#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 0.29 0.00 3.23 1.02 -1.25 -1.49 119.74 121.54 2crs s LYS 2 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 55.97 55.94 2crs s LYS 2 Cb 0.00 -0.77 0.00 0.00 -0.52 0.00 0.00 37.83 36.54 2crs s LYS 2 CO 0.00 -0.93 0.00 0.00 -0.92 0.00 0.00 175.35 173.50 2crs s ASN 4 N 0.75 3.78 0.00 0.00 2.47 -1.26 -1.43 114.94 119.25 2crs s ASN 4 Ca 0.00 -0.57 0.00 0.00 0.42 0.00 0.00 52.86 52.71 2crs s ASN 4 Cb 0.00 -0.50 0.00 0.00 -1.45 0.00 0.00 41.25 39.30 2crs s ASN 4 CO 0.00 0.19 0.00 1.17 -3.72 0.00 0.00 177.10 174.74 2crs n LYS 5 N 0.95 3.55 0.00 0.43 4.81 -0.58 -4.55 118.16 122.78 2crs n LYS 5 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 2crs n LYS 5 Cb 0.53 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.58 2crs n LYS 5 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 2crs n LEU 6 N 0.00 0.00 0.01 3.14 -0.00 -1.26 -4.91 117.00 113.99 2crs n LEU 6 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.79 2crs n LEU 6 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 2crs n LEU 6 CO 0.00 0.00 -0.52 0.58 -0.00 0.00 0.00 177.39 177.45 2crs h VAL 7 N 0.00 0.93 -3.58 1.47 2.07 -1.98 -3.45 116.25 111.71 2crs h VAL 7 Ca 0.00 -2.39 -0.56 0.00 0.82 0.00 0.00 66.70 64.57 2crs h VAL 7 Cb 0.00 2.65 -0.07 0.00 -1.52 0.00 0.00 31.29 32.36 2crs h VAL 7 CO 0.00 0.74 0.95 -2.16 0.02 0.00 0.00 177.57 177.12 2crs s PRO 8 N -2.50 3.72 0.27 1.57 0.04 -1.26 -4.86 135.00 131.98 2crs s PRO 8 Ca -0.20 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.54 2crs s PRO 8 Cb 0.05 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.67 2crs s PRO 8 CO 0.77 -1.38 0.00 1.28 0.04 0.00 0.00 177.00 177.71 2crs n LEU 9 N 7.97 -0.54 -0.00 -3.56 4.77 -1.26 -4.72 117.00 119.65 2crs n LEU 9 Ca 0.13 1.20 0.02 0.00 -0.03 0.00 0.00 56.01 57.33 2crs n LEU 9 Cb 0.49 -3.42 -0.02 0.00 -2.33 0.00 0.00 43.42 38.13 2crs n LEU 9 CO 0.70 -2.65 -0.45 2.22 -1.33 0.00 0.00 177.39 175.89 2crs n PHE 10 N -3.31 0.00 -4.41 -1.77 -1.74 -1.26 -4.20 117.46 100.78 2crs n PHE 10 Ca -0.00 0.00 -0.27 0.00 -0.56 0.00 0.00 57.45 56.62 2crs n PHE 10 Cb 0.62 -0.06 -0.11 0.00 1.52 0.00 0.00 39.48 41.45 2crs n PHE 10 CO 0.00 0.00 0.00 1.52 -0.56 0.00 0.00 176.76 177.72 2crs s TYR 11 N -2.07 2.35 -0.00 2.97 1.13 -1.26 -1.53 117.35 118.93 2crs s TYR 11 Ca -0.01 -0.34 0.01 0.00 -1.41 0.00 0.00 57.07 55.32 2crs s TYR 11 Cb 0.02 -1.16 -0.00 0.00 -1.10 0.00 0.00 41.96 39.72 2crs s TYR 11 CO 0.13 0.51 -0.03 -1.59 -2.51 0.00 0.00 175.55 172.05 2crs s LYS 12 N -2.72 0.27 -0.38 -3.49 -2.85 -0.52 -4.65 119.74 105.41 2crs s LYS 12 Ca 0.22 -0.12 -0.11 0.00 -1.00 0.00 0.00 55.97 54.96 2crs s LYS 12 Cb -0.08 -0.27 0.03 0.00 -2.06 0.00 0.00 37.83 35.46 2crs s LYS 12 