#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2crs s LYS 2 N 0.00 1.34 0.00 1.47 -2.85 -1.26 -1.54 119.74 116.90 2crs s LYS 2 Ca 0.00 -0.84 0.00 0.00 -1.00 0.00 0.00 55.97 54.13 2crs s LYS 2 Cb 0.00 -1.40 0.00 0.00 -2.06 0.00 0.00 37.83 34.37 2crs s LYS 2 CO 0.00 0.36 0.00 0.00 0.10 0.00 0.00 175.35 175.81 2crs s ASN 4 N 0.57 4.69 0.07 0.00 3.84 -1.26 -1.48 114.94 121.36 2crs s ASN 4 Ca 0.00 -0.56 -0.02 0.00 0.21 0.00 0.00 52.86 52.49 2crs s ASN 4 Cb 0.00 -0.94 -0.04 0.00 -0.55 0.00 0.00 41.25 39.73 2crs s ASN 4 CO 0.00 0.01 0.01 -0.75 -2.79 0.00 0.00 177.10 173.58 2crs s LYS 5 N -3.57 0.69 0.00 0.43 2.47 -0.18 -4.19 119.74 115.39 2crs s LYS 5 Ca 0.31 -1.23 0.16 0.00 -1.56 0.00 0.00 55.97 53.65 2crs s LYS 5 Cb -0.07 0.23 0.24 0.00 -1.46 0.00 0.00 37.83 36.77 2crs s LYS 5 CO 0.20 -0.15 1.13 1.47 0.16 0.00 0.00 175.35 178.16 2crs n LEU 6 N 0.06 2.69 -0.09 5.43 -0.00 -1.26 -4.57 117.00 119.26 2crs n LEU 6 Ca -0.13 -1.35 -0.09 0.00 -0.00 0.00 0.00 56.01 54.45 2crs n LEU 6 Cb 0.62 -0.12 -0.03 0.00 -0.00 0.00 0.00 43.42 43.89 2crs n LEU 6 CO 0.28 0.56 -0.60 0.52 -0.00 0.00 0.00 177.39 178.15 2crs n VAL 7 N 0.93 1.48 -0.02 1.47 0.31 -1.26 -5.02 118.33 116.21 2crs n VAL 7 Ca 0.12 0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.59 2crs n VAL 7 Cb 0.44 -2.34 0.00 0.00 -0.91 0.00 0.00 33.84 31.02 2crs n VAL 7 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2crs n PRO 8 N -4.50 0.97 0.00 5.55 -0.04 -1.26 -4.98 135.00 130.74 2crs n PRO 8 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2crs n PRO 8 Cb 0.46 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 2crs n PRO 8 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2crs n LEU 9 N 0.00 0.00 0.00 1.53 -0.00 -1.26 -4.97 117.00 112.30 2crs n LEU 9 Ca 0.00 0.83 0.00 0.00 -0.00 0.00 0.00 56.01 56.84 2crs n LEU 9 Cb 0.00 -0.33 0.00 0.00 -0.00 0.00 0.00 43.42 43.09 2crs n LEU 9 CO 0.00 -0.33 0.00 0.49 -0.00 0.00 0.00 177.39 177.55 2crs n PHE 10 N -1.92 0.00 -3.77 1.47 3.72 -1.26 -4.99 117.46 110.70 2crs n PHE 10 Ca 0.00 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.03 2crs n PHE 10 Cb 0.00 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.47 2crs n PHE 10 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 2crs s TYR 11 N 0.41 3.55 0.23 1.38 -0.85 -1.26 -1.01 117.35 119.79 2crs s TYR 11 Ca 0.00 0.53 0.04 0.00 -0.52 0.00 0.00 57.07 57.12 2crs s TYR 11 Cb 0.00 -2.07 -0.01 0.00 0.38 0.00 0.00 41.96 40.26 2crs s TYR 11 CO 0.00 0.57 0.22 1.17 -1.52 0.00 0.00 175.55 175.99 2crs n LYS 12 N 2.52 0.32 -4.43 -3.49 4.81 -0.55 -4.98 118.16 112.35 2crs n LYS 12 Ca -0.18 -2.18 -0.21 0.00 -0.87 0.00 0.00 58.31 54.87 2crs n LYS 12 Cb 0.54 1.85 -0.10 0.00 0.02 0.00 0.00 35.03 37.33 2crs n LYS 12 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2crs