#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 8.12 0.80 -2.95 0.00 3.32 -1.90 -3.33 116.42 120.47 2r33 h ASP 20 Ca -0.17 -0.40 -0.60 0.00 0.02 0.00 0.00 57.03 55.88 2r33 h ASP 20 Cb 1.11 -0.23 -0.40 0.00 0.22 0.00 0.00 39.33 40.04 2r33 h ASP 20 CO 0.14 1.15 -0.78 -0.44 -1.72 0.00 0.00 179.24 177.59 2r33 s SER 21 N -6.90 3.18 -0.27 6.45 0.01 -1.26 -4.92 113.70 109.98 2r33 s SER 21 Ca -0.09 -3.10 -0.21 0.00 1.31 0.00 0.00 55.95 53.86 2r33 s SER 21 Cb 0.11 -0.96 -0.01 0.00 0.21 0.00 0.00 66.02 65.36 2r33 s SER 21 CO 0.86 -0.18 0.66 0.00 0.41 0.00 0.00 173.24 174.99 2r33 s VAL 23 N 2.61 3.59 0.17 0.00 1.01 -0.58 -4.94 120.40 122.26 2r33 s VAL 23 Ca 0.27 -0.45 0.09 0.00 0.00 0.00 0.00 61.98 61.90 2r33 s VAL 23 Cb -0.15 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2r33 s VAL 23 CO 0.10 0.47 -0.13 0.00 0.00 0.00 0.00 175.10 175.54 2r33 s THR 25 N -1.62 4.36 -1.04 0.00 -4.23 0.19 -4.94 115.64 108.35 2r33 s THR 25 Ca 0.23 0.98 -0.15 0.00 -1.18 0.00 0.00 61.69 61.58 2r33 s THR 25 Cb -0.09 -3.64 0.19 0.00 1.34 0.00 0.00 72.50 70.29 2r33 s THR 25 CO 0.14 -0.79 1.17 -0.75 -0.54 0.00 0.00 174.62 173.85 2r33 s LYS 26 N -4.47 3.88 0.03 3.99 2.20 -1.26 -4.43 119.74 119.67 2r33 s LYS 26 Ca 0.59 -2.42 -0.06 0.00 -0.36 0.00 0.00 55.97 53.72 2r33 s LYS 26 Cb -0.12 -4.82 0.02 0.00 -1.51 0.00 0.00 37.83 31.40 2r33 s LYS 26 CO 0.41 -1.59 0.26 -1.13 -0.36 0.00 0.00 175.35 172.94 2r33 n SER 27 N 5.11 -0.38 -4.01 1.43 3.41 -1.26 -5.12 113.62 112.80 2r33 n SER 27 Ca 0.26 -1.17 -0.25 0.00 -0.26 0.00 0.00 58.87 57.45 2r33 n SER 27 Cb 0.45 0.61 -0.17 0.00 -0.26 0.00 0.00 64.21 64.84 2r33 n SER 27 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2r33 s ILE 28 N -2.35 1.14 0.76 -1.33 2.07 -1.26 -2.80 121.20 117.43 2r33 s ILE 28 Ca 0.06 -0.46 -0.11 0.00 -1.41 0.00 0.00 60.65 58.72 2r33 s ILE 28 Cb -0.01 -1.06 0.05 0.00 0.13 0.00 0.00 42.46 41.57 2r33 s ILE 28 CO 0.01 0.36 1.10 -2.16 -1.91 0.00 0.00 174.94 172.34 2r33 s PRO 29 N 0.81 2.38 0.27 3.50 0.04 -1.26 -5.07 135.00 135.67 2r33 s PRO 29 Ca -0.12 0.54 -0.30 0.00 0.04 0.00 0.00 61.00 61.16 2r33 s PRO 29 Cb -0.15 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.32 2r33 s PRO 29 CO 0.02 -1.39 1.47 -1.25 0.04 0.00 0.00 177.00 175.89 2r33 s PRO 30 N -5.26 4.23 -0.20 0.56 0.04 -1.12 -5.00 135.00 128.25 2r33 s PRO 30 Ca 0.60 2.38 0.00 0.00 0.04 0.00 0.00 61.00 64.02 2r33 s PRO 30 Cb -0.13 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.35 2r33 s PRO 30 CO 0.53 -0.47 -0.16 -0.65 0.04 0.00 0.00 177.00 176.29 2r33 s GLN 31 N -0.55 2.92 0.07 4.56 -1.52 -1.26 -4.24 119.66 119.64 2r33 s GLN 31 Ca 0.60 -0.89 0.06 0.00 -1.95 0.00 0.00 55.36 53.17 2r33 s GLN 31 Cb -0.43 -2.70 -0.03 0.00 -0.22 0.00 0.00 33.01 29.62 2r33 s GLN 31 CO 0.46 -0.28 -0.16 0.00 -0.25 0.00 0.00 