CO 0.11 0.07 0.21 0.99 0.10 0.00 0.00 175.35 176.82 2crs s THR 13 N -0.06 4.50 -0.44 3.79 2.01 -1.26 -1.71 115.64 122.47 2crs s THR 13 Ca 0.01 -0.94 0.10 0.00 0.31 0.00 0.00 61.69 61.17 2crs s THR 13 Cb -0.02 -3.54 0.35 0.00 0.01 0.00 0.00 72.50 69.30 2crs s THR 13 CO -0.00 -0.27 0.81 0.00 -0.69 0.00 0.00 174.62 174.47 2crs h PRO 15 N 2.99 -0.05 0.18 0.00 0.13 -1.76 -1.56 132.00 131.93 2crs h PRO 15 Ca 0.11 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.90 2crs h PRO 15 Cb 0.81 0.01 0.01 0.00 0.13 0.00 0.00 31.00 31.96 2crs h PRO 15 CO 0.61 -0.03 -1.70 0.00 -0.23 0.00 0.00 178.00 176.65 2crs h ALA 16 N -1.52 0.17 -0.29 -0.56 0.00 -1.96 -3.35 119.26 111.75 2crs h ALA 16 Ca -0.01 -1.12 0.05 0.00 0.00 0.00 0.00 54.91 53.83 2crs h ALA 16 Cb 0.04 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 2crs h ALA 16 CO 0.01 1.03 -0.03 0.78 0.00 0.00 0.00 179.25 181.04 2crs h GLY 17 N 0.87 0.25 0.00 0.00 0.00 -1.90 -3.46 103.07 98.83 2crs h GLY 17 Ca -0.32 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2crs h GLY 17 CO 0.18 -0.08 0.00 0.28 0.00 0.00 0.00 176.54 176.92 2crs n LYS 18 N -5.20 0.00 0.00 4.80 5.02 -1.21 -4.94 118.16 116.63 2crs n LYS 18 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2crs n LYS 18 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 2crs n LYS 18 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2crs n ASN 19 N 0.00 0.00 -4.90 4.39 0.23 -1.18 -4.34 115.26 109.45 2crs n ASN 19 Ca 0.00 0.00 -0.31 0.00 -0.53 0.00 0.00 54.58 53.74 2crs n ASN 19 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 2crs n ASN 19 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2crs s LEU 20 N -1.37 4.30 -0.13 -4.53 1.02 -0.77 -4.16 118.68 113.04 2crs s LEU 20 Ca 0.00 0.26 0.01 0.00 0.02 0.00 0.00 54.13 54.42 2crs s LEU 20 Cb 0.00 -2.83 -0.01 0.00 0.02 0.00 0.00 46.19 43.37 2crs s LEU 20 CO 0.00 0.19 -0.18 0.00 0.02 0.00 0.00 176.35 176.39 2crs s TYR 22 N 0.49 1.55 -0.10 0.00 1.13 -0.57 -0.19 117.35 119.65 2crs s TYR 22 Ca -0.12 -1.28 -0.01 0.00 -1.41 0.00 0.00 57.07 54.25 2crs s TYR 22 Cb -0.16 -0.87 0.03 0.00 -1.10 0.00 0.00 41.96 39.86 2crs s TYR 22 CO 0.05 -0.44 -0.03 0.15 -2.51 0.00 0.00 175.55 172.77 2crs s LYS 23 N -3.93 1.00 -0.16 -3.49 1.02 -0.14 -1.62 119.74 112.42 2crs s LYS 23 Ca 0.37 -0.12 -0.04 0.00 0.02 0.00 0.00 55.97 56.20 2crs s LYS 23 Cb 0.06 -1.37 -0.03 0.00 -0.52 0.00 0.00 37.83 35.98 2crs s LYS 23 CO 0.15 -0.33 -0.03 1.41 -0.92 0.00 0.00 175.35 175.63 2crs s MET 24 N 1.84 3.65 0.18 1.68 1.75 -0.40 -1.53 119.30 126.48 2crs s MET 24 Ca 0.04 -0.52 0.09 0.00 -1.25 0.00 0.00 55.69 54.05 2crs s MET 24 Cb -0.13 -2.94 -0.04 0.00 2.84 0.00 0.00 34.83 34.56 2crs s MET 24 CO -0.07 0.19 -0.18 -0.59 -0.65 0.00 0.00 175.02 