#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bmt s THR 3 N 0.00 0.12 -0.08 4.37 -4.23 -1.23 -4.70 115.64 109.88 2bmt s THR 3 Ca 0.00 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.72 2bmt s THR 3 Cb 0.00 -2.46 0.43 0.00 1.34 0.00 0.00 72.50 71.81 2bmt s THR 3 CO 0.00 0.00 1.18 -3.20 -0.54 0.00 0.00 174.62 172.06 2bmt n ASN 4 N -1.43 1.33 -4.30 3.99 5.15 -1.26 -4.84 115.26 113.90 2bmt n ASN 4 Ca 0.04 -2.67 -0.26 0.00 -0.60 0.00 0.00 54.58 51.09 2bmt n ASN 4 Cb 0.63 -0.38 -0.13 0.00 -0.53 0.00 0.00 39.78 39.36 2bmt n ASN 4 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2bmt s VAL 5 N -1.30 1.86 0.46 3.44 -7.23 -1.26 -5.04 120.40 111.33 2bmt s VAL 5 Ca 0.35 -1.45 -0.22 0.00 -1.81 0.00 0.00 61.98 58.85 2bmt s VAL 5 Cb 0.38 -1.64 -0.08 0.00 0.56 0.00 0.00 36.38 35.60 2bmt s VAL 5 CO -0.13 0.11 1.11 -0.55 -0.31 0.00 0.00 175.10 175.34 2bmt s SER 6 N -1.61 6.25 0.12 4.85 0.15 -1.26 -1.55 113.70 120.66 2bmt s SER 6 Ca 0.09 2.17 0.04 0.00 0.70 0.00 0.00 55.95 58.95 2bmt s SER 6 Cb -0.10 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.58 2bmt s SER 6 CO 0.03 -0.85 -0.09 0.00 1.20 0.00 0.00 173.24 173.53 2bmt n SER 8 N 0.04 2.11 0.00 0.00 7.64 -1.26 -4.59 113.62 117.56 2bmt n SER 8 Ca -0.12 -3.89 0.00 0.00 1.01 0.00 0.00 58.87 55.87 2bmt n SER 8 Cb 0.60 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2bmt n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bmt n ALA 9 N -1.07 0.00 -0.36 -0.43 0.00 -1.26 -4.80 120.51 112.58 2bmt n ALA 9 Ca 0.22 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.93 2bmt n ALA 9 Cb 0.73 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.71 2bmt n ALA 9 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2bmt h SER 10 N 0.00 0.43 -0.36 0.00 0.02 -1.89 0.13 113.55 111.88 2bmt h SER 10 Ca 0.00 0.13 0.05 0.00 -0.84 0.00 0.00 61.79 61.13 2bmt h SER 10 Cb 0.00 0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.57 2bmt h SER 10 CO 0.00 -0.04 0.08 0.77 -1.14 0.00 0.00 176.83 176.49 2bmt h SER 11 N 0.31 0.02 0.03 3.07 4.64 -1.91 0.41 113.55 120.13 2bmt h SER 11 Ca 0.70 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 62.07 2bmt h SER 11 Cb 1.82 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.98 2bmt h SER 11 CO -0.42 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 175.59 2bmt n GLN 12 N -5.08 0.50 -0.07 4.77 1.13 0.45 -3.37 117.38 115.71 2bmt n GLN 12 Ca 0.01 0.01 -0.10 0.00 -1.94 0.00 0.00 57.00 54.99 2bmt n GLN 12 Cb 0.16 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 28.94 2bmt n GLN 12 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bmt