 0.76 0.00 0.00 0.00 0.00 175.30 175.97 2r33 n LEU 62 N 5.08 0.46 -4.57 0.00 4.32 0.14 -4.47 117.00 117.96 2r33 n LEU 62 Ca 0.02 0.24 -0.46 0.00 -0.02 0.00 0.00 56.01 55.79 2r33 n LEU 62 Cb 0.49 -0.30 -0.02 0.00 -1.62 0.00 0.00 43.42 41.97 2r33 n LEU 62 CO 0.47 0.02 0.58 0.47 -1.22 0.00 0.00 177.39 177.71 2r33 n ASP 63 N -1.74 1.15 -4.35 -1.43 8.00 -1.25 -4.98 116.55 111.94 2r33 n ASP 63 Ca 0.05 1.16 -0.33 0.00 0.71 0.00 0.00 54.79 56.38 2r33 n ASP 63 Cb 0.37 -1.24 -0.14 0.00 -0.02 0.00 0.00 41.12 40.09 2r33 n ASP 63 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2r33 s ILE 64 N -0.74 3.01 0.39 0.53 1.01 -1.26 -4.45 121.20 119.69 2r33 s ILE 64 Ca 0.64 -0.67 0.06 0.00 0.00 0.00 0.00 60.65 60.68 2r33 s ILE 64 Cb -0.77 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 2r33 s ILE 64 CO 0.57 0.52 0.21 0.00 0.00 0.00 0.00 174.94 176.23 2r33 s ALA 65 N 0.49 2.54 -2.49 9.38 0.00 -0.31 -4.93 121.76 126.45 2r33 s ALA 65 Ca -0.09 -1.55 0.25 0.00 0.00 0.00 0.00 51.96 50.57 2r33 s ALA 65 Cb -0.16 1.08 0.79 0.00 0.00 0.00 0.00 23.12 24.84 2r33 s ALA 65 CO 0.04 -0.49 1.59 0.09 0.00 0.00 0.00 175.76 177.00 2r33 n ASN 66 N -1.53 1.90 -3.43 0.00 5.03 -1.26 0.95 115.26 116.93 2r33 n ASN 66 Ca -0.00 -1.67 -0.13 0.00 0.87 0.00 0.00 54.58 53.65 2r33 n ASN 66 Cb 0.63 -0.05 -0.04 0.00 -1.02 0.00 0.00 39.78 39.30 2r33 n ASN 66 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 2r33 s PHE 67 N -1.89 0.86 -0.00 3.10 -0.12 -1.26 -4.74 117.98 113.93 2r33 s PHE 67 Ca 0.35 -1.15 0.06 0.00 -0.05 0.00 0.00 56.93 56.15 2r33 s PHE 67 Cb 0.20 0.01 -0.03 0.00 -0.63 0.00 0.00 43.02 42.57 2r33 s PHE 67 CO 0.31 -1.11 -0.20 0.00 -0.05 0.00 0.00 175.22 174.17 2r33 s TYR 69 N -0.77 2.90 0.61 0.00 2.02 -1.26 -5.01 117.35 115.85 2r33 s TYR 69 Ca 0.12 1.35 -0.16 0.00 -0.37 0.00 0.00 57.07 58.01 2r33 s TYR 69 Cb -0.10 -2.99 -0.02 0.00 -0.40 0.00 0.00 41.96 38.44 2r33 s TYR 69 CO 0.02 -1.55 1.10 -1.59 -1.57 0.00 0.00 175.55 171.96 2r33 s LYS 70 N -5.05 3.06 0.58 -0.62 -2.85 -1.26 -4.16 119.74 109.44 2r33 s LYS 70 Ca 0.60 1.40 -0.19 0.00 -1.00 0.00 0.00 55.97 56.78 2r33 s LYS 70 Cb -0.15 -1.98 -0.05 0.00 -2.06 0.00 0.00 37.83 33.59 2r33 s LYS 70 CO 0.55 -1.05 1.00 -0.35 0.10 0.00 0.00 175.35 175.60 2r33 n PRO 71 N -2.04 0.99 0.08 1.78 -0.04 -1.17 -0.83 135.00 133.77 2r33 n PRO 71 Ca 0.10 0.38 -0.09 0.00 -0.04 0.00 0.00 63.50 63.85 2r33 n PRO 71 Cb 0.52 -2.19 -0.01 0.00 -0.04 0.00 0.00 33.50 31.78 2r33 n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46