173.72 2crs s PHE 25 N 0.49 1.89 0.23 4.11 -0.12 -0.73 -1.62 117.98 122.24 2crs s PHE 25 Ca -0.03 -0.46 0.04 0.00 -0.05 0.00 0.00 56.93 56.43 2crs s PHE 25 Cb -0.14 -0.92 -0.03 0.00 -0.63 0.00 0.00 43.02 41.29 2crs s PHE 25 CO 0.03 0.38 0.36 -1.64 -0.05 0.00 0.00 175.22 174.29 2crs s MET 26 N -2.94 3.45 -0.02 1.99 -1.94 -0.08 -1.31 119.30 118.45 2crs s MET 26 Ca 0.18 -0.68 0.22 0.00 -1.71 0.00 0.00 55.69 53.70 2crs s MET 26 Cb -0.05 -2.89 -0.31 0.00 2.01 0.00 0.00 34.83 33.59 2crs s MET 26 CO 0.08 0.43 0.56 0.28 -0.01 0.00 0.00 175.02 176.36 2crs n VAL 27 N -1.22 0.02 -0.32 -6.03 0.31 -1.26 -2.11 118.33 107.72 2crs n VAL 27 Ca -0.08 -0.42 0.20 0.00 -0.01 0.00 0.00 64.34 64.02 2crs n VAL 27 Cb 0.56 0.14 0.39 0.00 -0.91 0.00 0.00 33.84 34.02 2crs n VAL 27 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2crs h ALA 28 N 2.15 1.58 -3.96 3.52 0.00 -1.95 -3.40 119.26 117.20 2crs h ALA 28 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2crs h ALA 28 Cb 0.92 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2crs h ALA 28 CO 0.00 -0.61 0.00 0.25 0.00 0.00 0.00 179.25 178.89 2crs n THR 29 N -5.26 0.00 -2.04 0.00 -2.24 -1.26 -4.96 114.28 98.52 2crs n THR 29 Ca 0.27 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.64 2crs n THR 29 Cb 0.89 -0.94 -0.01 0.00 -2.10 0.00 0.00 70.33 68.16 2crs n THR 29 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2crs n PRO 30 N -0.91 2.67 -2.89 -0.78 -0.04 -1.26 -4.62 135.00 127.17 2crs n PRO 30 Ca 0.00 -2.76 -0.02 0.00 -0.04 0.00 0.00 63.50 60.68 2crs n PRO 30 Cb 0.00 -3.38 -0.02 0.00 -0.04 0.00 0.00 33.50 30.06 2crs n PRO 30 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2crs n LYS 31 N 7.39 -2.59 -3.99 0.54 4.01 -1.25 -4.97 118.16 117.31 2crs n LYS 31 Ca 0.50 2.15 -0.29 0.00 -0.51 0.00 0.00 58.31 60.15 2crs n LYS 31 Cb 0.43 -2.89 -0.17 0.00 -0.51 0.00 0.00 35.03 31.89 2crs n LYS 31 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2crs s VAL 32 N -0.58 1.42 0.12 -0.18 0.11 -0.90 -4.93 120.40 115.47 2crs s VAL 32 Ca -0.10 -0.54 -0.30 0.00 -2.93 0.00 0.00 61.98 58.11 2crs s VAL 32 Cb 0.01 -1.36 -0.06 0.00 -1.53 0.00 0.00 36.38 33.43 2crs s VAL 32 CO 0.38 0.43 1.08 -2.16 -3.33 0.00 0.00 175.10 171.50 2crs s PRO 33 N 1.55 4.58 0.00 1.54 0.04 -1.26 -0.90 135.00 140.54 2crs s PRO 33 Ca 0.05 1.65 0.00 0.00 0.04 0.00 0.00 61.00 62.74 2crs s PRO 33 Cb -0.13 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.08 2crs s PRO 33 CO -0.10 0.03 0.00 1.33 0.04 0.00 0.00 177.00 178.29 2crs n VAL 34 N 2.91 0.00 -3.82 -0.36 0.24 -0.64 -4.95 118.33 111.71 2crs n VAL 34 Ca 0.04 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 62.06 2crs n VAL 34 Cb 0.47 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.72 2crs n