h TRP 14 N -0.01 -0.24 -0.61 0.00 6.55 -1.22 0.45 115.95 120.87 2bmt h TRP 14 Ca -0.31 0.06 -0.00 0.00 0.95 0.00 0.00 58.89 59.58 2bmt h TRP 14 Cb 1.48 0.22 -0.03 0.00 -0.86 0.00 0.00 29.16 29.97 2bmt h TRP 14 CO 0.02 -0.27 0.37 -1.00 -1.05 0.00 0.00 178.44 176.50 2bmt h PRO 15 N 0.04 0.82 0.77 0.49 0.13 -1.85 0.10 132.00 132.51 2bmt h PRO 15 Ca 0.35 -0.07 -0.04 0.00 -0.87 0.00 0.00 66.00 65.38 2bmt h PRO 15 Cb 0.57 -0.18 0.01 0.00 0.13 0.00 0.00 31.00 31.53 2bmt h PRO 15 CO -0.68 0.58 -0.37 0.28 -0.23 0.00 0.00 178.00 177.58 2bmt h VAL 16 N 0.84 0.00 -0.92 1.56 2.07 -0.49 -0.14 116.25 119.17 2bmt h VAL 16 Ca 0.22 -0.13 0.25 0.00 0.82 0.00 0.00 66.70 67.86 2bmt h VAL 16 Cb -0.03 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.60 2bmt h VAL 16 CO -0.04 0.00 0.38 0.00 0.02 0.00 0.00 177.57 177.92 2bmt h LYS 18 N 0.31 1.05 -0.21 0.00 1.63 0.25 0.54 116.57 120.14 2bmt h LYS 18 Ca 0.60 -0.28 -0.10 0.00 -0.85 0.00 0.00 60.65 60.02 2bmt h LYS 18 Cb 1.23 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 32.73 2bmt h LYS 18 CO -0.60 0.97 -0.25 -0.22 -3.45 0.00 0.00 179.45 175.91 2bmt h LYS 19 N 0.97 0.55 0.06 1.90 3.64 0.14 -2.52 116.57 121.31 2bmt h LYS 19 Ca 0.20 -0.30 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2bmt h LYS 19 Cb 0.42 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2bmt h LYS 19 CO 0.01 0.90 -0.03 -0.07 -2.27 0.00 0.00 179.45 177.99 2bmt h LEU 20 N 0.23 -0.07 0.00 5.20 3.38 -0.88 -3.41 115.31 119.76 2bmt h LEU 20 Ca 0.03 -0.48 -0.32 0.00 0.09 0.00 0.00 57.88 57.20 2bmt h LEU 20 Cb 0.81 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 2bmt h LEU 20 CO 0.06 0.47 -2.16 0.49 0.09 0.00 0.00 178.44 177.40 2bmt n PHE 21 N -4.87 0.00 0.00 1.13 3.72 0.14 -5.02 117.46 112.56 2bmt n PHE 21 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2bmt n PHE 21 Cb 0.27 -0.77 0.00 0.00 -0.94 0.00 0.00 39.48 38.05 2bmt n PHE 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bmt n GLY 22 N 2.30 1.71 3.30 1.37 0.00 -0.95 -5.02 105.19 107.90 2bmt n GLY 22 Ca -0.37 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 2bmt n GLY 22 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2bmt s THR 23 N -1.87 1.60 -0.25 2.61 -1.32 -1.20 -4.87 115.64 110.34 2bmt s THR 23 Ca 0.00 -1.89 0.13 0.00 -1.21 0.00 0.00 61.69 58.71 2bmt s THR 23 Cb 0.00 -1.76 0.59 0.00 -1.51 0.00 0.00 72.50 69.82 2bmt s THR 23 CO 0.00 -0.41 1.55 0.00 -2.21 0.00 0.00 174.62 173.55 2bmt n TYR 24 N 0.26 1.45 -3.75 9.09 9.36 -1.26 0.83 117.16 133.14 2bmt n TYR 24 Ca -0.13 -1.17 -0.29 0.00 3.32 