#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wro s ILE 5 N 0.00 1.76 0.06 -0.61 -0.00 -1.26 -5.11 121.20 116.04 2wro s ILE 5 Ca 0.00 -3.30 0.01 0.00 -0.00 0.00 0.00 60.65 57.36 2wro s ILE 5 Cb 0.00 -2.18 -0.00 0.00 -0.00 0.00 0.00 42.46 40.27 2wro s ILE 5 CO 0.00 -1.03 0.05 1.41 -0.00 0.00 0.00 174.94 175.37 2wro n HIS 6 N 2.71 -0.15 0.93 1.37 -0.00 -1.26 -5.03 115.22 113.79 2wro n HIS 6 Ca 0.19 -0.47 0.09 0.00 -0.00 0.00 0.00 57.72 57.54 2wro n HIS 6 Cb 0.38 0.05 -0.09 0.00 -0.00 0.00 0.00 29.99 30.33 2wro n HIS 6 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 2wro n PRO 7 N -0.11 0.70 0.00 -0.41 -0.02 -1.26 -5.04 135.00 128.87 2wro n PRO 7 Ca 0.01 -0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.28 2wro n PRO 7 Cb 0.10 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2wro n PRO 7 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2wro n LYS 8 N -1.15 0.00 0.00 -0.52 4.81 -1.26 -4.91 118.16 115.13 2wro n LYS 8 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 2wro n LYS 8 Cb 0.33 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.38 2wro n LYS 8 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2wro n LEU 9 N 0.00 0.00 0.00 3.14 -0.00 -1.26 -5.06 117.00 113.82 2wro n LEU 9 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2wro n LEU 9 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2wro n LEU 9 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 177.39 177.94 2wro n VAL 10 N 0.47 0.00 -2.64 1.96 3.14 -1.14 -4.89 118.33 115.23 2wro n VAL 10 Ca 0.00 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.00 2wro n VAL 10 Cb 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 32.73 2wro n VAL 10 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2wro s PRO 11 N -2.00 4.50 0.05 1.45 0.04 -1.26 -1.01 135.00 136.77 2wro s PRO 11 Ca 0.00 1.50 -0.03 0.00 0.04 0.00 0.00 61.00 62.51 2wro s PRO 11 Cb 0.00 -2.85 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 2wro s PRO 11 CO 0.00 0.16 0.02 0.00 0.04 0.00 0.00 177.00 177.22 2wro s ALA 12 N -1.49 0.33 -0.62 8.56 0.00 0.32 -4.62 121.76 124.25 2wro s ALA 12 Ca 0.50 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2wro s ALA 12 Cb -0.23 0.30 0.16 0.00 0.00 0.00 0.00 23.12 23.35 2wro s ALA 12 CO 0.29 -0.38 0.40 -0.98 0.00 0.00 0.00 175.76 175.09 2wro s ARG 13 N -3.74 2.18 0.30 0.00 1.70 -1.21 -1.60 118.95 116.57 2wro s ARG 13 Ca 0.05 -3.00 -0.30 0.00 -0.47 0.00 0.00 55.73 52.02 2wro s ARG 13 Cb 0.06 -3.23 -0.12 0.00 -0.57 0.00 0.00 34.95 31.10 2wro s ARG 13 CO -0.10 -1.23 1.50 -0.89 -1.08 0.00 0.00 175.30 173.51 2wro n ILE 14 N 2.44 1.27 -3.66 4.99 -0.00 -0.36 -4.63 119.36 119.41 2wro n ILE 14 Ca 