175.29 175.06 2r33 s HIS 33 N -1.13 0.01 -0.19 0.00 -3.43 -0.44 -1.08 115.29 109.03 2r33 s HIS 33 Ca 0.01 -0.24 -0.15 0.00 -0.80 0.00 0.00 55.06 53.88 2r33 s HIS 33 Cb -0.09 0.02 -0.04 0.00 -1.43 0.00 0.00 32.58 31.03 2r33 s HIS 33 CO 0.02 -0.48 0.37 0.00 -2.00 0.00 0.00 174.74 172.65 2r33 n THR 35 N 4.20 0.15 -1.64 0.00 -2.24 -0.76 -4.25 114.28 109.74 2r33 n THR 35 Ca -0.09 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.78 2r33 n THR 35 Cb 0.51 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 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 1.00 1.88 -4.56 3.42 5.03 -1.26 -4.96 115.26 115.81 2r33 n ASN 36 Ca 0.17 1.12 -0.39 0.00 0.87 0.00 0.00 54.58 56.35 2r33 n ASN 36 Cb 0.51 -1.40 -0.11 0.00 -1.02 0.00 0.00 39.78 37.77 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 -1.17 5.29 -0.01 2.41 -1.09 -1.26 -4.49 121.20 120.88 2r33 s ILE 37 Ca 0.60 0.00 -0.01 0.00 -2.23 0.00 0.00 60.65 59.01 2r33 s ILE 37 Cb -0.58 -3.64 -0.04 0.00 -1.58 0.00 0.00 42.46 36.62 2r33 s ILE 37 CO 0.59 0.11 0.10 -0.13 -1.23 0.00 0.00 174.94 174.38 2r33 s ARG 38 N 1.77 3.15 -0.05 2.79 0.52 0.01 -4.92 118.95 122.21 2r33 s ARG 38 Ca 0.07 -0.44 -0.27 0.00 -0.52 0.00 0.00 55.73 54.57 2r33 s ARG 38 Cb -0.17 -2.92 -0.03 0.00 0.52 0.00 0.00 34.95 32.36 2r33 s ARG 38 CO 0.11 0.66 0.87 -0.51 0.02 0.00 0.00 175.30 176.45 2r33 s LEU 39 N -1.73 4.32 0.00 2.53 1.43 -1.26 -0.94 118.68 123.03 2r33 s LEU 39 Ca 0.23 1.43 0.00 0.00 -1.03 0.00 0.00 54.13 54.76 2r33 s LEU 39 Cb -0.12 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2r33 s LEU 39 CO 0.14 -0.25 0.00 0.59 0.23 0.00 0.00 176.35 177.06 2r33 n ASN 40 N 4.13 0.00 -3.53 2.29 3.02 0.47 -4.85 115.26 116.79 2r33 n ASN 40 Ca 0.04 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.46 2r33 n ASN 40 Cb 0.51 -0.22 -0.05 0.00 -0.61 0.00 0.00 39.78 39.41 2r33 n ASN 40 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2r33 s SER 41 N -0.73 -0.48 0.69 6.41 1.04 -1.26 -4.82 113.70 114.56 2r33 s SER 41 Ca 0.00 0.40 -0.11 0.00 0.48 0.00 0.00 55.95 56.72 2r33 s SER 41 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.54 2r33 s SER 41 CO 0.00 -0.52 1.06 0.00 0.98 0.00 0.00 173.24 174.76 2r33 s HIS 43 N -3.11 1.52 0.26 0.00 4.02 -1.26 -4.95 115.29 111.77 2r33 s HIS 43 Ca 0.58 1.12 -0.02 0.00 1.02 0.00 0.00 55.06 57.76 2r33 s HIS 43 Cb -0.13 -3.14 0.45 0.00 -1.02 0.00 0.00 32.58 28.74 2r33 s HIS 43 CO 0.54 -3.68 1.85 1.03 1.02 0.00 0.00 174.74 175.51 2r33 h SER 44 N -2.48 0.92 -0.03 1.40 0.87 -2.01 -2.88 113.55 109.34 2r33 h SER 44 Ca -0.60 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 2r33 h SER 44 Cb 1.33 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2r33 h SER 44 CO 0.52 0.54 0.00 0.61 -0.53 0.00 0.00 176.83 177.98 2r33 n GLY 45 N -1.35 -0.59 3.73 5.77 0.00 -1.26 -4.89 105.19 106.60 2r33 n GLY 45 Ca 0.16 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 2r33 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r33 n LYS 47 N 3.31 0.62 -4.00 0.00 4.81 -1.26 -4.83 118.16 116.80 2r33 n LYS 47 Ca 0.01 0.48 -0.34 0.00 -0.87 0.00 0.00 58.31 57.59 2r33 n LYS 47 Cb 0.50 -1.72 -0.15 0.00 0.02 0.00 0.00 35.03 33.68 2r33 n LYS 47 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2r33 s SER 48 N -6.94 3.83 -0.10 3.14 0.01 -1.26 -5.05 113.70 107.33 2r33 s SER 48 Ca -0.28 -0.59 0.02 0.00 1.31 0.00 0.00 55.95 56.42 2r33 s SER 48 Cb 0.07 -1.62 -0.01 0.00 0.21 0.00 0.00 66.02 64.66 2r33 s SER 48 CO 0.63 -0.03 -0.17 0.00 0.41 0.00 0.00 173.24 174.08 2r33 s LEU 50 N 0.06 2.61 -0.14 0.00 0.20 0.58 -4.93 118.68 117.06 2r33 s LEU 50 Ca -0.07 -0.87 -0.02 0.00 0.69 0.00 0.00 54.13 53.86 2r33 s LEU 50 Cb -0.15 -1.52 -0.02 0.00 -0.43 0.00 0.00 46.19 44.06 2r33 s LEU 50 CO 0.05 -0.06 -0.07 0.00 -0.29 0.00 0.00 176.35 175.98 2r33 s THR 52 N 0.28 4.75 0.06 0.00 2.01 0.28 -4.86 115.64 118.15 2r33 s THR 52 Ca -0.05 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 61.89 2r33 s THR 52 Cb -0.14 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.26 2r33 s THR 52 CO 0.04 0.50 0.00 0.49 -0.69 0.00 0.00 174.62 174.96 2r33 n PHE 53 N 3.15 -2.08 -4.27 4.92 3.01 -1.26 -1.12 117.46 119.80 2r33 n PHE 53 Ca -0.17 0.33 -0.28 0.00 1.01 0.00 0.00 57.45 58.34 2r33 n PHE 53 Cb 0.53 -0.46 -0.06 0.00 -0.01 0.00 0.00 39.48 39.48 2r33 n PHE 53 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2r33 s SER 54 N -4.43 4.37 0.00 4.37 1.04 -1.26 -4.58 113.70 113.20 2r33 s SER 54 Ca 0.00 -1.32 0.00 0.00 0.48 0.00 0.00 55.95 55.11 2r33 s SER 54 Cb 0.00 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2r33 s SER 54 CO 0.00 -0.80 0.00 2.30 0.98 0.00 0.00 173.24 175.72 2r33 n ILE 55 N -1.39 0.00 -1.54 -1.02 -0.00 -1.26 -2.75 119.36 111.40 2r33 n ILE 55 Ca -0.07 0.00 -0.23 0.00 -0.00 0.00 0.00 62.75 62.45 2r33 n ILE 55 Cb 0.65 0.00 -0.09 0.00 -0.00 0.00 0.00 39.64 40.20 2r33 n ILE 55 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 2r33 n PRO 56 N 0.00 0.55 -1.62 6.28 -0.04 -1.26 -5.14 135.00 133.77 2r33 n PRO 56 Ca 0.00 -0.41 -0.32 0.00 -0.04 0.00 0.00 63.50 62.74 2r33 n PRO 56 Cb 0.00 -3.00 0.05 0.00 -0.04 0.00 0.00 33.50 30.51 2r33 n PRO 56 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2r33 s GLY 57 N 9.39 1.85 -0.51 0.55 0.00 -1.11 -4.74 107.32 112.75 2r33 s GLY 57 Ca 1.05 0.28 -0.13 0.00 0.00 0.00 0.00 44.72 45.91 2r33 s GLY 57 CO 0.25 0.61 0.43 -0.56 0.00 0.00 0.00 173.10 173.82 2r33 s SER 58 N -3.26 5.99 -0.13 1.64 0.01 -0.28 -0.39 113.70 117.27 2r33 s SER 58 Ca 0.62 -1.79 -0.10 0.00 1.31 0.00 0.00 55.95 55.99 2r33 s SER 58 Cb -0.16 -2.13 -0.05 0.00 0.21 0.00 0.00 66.02 63.89 2r33 