s THR 13 N -2.87 1.66 -0.69 3.15 2.01 -1.26 -1.81 115.64 115.83 2crs s THR 13 Ca 0.26 -2.13 0.05 0.00 0.31 0.00 0.00 61.69 60.18 2crs s THR 13 Cb 0.01 -2.46 0.17 0.00 0.01 0.00 0.00 72.50 70.23 2crs s THR 13 CO 0.18 -0.29 0.51 0.00 -0.69 0.00 0.00 174.62 174.33 2crs s PRO 15 N -1.48 3.12 0.00 0.00 0.04 -1.26 -3.19 135.00 132.23 2crs s PRO 15 Ca 0.26 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.72 2crs s PRO 15 Cb -0.02 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.31 2crs s PRO 15 CO -0.16 -2.16 0.00 0.00 0.04 0.00 0.00 177.00 174.71 2crs n ALA 16 N 10.35 0.00 -0.11 8.56 0.00 -1.26 -4.81 120.51 133.24 2crs n ALA 16 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.36 2crs n ALA 16 Cb 0.50 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.85 2crs n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2crs n GLY 17 N -0.46 -0.80 0.00 0.00 0.00 -1.19 -5.03 105.19 97.70 2crs n GLY 17 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2crs n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2crs n LYS 18 N -4.43 0.00 0.00 1.61 4.76 -1.25 -4.96 118.16 113.89 2crs n LYS 18 Ca -0.32 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.12 2crs n LYS 18 Cb 0.66 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.85 2crs n LYS 18 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2crs n ASN 19 N 0.00 0.00 -4.99 4.39 6.94 -1.25 -4.88 115.26 115.47 2crs n ASN 19 Ca 0.00 0.00 -0.19 0.00 -0.02 0.00 0.00 54.58 54.37 2crs n ASN 19 Cb 0.00 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2crs n ASN 19 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2crs s LEU 20 N 0.00 3.90 -0.31 -4.53 1.43 -0.87 -4.43 118.68 113.87 2crs s LEU 20 Ca 0.00 -0.21 -0.05 0.00 -1.03 0.00 0.00 54.13 52.84 2crs s LEU 20 Cb 0.00 -2.75 0.03 0.00 0.03 0.00 0.00 46.19 43.50 2crs s LEU 20 CO 0.00 -0.51 0.06 0.00 0.23 0.00 0.00 176.35 176.13 2crs s TYR 22 N 1.41 3.13 -0.06 0.00 1.13 0.08 -0.12 117.35 122.92 2crs s TYR 22 Ca -0.00 -0.04 -0.01 0.00 -1.41 0.00 0.00 57.07 55.61 2crs s TYR 22 Cb -0.18 -1.49 0.03 0.00 -1.10 0.00 0.00 41.96 39.22 2crs s TYR 22 CO 0.01 0.52 0.01 0.21 -2.51 0.00 0.00 175.55 173.79 2crs s LYS 23 N -3.23 0.53 -0.27 -3.49 2.20 0.48 -1.29 119.74 114.66 2crs s LYS 23 Ca 0.31 0.12 -0.07 0.00 -0.36 0.00 0.00 55.97 55.98 2crs s LYS 23 Cb -0.10 -0.88 -0.01 0.00 -1.51 0.00 0.00 37.83 35.33 2crs s LYS 23 CO 0.24 -0.28 0.06 -1.64 -0.36 0.00 0.00 175.35 173.36 2crs s MET 24 N 1.88 3.32 0.03 4.03 -1.94 -0.45 -1.15 119.30 125.01 2crs s MET 24 Ca 0.03 -0.70 0.08 0.00 -1.71 0.00 0.00 55.69 53.40 2crs s MET 24 Cb -0.12 -3.31 -0.03 0.00 2.01 0.00 0.00 34.83 33.38 2crs s MET 24 CO -0.04 -0.32 -0.25 -0.59 -0.01 0.00 0.00 175.02 173.81 2crs s PHE 25 N 1.54 2.17 0.03 -0.03 -0.71 -0.60 0.25 117.98 120.63 2crs s PHE 25 Ca 0.04 -0.40 -0.03 0.00 -1.04 0.00 0.00 56.93 55.50 2crs s PHE 25 Cb -0.16 -1.32 -0.04 0.00 -1.21 0.00 0.00 43.02 40.29 2crs s PHE 25 CO 0.02 0.08 0.23 0.00 -1.34 0.00 0.00 175.22 174.21 2crs s MET 26 N -1.07 3.49 0.00 1.99 0.23 0.14 -1.05 119.30 123.03 2crs s MET 26 Ca 0.10 -0.26 0.24 0.00 -1.03 0.00 0.00 55.69 54.74 2crs s MET 26 Cb -0.10 -3.05 0.40 0.00 -1.53 0.00 0.00 34.83 30.55 2crs s MET 26 CO 0.01 0.63 1.16 1.55 -2.03 0.00 0.00 175.02 176.35 2crs n VAL 27 N 0.76 0.00 -0.10 5.16 3.14 -1.26 -2.14 118.33 123.89 2crs n VAL 27 Ca -0.09 -0.94 0.26 0.00 -2.96 0.00 0.00 64.34 60.61 2crs n VAL 27 Cb 0.52 0.97 0.60 0.00 -1.06 0.00 0.00 33.84 34.87 2crs n VAL 27 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2crs h ALA 28 N 0.94 2.62 0.00 1.55 0.00 -1.90 -3.38 119.26 119.09 2crs h ALA 28 Ca -0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2crs h ALA 28 Cb 1.87 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2crs h ALA 28 CO 0.09 -1.28 0.00 -2.37 0.00 0.00 0.00 179.25 175.69 2crs n THR 29 N -3.49 0.00 -0.98 0.00 5.66 -1.26 -5.13 114.28 109.08 2crs n THR 29 Ca 0.17 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.17 2crs n THR 29 Cb 1.14 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.92 2crs n THR 29 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2crs n PRO 30 N -3.24 0.35 -3.76 1.09 -0.04 -1.26 -5.08 135.00 123.07 2crs n PRO 30 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 2crs n PRO 30 Cb 0.00 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.30 2crs n PRO 30 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2crs s LYS 31 N -2.17 0.79 0.11 0.54 1.02 -1.26 -4.15 119.74 114.62 2crs s LYS 31 Ca 0.00 -0.66 -0.11 0.00 0.02 0.00 0.00 55.97 55.22 2crs s LYS 31 Cb 0.00 -2.13 0.01 0.00 -0.52 0.00 0.00 37.83 35.19 2crs s LYS 31 CO 0.00 -0.73 0.27 0.14 -0.92 0.00 0.00 175.35 174.11 2crs s VAL 32 N 1.74 0.11 0.64 3.17 -7.23 -0.91 -5.02 120.40 112.90 2crs s VAL 32 Ca 0.01 -1.07 -0.11 0.00 -1.81 0.00 0.00 61.98 59.00 2crs s VAL 32 Cb -0.17 -1.40 0.15 0.00 0.56 0.00 0.00 36.38 35.51 2crs s VAL 32 CO -0.13 -0.49 0.87 -0.81 -0.31 0.00 0.00 175.10 174.23 2crs n PRO 33 N -0.14 -0.84 0.00 4.82 -0.04 -1.26 0.26 135.00 137.80 2crs n PRO 33 Ca -0.14 -1.34 0.00 0.00 -0.04 0.00 0.00 63.50 61.98 2crs n PRO 33 Cb 0.63 -0.89 0.00 0.00 -0.04 0.00 0.00 33.50 33.20 2crs n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2crs n VAL 34 N -3.19 0.00 -3.21 0.52 0.31 0.70 -4.24 118.33 109.21 2crs n VAL 34 Ca 0.11 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.43 2crs n VAL 34 Cb 0.38 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.28 2crs n VAL 34 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2crs s