0.15 -0.32 -0.38 0.00 -0.00 0.00 0.00 62.75 62.20 2wro n ILE 14 Cb 0.35 -1.81 -0.09 0.00 -0.00 0.00 0.00 39.64 38.09 2wro n ILE 14 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 2wro s ILE 15 N -0.31 3.97 1.17 1.39 -1.09 -0.73 -3.29 121.20 122.32 2wro s ILE 15 Ca 0.62 -2.74 -0.15 0.00 -2.23 0.00 0.00 60.65 56.14 2wro s ILE 15 Cb -0.53 -3.58 0.22 0.00 -1.58 0.00 0.00 42.46 36.99 2wro s ILE 15 CO 0.53 -0.88 0.57 0.00 -1.23 0.00 0.00 174.94 173.93 2wro n GLY 17 N 1.49 0.57 0.41 0.00 0.00 -1.16 -4.23 105.19 102.28 2wro n GLY 17 Ca 0.01 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 2wro n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wro n GLY 19 N 2.22 -2.10 0.00 0.00 0.00 -1.26 -5.13 105.19 98.91 2wro n GLY 19 Ca -0.29 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2wro n GLY 19 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wro n ASN 20 N 0.00 0.00 -3.99 1.61 4.05 -1.26 -4.05 115.26 111.62 2wro n ASN 20 Ca 0.00 0.00 -0.32 0.00 0.45 0.00 0.00 54.58 54.71 2wro n ASN 20 Cb 0.00 0.00 -0.11 0.00 1.23 0.00 0.00 39.78 40.90 2wro n ASN 20 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2wro s VAL 21 N 0.00 3.17 0.33 3.44 1.01 -1.26 -2.88 120.40 124.20 2wro s VAL 21 Ca 0.00 -3.64 -0.28 0.00 0.00 0.00 0.00 61.98 58.06 2wro s VAL 21 Cb 0.00 -3.09 -0.10 0.00 0.00 0.00 0.00 36.38 33.20 2wro s VAL 21 CO 0.00 -0.92 1.19 -0.63 0.00 0.00 0.00 175.10 174.74 2wro s ILE 22 N -0.78 3.11 -0.42 2.22 1.09 -1.21 -4.83 121.20 120.39 2wro s ILE 22 Ca 0.21 1.08 0.02 0.00 -1.10 0.00 0.00 60.65 60.86 2wro s ILE 22 Cb -0.15 -3.67 0.12 0.00 -1.06 0.00 0.00 42.46 37.70 2wro s ILE 22 CO -0.08 0.22 0.19 -0.70 -0.10 0.00 0.00 174.94 174.48 2wro s GLU 23 N -1.78 1.34 0.00 2.79 2.12 -1.26 -1.22 118.70 120.69 2wro s GLU 23 Ca 0.49 -1.93 0.00 0.00 0.36 0.00 0.00 54.97 53.89 2wro s GLU 23 Cb -0.35 -2.58 0.00 0.00 0.26 0.00 0.00 34.13 31.46 2wro s GLU 23 CO 0.45 -1.09 0.00 0.25 -0.54 0.00 0.00 175.26 174.33 2wro n THR 24 N 3.80 0.00 -4.27 -1.70 -2.24 -0.62 -4.90 114.28 104.34 2wro n THR 24 Ca 0.05 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.62 2wro n THR 24 Cb 0.36 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.48 2wro n THR 24 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2wro s TYR 25 N 2.30 1.63 -3.96 4.78 1.51 -1.26 0.12 117.35 122.46 2wro s TYR 25 Ca 0.00 -0.47 0.00 0.00 -1.01 0.00 0.00 57.07 55.59 2wro s TYR 25 Cb 0.00 -0.86 0.00 0.00 -0.11 0.00 0.00 41.96 40.99 2wro s TYR 25 CO 0.00 0.21 0.00 -1.13 -1.11 0.00 0.00 175.55 173.52 2wro n SER 26 N 0.77 0.00 -4.81 2.29 3.41 -0.18 -4.92 113.62 110.18 2wro n SER 26 Ca -0.17 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.11 