#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 0.37 -0.11 4.37 -4.23 -1.19 -4.75 115.64 110.10 2bmt s THR 3 Ca 0.00 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.69 2bmt s THR 3 Cb 0.00 -2.43 0.41 0.00 1.34 0.00 0.00 72.50 71.82 2bmt s THR 3 CO 0.00 0.00 1.19 -3.20 -0.54 0.00 0.00 174.62 172.07 2bmt n ASN 4 N -1.28 1.36 -4.30 3.99 2.85 -1.26 -4.81 115.26 111.81 2bmt n ASN 4 Ca -0.01 -2.96 -0.26 0.00 -0.11 0.00 0.00 54.58 51.25 2bmt n ASN 4 Cb 0.64 -0.41 -0.13 0.00 1.24 0.00 0.00 39.78 41.12 2bmt n ASN 4 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2bmt s VAL 5 N -1.65 1.84 0.53 3.44 -7.23 -1.26 -5.04 120.40 111.02 2bmt s VAL 5 Ca 0.35 -1.46 -0.19 0.00 -1.81 0.00 0.00 61.98 58.87 2bmt s VAL 5 Cb 0.37 -1.63 -0.06 0.00 0.56 0.00 0.00 36.38 35.62 2bmt s VAL 5 CO -0.11 0.09 1.09 -0.55 -0.31 0.00 0.00 175.10 175.31 2bmt s SER 6 N -1.64 5.90 0.15 4.85 0.15 -1.26 -1.78 113.70 120.07 2bmt s SER 6 Ca 0.09 2.06 0.03 0.00 0.70 0.00 0.00 55.95 58.82 2bmt s SER 6 Cb -0.10 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 2bmt s SER 6 CO 0.04 -1.09 -0.05 0.00 1.20 0.00 0.00 173.24 173.34 2bmt n SER 8 N -0.18 2.54 0.00 0.00 2.88 -1.26 -4.60 113.62 113.00 2bmt n SER 8 Ca -0.09 -3.32 0.00 0.00 -1.33 0.00 0.00 58.87 54.13 2bmt n SER 8 Cb 0.62 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 2bmt n SER 8 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bmt n ALA 9 N -0.66 0.00 -0.35 -1.46 0.00 -1.26 -4.79 120.51 111.98 2bmt n ALA 9 Ca 0.23 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.93 2bmt n ALA 9 Cb 0.86 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.86 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 0.39 -0.27 0.00 0.02 -1.88 0.43 113.55 112.24 2bmt h SER 10 Ca 0.00 0.10 0.05 0.00 -0.84 0.00 0.00 61.79 61.10 2bmt h SER 10 Cb 0.00 0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.53 2bmt h SER 10 CO 0.00 0.01 -0.05 0.77 -1.14 0.00 0.00 176.83 176.42 2bmt h SER 11 N 0.31 -0.22 0.00 3.07 4.64 -1.90 0.34 113.55 119.80 2bmt h SER 11 Ca 0.65 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 62.05 2bmt h SER 11 Cb 1.78 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 64.03 2bmt h SER 11 CO -0.33 -0.07 0.00 0.00 -0.87 0.00 0.00 176.83 175.55 2bmt n GLN 12 N -5.22 0.54 -0.08 4.77 1.13 0.13 -3.14 117.38 115.51 2bmt n GLN 12 Ca -0.01 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.94 2bmt n GLN 12 Cb 0.16 -1.47 -0.08 0.00 0.11 0.00 0.00 30.24 28.95 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 0.00 -0.61 -0.35 0.00 6.55 -1.23 0.43 115.95 120.74 2bmt h TRP 14 Ca -0.38 0.07 -0.02 0.00 0.95 0.00 0.00 58.89 59.50 2bmt h TRP 14 Cb 1.62 0.38 -0.02 0.00 -0.86 0.00 0.00 29.16 30.28 2bmt h TRP 14 CO 0.02 -0.35 0.11 -1.00 -1.05 0.00 0.00 178.44 176.17 2bmt h PRO 15 N -0.06 0.50 0.80 0.49 0.13 -1.84 -0.27 132.00 131.75 2bmt h PRO 15 Ca 0.31 -0.07 -0.04 0.00 -0.87 0.00 0.00 66.00 65.34 2bmt h PRO 15 Cb 0.55 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.59 2bmt h PRO 15 CO -0.75 0.44 -0.38 0.28 -0.23 0.00 0.00 178.00 177.36 2bmt h VAL 16 N 0.49 0.00 -0.88 1.56 2.07 -0.54 0.14 116.25 119.08 2bmt h VAL 16 Ca 0.12 -0.21 0.23 0.00 0.82 0.00 0.00 66.70 67.66 2bmt h VAL 16 Cb 0.15 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.79 2bmt h VAL 16 CO -0.01 0.00 0.32 0.00 0.02 0.00 0.00 177.57 177.90 2bmt h LYS 18 N 0.30 1.10 -0.22 0.00 1.63 0.28 0.60 116.57 120.25 2bmt h LYS 18 Ca 0.56 -0.29 -0.10 0.00 -0.85 0.00 0.00 60.65 59.97 2bmt h LYS 18 Cb 1.11 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 32.61 2bmt h LYS 18 CO -0.59 1.00 -0.24 -0.22 -3.45 0.00 0.00 179.45 175.95 2bmt h LYS 19 N 1.02 0.55 0.18 1.90 1.63 0.16 -2.66 116.57 119.35 2bmt h LYS 19 Ca 0.20 -0.30 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 