LYS 35 N -1.00 0.51 -0.40 5.55 1.02 -0.76 -4.93 119.74 119.73 2crs s LYS 35 Ca 0.00 0.37 -0.07 0.00 0.02 0.00 0.00 55.97 56.29 2crs s LYS 35 Cb 0.00 0.03 0.08 0.00 -0.52 0.00 0.00 37.83 37.42 2crs s LYS 35 CO 0.00 -1.05 0.22 1.03 -0.92 0.00 0.00 175.35 174.63 2crs s ARG 36 N 2.70 2.49 0.00 1.68 0.52 -1.26 -1.34 118.95 123.74 2crs s ARG 36 Ca 0.10 -1.49 0.00 0.00 -0.52 0.00 0.00 55.73 53.82 2crs s ARG 36 Cb -0.11 -3.68 0.00 0.00 0.52 0.00 0.00 34.95 31.68 2crs s ARG 36 CO -0.27 -0.93 0.00 0.41 0.02 0.00 0.00 175.30 174.53 2crs n GLY 37 N 4.83 4.26 3.71 -3.53 0.00 -0.41 -3.82 105.19 110.22 2crs n GLY 37 Ca -0.09 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.35 2crs n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2crs s ILE 39 N -2.38 0.02 -1.48 0.00 2.07 -0.16 -4.69 121.20 114.58 2crs s ILE 39 Ca 0.36 -0.15 0.22 0.00 -1.41 0.00 0.00 60.65 59.67 2crs s ILE 39 Cb -0.04 -0.95 -0.12 0.00 0.13 0.00 0.00 42.46 41.48 2crs s ILE 39 CO 0.22 -0.08 1.01 -0.67 -1.91 0.00 0.00 174.94 173.51 2crs n ASP 40 N 0.61 1.45 -3.15 4.50 -0.08 -1.26 -2.05 116.55 116.56 2crs n ASP 40 Ca -0.19 -1.21 0.04 0.00 -1.51 0.00 0.00 54.79 51.93 2crs n ASP 40 Cb 0.59 0.73 -0.00 0.00 2.34 0.00 0.00 41.12 44.78 2crs n ASP 40 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2crs s VAL 41 N -2.76 -0.83 0.04 5.18 1.01 -1.26 -4.98 120.40 116.80 2crs s VAL 41 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 61.98 61.73 2crs s VAL 41 Cb 0.17 -0.86 -0.18 0.00 0.00 0.00 0.00 36.38 35.50 2crs s VAL 41 CO 0.73 0.00 1.21 0.00 0.00 0.00 0.00 175.10 177.04 2crs n PRO 43 N 2.05 0.56 -4.62 0.00 -0.04 -1.26 -5.10 135.00 126.59 2crs n PRO 43 Ca 0.19 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.33 2crs n PRO 43 Cb 0.14 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.53 2crs n PRO 43 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2crs s LYS 44 N -1.02 2.21 0.87 0.54 1.02 -1.26 -4.95 119.74 117.15 2crs s LYS 44 Ca 0.00 -2.35 -0.13 0.00 0.02 0.00 0.00 55.97 53.51 2crs s LYS 44 Cb 0.00 -1.62 0.14 0.00 -0.52 0.00 0.00 37.83 35.82 2crs s LYS 44 CO 0.00 -0.42 1.22 0.45 -0.92 0.00 0.00 175.35 175.68 2crs s SER 45 N -3.96 3.86 -0.08 2.83 0.15 -1.26 -4.84 113.70 110.41 2crs s SER 45 Ca 0.09 0.43 0.25 0.00 0.70 0.00 0.00 55.95 57.42 2crs s SER 45 Cb 0.01 -0.72 0.45 0.00 -1.71 0.00 0.00 66.02 64.05 2crs s SER 45 CO 0.05 -2.27 1.15 -1.20 1.20 0.00 0.00 173.24 172.18 2crs n SER 46 N -3.46 1.11 0.00 5.45 7.64 -1.23 -4.96 113.62 118.18 2crs n SER 46 Ca 0.12 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 57.99 2crs n SER 46 Cb 0.60 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 63.47 2crs n SER 46 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2crs n LEU 47 N 0.16 0.00 -2.83 -3.43 7.94 -1.26 -4.71 