2wro n SER 26 Cb 0.55 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.49 2wro n SER 26 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wro s THR 27 N -2.06 4.05 0.07 6.66 -1.32 -1.26 -2.91 115.64 118.88 2wro s THR 27 Ca 0.00 1.06 0.00 0.00 -1.21 0.00 0.00 61.69 61.54 2wro s THR 27 Cb 0.00 -3.51 0.00 0.00 -1.51 0.00 0.00 72.50 67.48 2wro s THR 27 CO 0.00 -0.49 0.00 1.17 -2.21 0.00 0.00 174.62 173.09 2wro n LYS 28 N -1.59 -4.59 -0.13 7.08 3.00 -1.26 -4.92 118.16 115.75 2wro n LYS 28 Ca 0.08 3.37 -0.10 0.00 -0.00 0.00 0.00 58.31 61.66 2wro n LYS 28 Cb 0.53 -3.98 0.03 0.00 0.00 0.00 0.00 35.03 31.61 2wro n LYS 28 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 2wro h PRO 29 N 3.68 0.92 -5.81 1.64 0.11 -1.85 -3.42 132.00 127.27 2wro h PRO 29 Ca 0.00 -0.40 -0.61 0.00 0.11 0.00 0.00 66.00 65.11 2wro h PRO 29 Cb 0.00 -0.03 -0.12 0.00 0.11 0.00 0.00 31.00 30.96 2wro h PRO 29 CO 0.00 1.05 0.62 -1.21 -0.21 0.00 0.00 178.00 178.25 2wro s GLU 30 N -4.63 3.26 -0.39 1.05 8.01 -1.26 -3.34 118.70 121.41 2wro s GLU 30 Ca -0.11 -0.41 -0.03 0.00 0.01 0.00 0.00 54.97 54.44 2wro s GLU 30 Cb 0.12 -4.11 0.10 0.00 -4.31 0.00 0.00 34.13 25.93 2wro s GLU 30 CO 0.86 -1.64 0.17 0.42 0.01 0.00 0.00 175.26 175.07 2wro s ILE 31 N 4.17 3.22 -1.55 -1.63 1.09 -1.26 -5.00 121.20 120.25 2wro s ILE 31 Ca 0.29 -1.95 -0.10 0.00 -1.10 0.00 0.00 60.65 57.79 2wro s ILE 31 Cb -0.13 -3.16 -0.07 0.00 -1.06 0.00 0.00 42.46 38.03 2wro s ILE 31 CO 0.16 -0.60 2.82 0.00 -0.10 0.00 0.00 174.94 177.22 2wro n TYR 32 N 4.59 2.45 -1.24 3.97 0.18 -1.26 -1.77 117.16 124.09 2wro n TYR 32 Ca -0.04 -2.99 -0.36 0.00 1.88 0.00 0.00 57.90 56.40 2wro n TYR 32 Cb 0.42 -2.43 0.08 0.00 -0.38 0.00 0.00 39.34 37.02 2wro n TYR 32 CO 0.00 0.00 0.00 0.28 -2.08 0.00 0.00 176.86 175.06 2wro n VAL 33 N 3.81 1.84 -0.12 -3.48 0.31 -1.07 -4.95 118.33 114.67 2wro n VAL 33 Ca 0.73 -0.37 -0.24 0.00 -0.01 0.00 0.00 64.34 64.45 2wro n VAL 33 Cb 0.24 -0.82 -0.10 0.00 -0.91 0.00 0.00 33.84 32.26 2wro n VAL 33 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wro n GLU 34 N -1.13 0.57 -3.51 5.55 4.71 -1.26 -2.97 120.64 122.59 2wro n GLU 34 Ca 0.10 0.40 -0.13 0.00 -0.01 0.00 0.00 57.16 57.52 2wro n GLU 34 Cb 0.50 -1.60 -0.04 0.00 -1.01 0.00 0.00 31.44 29.29 2wro n GLU 34 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2wro s VAL 35 N -2.46 0.02 0.00 2.62 1.01 -1.26 -3.44 120.40 116.89 2wro s VAL 35 Ca -0.33 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2wro s VAL 35 Cb 0.10 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.47 2wro s VAL 35 CO 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 175.10 175.53 2wro n SER 37 N 0.00 -3.46 -0.30 