s SER 58 CO 0.49 -0.77 0.19 0.00 0.41 0.00 0.00 173.24 173.55 2r33 s ARG 60 N -0.49 1.16 -0.11 0.00 3.52 0.86 -0.81 118.95 123.08 2r33 s ARG 60 Ca 0.14 -0.40 -0.24 0.00 -0.13 0.00 0.00 55.73 55.10 2r33 s ARG 60 Cb -0.12 -1.06 -0.03 0.00 -1.56 0.00 0.00 34.95 32.18 2r33 s ARG 60 CO 0.04 0.18 0.76 0.00 -0.81 0.00 0.00 175.30 175.46 2r33 h LEU 62 N 7.50 0.00 -8.46 0.00 3.38 -0.48 -3.41 115.31 113.85 2r33 h LEU 62 Ca -0.36 -0.07 -0.75 0.00 0.09 0.00 0.00 57.88 56.79 2r33 h LEU 62 Cb 1.17 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.96 2r33 h LEU 62 CO 0.79 0.03 0.14 0.47 0.09 0.00 0.00 178.44 179.96 2r33 n ASP 63 N -2.54 0.15 -4.44 -0.43 8.00 -1.25 -4.96 116.55 111.08 2r33 n ASP 63 Ca 0.02 1.09 -0.34 0.00 0.71 0.00 0.00 54.79 56.28 2r33 n ASP 63 Cb 0.50 -0.86 -0.13 0.00 -0.02 0.00 0.00 41.12 40.61 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 0.39 3.63 0.43 0.53 1.01 -1.26 -4.42 121.20 121.51 2r33 s ILE 64 Ca 0.87 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 61.11 2r33 s ILE 64 Cb -1.22 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 2r33 s ILE 64 CO 0.57 0.48 0.06 0.00 0.00 0.00 0.00 174.94 176.05 2r33 s ALA 65 N 0.58 3.28 -2.37 9.38 0.00 -0.24 -4.94 121.76 127.45 2r33 s ALA 65 Ca -0.04 -1.21 0.23 0.00 0.00 0.00 0.00 51.96 50.94 2r33 s ALA 65 Cb -0.15 0.41 0.83 0.00 0.00 0.00 0.00 23.12 24.22 2r33 s ALA 65 CO 0.03 -0.19 1.61 0.09 0.00 0.00 0.00 175.76 177.29 2r33 n ASN 66 N -1.15 1.68 -2.32 0.00 5.03 -1.26 -0.81 115.26 116.44 2r33 n ASN 66 Ca -0.10 -1.65 -0.09 0.00 0.87 0.00 0.00 54.58 53.61 2r33 n ASN 66 Cb 0.66 -0.07 -0.01 0.00 -1.02 0.00 0.00 39.78 39.34 2r33 n ASN 66 CO 0.00 0.00 0.00 2.22 -1.83 0.00 0.00 177.26 177.65 2r33 n PHE 67 N 0.32 -1.39 -4.88 3.10 -1.74 -1.26 -4.65 117.46 106.97 2r33 n PHE 67 Ca 0.17 -1.50 -0.27 0.00 -0.56 0.00 0.00 57.45 55.29 2r33 n PHE 67 Cb 0.35 0.46 -0.15 0.00 1.52 0.00 0.00 39.48 41.66 2r33 n PHE 67 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2r33 s TYR 69 N -0.66 3.39 0.81 0.00 2.02 -1.26 -5.02 117.35 116.63 2r33 s TYR 69 Ca 0.08 1.41 -0.12 0.00 -0.37 0.00 0.00 57.07 58.08 2r33 s TYR 69 Cb -0.09 -2.82 0.09 0.00 -0.40 0.00 0.00 41.96 38.74 2r33 s TYR 69 CO 0.01 -0.71 1.16 0.15 -1.57 0.00 0.00 175.55 174.58 2r33 s LYS 70 N -4.55 1.72 0.77 -0.62 1.02 -1.26 -4.25 119.74 112.57 2r33 s LYS 70 Ca 0.58 1.54 -0.14 0.00 0.02 0.00 0.00 55.97 57.98 2r33 s LYS 70 Cb -0.12 -1.81 0.06 0.00 -0.52 0.00 0.00 37.83 35.45 2r33 s LYS 70 CO 0.43 -2.11 1.21 -2.14 -0.92 0.00 0.00 175.35 171.81 2r33 s PRO 71 N -4.42 1.87 0.35 -1.68 0.02 -1.25 -1.10 135.00 128.79 2r33 s PRO 71 Ca 0.68 1.76 0.11 0.00 0.02 0.00 0.00 61.00 63.57 2r33 s PRO 71 Cb -0.24 -1.80 0.66 0.00 0.02 0.00 0.00 34.50 33.14 2r33 s PRO 71 CO 0.52 -2.04 1.80 0.00 -0.33 0.00 0.00 177.00 176.96