117.00 112.86 2crs n LEU 47 Ca 0.06 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.85 2crs n LEU 47 Cb 1.04 0.00 0.06 0.00 0.53 0.00 0.00 43.42 45.05 2crs n LEU 47 CO -0.01 0.00 0.18 0.00 -1.11 0.00 0.00 177.39 176.44 2crs n LEU 48 N 0.00 -1.03 0.00 -1.96 -0.00 -1.26 -4.89 117.00 107.86 2crs n LEU 48 Ca 0.00 -4.00 0.00 0.00 -0.00 0.00 0.00 56.01 52.01 2crs n LEU 48 Cb 0.00 0.65 0.00 0.00 -0.00 0.00 0.00 43.42 44.07 2crs n LEU 48 CO 0.00 2.04 0.00 0.55 -0.00 0.00 0.00 177.39 179.98 2crs n VAL 49 N 0.11 0.00 -3.30 1.47 3.14 -1.26 -4.34 118.33 114.15 2crs n VAL 49 Ca 0.10 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.29 2crs n VAL 49 Cb 0.73 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.51 2crs n VAL 49 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2crs s LYS 50 N 0.00 3.03 0.02 1.45 1.02 -0.21 -3.48 119.74 121.56 2crs s LYS 50 Ca 0.00 -1.02 0.02 0.00 0.02 0.00 0.00 55.97 54.98 2crs s LYS 50 Cb 0.00 -2.78 -0.01 0.00 -0.52 0.00 0.00 37.83 34.52 2crs s LYS 50 CO 0.00 -0.06 -0.06 1.52 -0.92 0.00 0.00 175.35 175.83 2crs s TYR 51 N -2.26 0.52 -0.06 3.18 1.13 -1.26 -1.55 117.35 117.05 2crs s TYR 51 Ca 0.48 -0.28 -0.00 0.00 -1.41 0.00 0.00 57.07 55.85 2crs s TYR 51 Cb -0.10 -0.32 0.03 0.00 -1.10 0.00 0.00 41.96 40.47 2crs s TYR 51 CO 0.32 -0.05 -0.02 0.08 -2.51 0.00 0.00 175.55 173.37 2crs s VAL 52 N -0.73 0.44 0.33 -3.49 1.01 -0.30 -4.91 120.40 112.75 2crs s VAL 52 Ca -0.04 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.01 2crs s VAL 52 Cb -0.06 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 2crs s VAL 52 CO 0.00 0.24 0.36 0.00 0.00 0.00 0.00 175.10 175.70 2crs s ASN 55 N 0.99 4.45 0.00 0.00 2.47 -1.26 -1.59 114.94 120.01 2crs s ASN 55 Ca -0.06 -3.74 0.00 0.00 0.42 0.00 0.00 52.86 49.48 2crs s ASN 55 Cb -0.06 -1.51 0.00 0.00 -1.45 0.00 0.00 41.25 38.24 2crs s ASN 55 CO -0.09 -0.10 0.00 0.41 -3.72 0.00 0.00 177.10 173.60 2crs n THR 56 N 2.11 0.00 0.00 -5.21 -1.04 -1.26 -5.06 114.28 103.82 2crs n THR 56 Ca 0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.21 2crs n THR 56 Cb 0.36 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 2crs n THR 56 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2crs n ASP 57 N -0.56 0.00 -0.89 8.00 9.92 -1.26 -4.54 116.55 127.21 2crs n ASP 57 Ca 0.00 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.14 2crs n ASP 57 Cb 0.00 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.43 2crs n ASP 57 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2crs n ARG 58 N 0.00 -1.70 0.00 -1.24 0.63 -1.26 -4.77 116.66 108.33 2crs n ARG 58 Ca 0.00 0.91 0.11 0.00 -0.92 0.00 0.00 57.85 57.95 2crs n ARG 58 Cb 0.00 -5.34 0.07 0.00 0.45 0.00 0.00 32.46 27.64 2crs n ARG 58 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12