0.00 7.64 -1.26 -3.07 113.62 113.17 2wro n SER 37 Ca 0.00 -0.60 -0.04 0.00 1.01 0.00 0.00 58.87 59.24 2wro n SER 37 Cb 0.00 -0.95 -0.02 0.00 -1.01 0.00 0.00 64.21 62.23 2wro n SER 37 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2wro n LYS 38 N -4.24 -1.34 -2.50 1.43 3.00 -1.26 -4.83 118.16 108.42 2wro n LYS 38 Ca 0.09 0.54 -0.16 0.00 -0.00 0.00 0.00 58.31 58.78 2wro n LYS 38 Cb 0.51 -4.63 0.02 0.00 0.00 0.00 0.00 35.03 30.94 2wro n LYS 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wro s HIS 40 N -3.49 -0.62 -0.43 0.00 5.65 -1.26 -4.37 115.29 110.77 2wro s HIS 40 Ca 0.39 1.47 -0.22 0.00 0.25 0.00 0.00 55.06 56.95 2wro s HIS 40 Cb 0.40 0.33 0.02 0.00 -1.18 0.00 0.00 32.58 32.15 2wro s HIS 40 CO -0.05 -0.32 0.71 -2.14 -0.65 0.00 0.00 174.74 172.29 2wro s PRO 41 N 0.15 3.39 -1.12 2.88 0.02 -1.26 -5.14 135.00 133.91 2wro s PRO 41 Ca 0.01 -0.19 -0.03 0.00 0.02 0.00 0.00 61.00 60.80 2wro s PRO 41 Cb -0.04 -3.93 0.26 0.00 0.02 0.00 0.00 34.50 30.81 2wro s PRO 41 CO -0.02 -1.03 1.89 1.97 -0.33 0.00 0.00 177.00 179.48 2wro n PHE 42 N 6.45 2.63 0.00 6.54 -1.74 -1.26 -5.01 117.46 125.07 2wro n PHE 42 Ca 0.00 -2.63 0.00 0.00 -0.56 0.00 0.00 57.45 54.26 2wro n PHE 42 Cb 0.48 -1.40 0.00 0.00 1.52 0.00 0.00 39.48 40.08 2wro n PHE 42 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 2wro n TYR 43 N 0.87 0.00 -0.80 2.97 9.36 -1.26 -5.01 117.16 123.29 2wro n TYR 43 Ca 0.46 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.68 2wro n TYR 43 Cb 0.28 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.99 2wro n TYR 43 CO 0.00 0.00 0.00 -2.37 0.22 0.00 0.00 176.86 174.71 2wro n THR 44 N 0.00 0.00 -1.37 2.97 5.66 -1.26 -5.16 114.28 115.11 2wro n THR 44 Ca 0.00 0.00 0.15 0.00 -3.05 0.00 0.00 64.05 61.15 2wro n THR 44 Cb 0.00 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 2wro n THR 44 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2wro n GLY 45 N 0.00 -3.42 3.42 1.09 0.00 -1.26 -5.03 105.19 99.99 2wro n GLY 45 Ca 0.00 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.87 2wro n GLY 45 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wro s GLN 46 N -4.35 1.24 0.00 1.61 2.00 -1.26 -5.17 119.66 113.74 2wro s GLN 46 Ca 0.00 -0.86 0.00 0.00 -2.00 0.00 0.00 55.36 52.50 2wro s GLN 46 Cb 0.00 0.48 0.00 0.00 0.80 0.00 0.00 33.01 34.29 2wro s GLN 46 CO 0.00 -0.50 0.00 0.00 -0.50 0.00 0.00 175.29 174.29 2wro n GLN 47 N -0.28 2.13 0.00 1.67 0.00 -1.26 -5.35 117.38 114.29 2wro n GLN 47 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.00 56.88 2wro n GLN 47 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.87 2wro n GLN 47 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93