VAL 34 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2crs s LYS 35 N -0.36 2.15 -0.27 7.34 1.02 -0.77 -4.98 119.74 123.86 2crs s LYS 35 Ca 0.00 -3.07 -0.07 0.00 0.02 0.00 0.00 55.97 52.85 2crs s LYS 35 Cb 0.00 -3.06 -0.00 0.00 -0.52 0.00 0.00 37.83 34.24 2crs s LYS 35 CO 0.00 -1.29 0.07 1.03 -0.92 0.00 0.00 175.35 174.24 2crs s ARG 36 N -1.10 3.29 0.00 1.68 0.52 -1.26 -1.27 118.95 120.81 2crs s ARG 36 Ca 0.25 -0.72 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 2crs s ARG 36 Cb -0.05 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 32.10 2crs s ARG 36 CO -0.16 -0.35 0.00 0.41 0.02 0.00 0.00 175.30 175.23 2crs n GLY 37 N 4.88 3.70 3.26 -3.53 0.00 -0.64 -4.60 105.19 108.25 2crs n GLY 37 Ca -0.15 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.20 0.00 -0.21 0.00 2.07 -0.31 -4.93 121.20 116.62 2crs s ILE 39 Ca 0.04 -0.99 0.15 0.00 -1.41 0.00 0.00 60.65 58.45 2crs s ILE 39 Cb -0.10 -2.01 0.63 0.00 0.13 0.00 0.00 42.46 41.11 2crs s ILE 39 CO 0.04 0.00 1.54 0.47 -1.91 0.00 0.00 174.94 175.08 2crs n ASP 40 N -0.47 4.44 0.00 4.50 8.00 -1.26 -1.86 116.55 129.90 2crs n ASP 40 Ca -0.04 -3.04 0.00 0.00 0.71 0.00 0.00 54.79 52.42 2crs n ASP 40 Cb 0.59 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 2crs n ASP 40 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2crs n VAL 41 N -0.19 0.00 -3.17 2.53 3.14 -1.26 -5.02 118.33 114.37 2crs n VAL 41 Ca 0.25 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.40 2crs n VAL 41 Cb 1.02 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.75 2crs n VAL 41 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2crs n PRO 43 N 0.53 3.73 -0.63 0.00 -0.04 -1.26 -4.86 135.00 132.47 2crs n PRO 43 Ca 0.26 -2.31 0.00 0.00 -0.04 0.00 0.00 63.50 61.42 2crs n PRO 43 Cb 0.53 -2.81 0.00 0.00 -0.04 0.00 0.00 33.50 31.17 2crs n PRO 43 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2crs n LYS 44 N 3.57 0.72 -0.81 0.54 3.00 -1.26 -5.10 118.16 118.82 2crs n LYS 44 Ca 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 59.08 2crs n LYS 44 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.27 2crs n LYS 44 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2crs n SER 45 N -0.81 -5.21 0.00 3.14 3.41 -1.26 -4.88 113.62 108.02 2crs n SER 45 Ca 0.00 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 2crs n SER 45 Cb 0.00 -1.64 0.00 0.00 -0.26 0.00 0.00 64.21 62.31 2crs n SER 45 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2crs n SER 46 N -0.04 0.00 -0.05 4.04 3.41 -1.21 -4.95 113.62 114.83 2crs n SER 46 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2crs n SER 46 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 2crs n SER 46 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2crs h