0.00 0.00 57.90 59.63 2bmt n TYR 24 Cb 0.58 -0.48 -0.10 0.00 -0.63 0.00 0.00 39.34 38.70 2bmt n TYR 24 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 2bmt n ARG 25 N -0.58 2.12 -4.43 2.98 0.63 -1.26 -4.74 116.66 111.38 2bmt n ARG 25 Ca 0.31 -4.54 -0.22 0.00 -0.92 0.00 0.00 57.85 52.47 2bmt n ARG 25 Cb 1.09 -2.30 -0.09 0.00 0.45 0.00 0.00 32.46 31.61 2bmt n ARG 25 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2bmt s GLY 26 N -1.63 2.32 0.14 5.14 0.00 -1.26 -3.39 107.32 108.64 2bmt s GLY 26 Ca 0.29 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.44 2bmt s GLY 26 CO -0.12 -1.73 0.03 -1.59 0.00 0.00 0.00 173.10 169.68 2bmt s LYS 27 N -3.77 0.99 -0.23 2.90 -2.85 0.24 -4.62 119.74 112.40 2bmt s LYS 27 Ca 0.30 -1.47 -0.03 0.00 -1.00 0.00 0.00 55.97 53.78 2bmt s LYS 27 Cb 0.04 0.02 0.00 0.00 -2.06 0.00 0.00 37.83 35.84 2bmt s LYS 27 CO 0.16 -0.20 -0.05 0.00 0.10 0.00 0.00 175.35 175.36 2bmt s MET 29 N 1.43 0.61 -1.50 0.00 0.23 -0.39 -4.66 119.30 115.01 2bmt s MET 29 Ca 0.04 -0.65 -0.08 0.00 -1.03 0.00 0.00 55.69 53.97 2bmt s MET 29 Cb -0.15 0.25 0.06 0.00 -1.53 0.00 0.00 34.83 33.46 2bmt s MET 29 CO -0.04 -0.16 0.68 0.09 -2.03 0.00 0.00 175.02 173.56 2bmt n ASN 30 N 0.85 -2.25 -2.39 -1.18 3.02 -1.26 -0.55 115.26 111.50 2bmt n ASN 30 Ca -0.20 -0.93 -0.04 0.00 -0.03 0.00 0.00 54.58 53.38 2bmt n ASN 30 Cb 0.58 -3.29 -0.00 0.00 -0.61 0.00 0.00 39.78 36.46 2bmt n ASN 30 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2bmt n SER 31 N -2.87 -1.84 -4.00 6.41 7.64 -1.26 -4.91 113.62 112.79 2bmt n SER 31 Ca -0.12 0.39 -0.13 0.00 1.01 0.00 0.00 58.87 60.01 2bmt n SER 31 Cb 0.60 -1.69 -0.13 0.00 -1.01 0.00 0.00 64.21 61.98 2bmt n SER 31 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2bmt s LYS 32 N -4.83 0.43 0.81 1.43 1.02 0.29 -1.17 119.74 117.71 2bmt s LYS 32 Ca 0.00 -0.49 -0.11 0.00 0.02 0.00 0.00 55.97 55.39 2bmt s LYS 32 Cb 0.00 -0.26 0.08 0.00 -0.52 0.00 0.00 37.83 37.12 2bmt s LYS 32 CO 0.00 0.06 1.09 0.00 -0.92 0.00 0.00 175.35 175.58 2bmt s ARG 34 N -5.04 0.62 0.30 0.00 3.52 0.23 -3.55 118.95 115.02 2bmt s ARG 34 Ca 0.61 -0.39 0.05 0.00 -0.13 0.00 0.00 55.73 55.87 2bmt s ARG 34 Cb -0.16 0.26 -0.06 0.00 -1.56 0.00 0.00 34.95 33.44 2bmt s ARG 34 CO 0.55 -0.17 0.01 0.00 -0.81 0.00 0.00 175.30 174.89 2bmt n TYR 36 N -0.62 0.00 0.00 0.00 4.01 -1.22 -4.44 117.16 114.90 2bmt n TYR 36 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2bmt n TYR 36 Cb 0.65 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 39.45 2bmt n TYR 36 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85