2bmt h LYS 19 Cb 0.44 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 2bmt h LYS 19 CO 0.01 0.89 -0.09 -0.07 -3.45 0.00 0.00 179.45 176.75 2bmt h LEU 20 N 0.24 -0.20 0.00 5.20 3.38 -0.87 -3.42 115.31 119.63 2bmt h LEU 20 Ca 0.03 -0.33 -0.37 0.00 0.09 0.00 0.00 57.88 57.30 2bmt h LEU 20 Cb 0.80 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.55 2bmt h LEU 20 CO 0.06 0.31 -2.29 0.49 0.09 0.00 0.00 178.44 177.10 2bmt n PHE 21 N -4.96 0.00 0.00 1.13 3.72 0.14 -5.02 117.46 112.47 2bmt n PHE 21 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 2bmt n PHE 21 Cb 0.26 -0.84 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 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 1.93 1.89 3.37 1.37 0.00 -0.79 -5.01 105.19 107.95 2bmt n GLY 22 Ca -0.43 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 2bmt n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bmt s THR 23 N -2.00 2.10 -0.23 2.61 2.01 -1.16 -4.86 115.64 114.12 2bmt s THR 23 Ca 0.00 -1.81 0.10 0.00 0.31 0.00 0.00 61.69 60.30 2bmt s THR 23 Cb 0.00 -1.91 0.22 0.00 0.01 0.00 0.00 72.50 70.82 2bmt s THR 23 CO 0.00 -0.05 1.15 0.00 -0.69 0.00 0.00 174.62 175.03 2bmt n TYR 24 N 0.69 0.22 -3.74 4.92 9.36 -1.26 0.12 117.16 127.47 2bmt n TYR 24 Ca -0.16 -0.71 -0.30 0.00 3.32 0.00 0.00 57.90 60.05 2bmt n TYR 24 Cb 0.54 -0.12 -0.10 0.00 -0.63 0.00 0.00 39.34 39.04 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 -0.61 2.18 -4.41 2.98 0.63 -1.26 -4.65 116.66 111.52 2bmt n ARG 25 Ca 0.10 -4.53 -0.20 0.00 -0.92 0.00 0.00 57.85 52.30 2bmt n ARG 25 Cb 0.50 -2.31 -0.10 0.00 0.45 0.00 0.00 32.46 30.99 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 -1.46 1.80 0.26 5.14 0.00 -1.26 -3.78 107.32 108.01 2bmt s GLY 26 Ca 0.28 -1.89 0.05 0.00 0.00 0.00 0.00 44.72 43.16 2bmt s GLY 26 CO -0.13 -1.79 -0.03 0.54 0.00 0.00 0.00 173.10 171.69 2bmt s LYS 27 N -3.79 1.46 -0.30 2.90 -0.14 0.71 -4.47 119.74 116.12 2bmt s LYS 27 Ca 0.30 -1.74 -0.05 0.00 -1.36 0.00 0.00 55.97 53.12 2bmt s LYS 27 Cb 0.05 -0.92 0.02 0.00 -1.68 0.00 0.00 37.83 35.31 2bmt s LYS 27 CO 0.12 -0.03 0.05 0.00 -0.76 0.00 0.00 175.35 174.72 2bmt s MET 29 N 1.41 0.61 -1.45 0.00 0.23 -0.27 -4.70 119.30 115.13 2bmt s MET 29 Ca 0.00 -0.69 -0.02 0.00 -1.03 0.00 0.00 55.69 53.95 2bmt s MET 29 Cb -0.18 -0.48 0.01 0.00 -1.53 0.00 0.00 34.83 32.65 2bmt s MET 29 CO 0.01 0.11 0.39 0.09 -2.03 0.00 0.00 175.02 173.58 2bmt n ASN 30 N 1.74 -0.39 -3.41 -1.18 4.13 -1.26 -0.33 115.26 114.57 2bmt n ASN 30 Ca -0.20 -1.04 -0.20 0.00 1.68 0.00 0.00 54.58 54.82 2bmt n ASN 30 Cb 0.55 -2.84 -0.03 0.00 -1.54 0.00 0.00 39.78 35.92 2bmt n ASN 30 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2bmt n SER 31 N -2.95 -1.54 -3.97 6.41 2.88 -1.26 -4.90 113.62 108.28 2bmt n SER 31 Ca -0.28 -0.29 -0.11 0.00 -1.33 0.00 0.00 58.87 56.86 2bmt n SER 31 Cb 0.67 -1.40 -0.12 0.00 -0.75 0.00 0.00 64.21 62.61 2bmt n SER 31 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2bmt s LYS 32 N -6.00 0.31 0.80 -1.46 1.02 0.55 -1.12 119.74 113.83 2bmt s LYS 32 Ca 0.38 -0.49 -0.11 0.00 0.02 0.00 0.00 55.97 55.77 2bmt s LYS 32 Cb -0.22 -0.04 0.07 0.00 -0.52 0.00 0.00 37.83 37.12 2bmt s LYS 32 CO 0.46 -0.01 1.09 0.00 -0.92 0.00 0.00 175.35 175.97 2bmt s ARG 34 N -5.01 0.34 0.30 0.00 3.52 0.29 -3.20 118.95 115.19 2bmt s ARG 34 Ca 0.61 -0.27 0.04 0.00 -0.13 0.00 0.00 55.73 55.98 2bmt s ARG 34 Cb -0.16 0.14 -0.06 0.00 -1.56 0.00 0.00 34.95 33.31 2bmt s ARG 34 CO 0.56 -0.07 0.02 0.00 -0.81 0.00 0.00 175.30 174.99 2bmt n TYR 36 N -0.61 0.00 0.00 0.00 4.01 -1.25 -4.49 117.16 114.82 2bmt n TYR 36 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 2bmt n TYR 36 Cb 0.65 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 2bmt n TYR 36 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83