LEU 47 N 0.00 0.25 -5.91 1.04 3.38 -2.05 -3.41 115.31 108.61 2crs h LEU 47 Ca 0.00 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 2crs h LEU 47 Cb 0.00 -0.06 -0.21 0.00 0.09 0.00 0.00 40.66 40.48 2crs h LEU 47 CO 0.00 0.28 -0.51 -0.76 0.09 0.00 0.00 178.44 177.54 2crs s LEU 48 N -9.97 -1.20 0.00 1.67 1.43 -1.26 -5.01 118.68 104.34 2crs s LEU 48 Ca -0.13 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.83 2crs s LEU 48 Cb 0.08 1.66 0.00 0.00 0.03 0.00 0.00 46.19 47.95 2crs s LEU 48 CO 0.70 -0.17 0.00 0.55 0.23 0.00 0.00 176.35 177.67 2crs n VAL 49 N 4.11 0.00 -3.71 -1.59 3.14 -1.26 -4.26 118.33 114.76 2crs n VAL 49 Ca 0.13 0.00 -0.17 0.00 -2.96 0.00 0.00 64.34 61.33 2crs n VAL 49 Cb 0.55 0.00 -0.17 0.00 -1.06 0.00 0.00 33.84 33.16 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 -1.51 -0.03 0.03 1.45 1.02 -0.43 -3.29 119.74 116.98 2crs s LYS 50 Ca 0.00 0.36 0.04 0.00 0.02 0.00 0.00 55.97 56.40 2crs s LYS 50 Cb 0.00 -0.36 -0.03 0.00 -0.52 0.00 0.00 37.83 36.92 2crs s LYS 50 CO 0.00 -0.26 -0.08 1.52 -0.92 0.00 0.00 175.35 175.60 2crs s TYR 51 N 1.78 2.83 -0.24 3.18 -0.85 -1.26 -1.76 117.35 121.02 2crs s TYR 51 Ca -0.01 -0.09 0.01 0.00 -0.52 0.00 0.00 57.07 56.46 2crs s TYR 51 Cb -0.12 -1.56 0.06 0.00 0.38 0.00 0.00 41.96 40.72 2crs s TYR 51 CO -0.04 0.37 -0.04 0.08 -1.52 0.00 0.00 175.55 174.40 2crs s VAL 52 N -1.03 1.46 0.35 -3.49 1.01 -0.58 -4.94 120.40 113.19 2crs s VAL 52 Ca 0.18 -1.22 0.06 0.00 0.00 0.00 0.00 61.98 60.99 2crs s VAL 52 Cb -0.11 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 2crs s VAL 52 CO 0.09 -0.15 0.50 0.00 0.00 0.00 0.00 175.10 175.53 2crs n ASN 55 N 2.90 4.50 -0.00 0.00 5.15 -1.26 -1.67 115.26 124.88 2crs n ASN 55 Ca -0.15 -3.64 0.03 0.00 -0.60 0.00 0.00 54.58 50.22 2crs n ASN 55 Cb 0.56 -0.45 -0.04 0.00 -0.53 0.00 0.00 39.78 39.32 2crs n ASN 55 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2crs n THR 56 N -0.49 0.00 -0.01 -0.44 -1.04 -1.26 -5.08 114.28 105.97 2crs n THR 56 Ca 0.37 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 2crs n THR 56 Cb 0.72 0.64 0.00 0.00 -1.82 0.00 0.00 70.33 69.87 2crs n THR 56 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2crs n ASP 57 N -1.44 -1.45 -0.38 8.00 2.03 -1.26 -4.73 116.55 117.31 2crs n ASP 57 Ca -0.00 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.26 2crs n ASP 57 Cb 0.11 0.98 -0.02 0.00 -0.72 0.00 0.00 41.12 41.47 2crs n ASP 57 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2crs n ARG 58 N -0.79 -1.61 0.00 -0.67 3.00 -1.26 -4.76 116.66 110.58 2crs n ARG 58 Ca 0.00 0.63 0.09 0.00 -0.00 0.00 0.00 57.85 58.56 2crs n ARG 58 Cb 0.00 -4.92 0.01 0.00 0.00 0.00 0.00 32.46 27.54 2crs n ARG 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63