#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 0.36 -0.16 4.37 -4.23 -1.18 -4.74 115.64 110.06 2bmt s THR 3 Ca 0.00 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.68 2bmt s THR 3 Cb 0.00 -2.49 0.44 0.00 1.34 0.00 0.00 72.50 71.79 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 -1.06 1.91 -4.39 3.99 2.85 -1.26 -4.73 115.26 112.56 2bmt n ASN 4 Ca 0.00 -3.04 -0.30 0.00 -0.11 0.00 0.00 54.58 51.14 2bmt n ASN 4 Cb 0.65 -0.42 -0.13 0.00 1.24 0.00 0.00 39.78 41.11 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 -2.42 2.33 0.39 3.44 -7.23 -1.26 -5.03 120.40 110.63 2bmt s VAL 5 Ca 0.37 -1.57 -0.25 0.00 -1.81 0.00 0.00 61.98 58.72 2bmt s VAL 5 Cb 0.38 -2.00 -0.09 0.00 0.56 0.00 0.00 36.38 35.23 2bmt s VAL 5 CO -0.08 0.20 1.16 -0.55 -0.31 0.00 0.00 175.10 175.51 2bmt s SER 6 N -1.76 6.61 0.19 4.85 0.15 -1.26 -1.79 113.70 120.70 2bmt s SER 6 Ca 0.14 2.32 0.05 0.00 0.70 0.00 0.00 55.95 59.16 2bmt s SER 6 Cb -0.10 -2.61 -0.05 0.00 -1.71 0.00 0.00 66.02 61.55 2bmt s SER 6 CO 0.05 -0.61 -0.09 0.00 1.20 0.00 0.00 173.24 173.79 2bmt n SER 8 N -0.33 1.88 0.00 0.00 2.88 -1.26 -4.63 113.62 112.16 2bmt n SER 8 Ca -0.08 -3.28 0.00 0.00 -1.33 0.00 0.00 58.87 54.18 2bmt n SER 8 Cb 0.62 -0.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 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 -0.62 0.00 -0.15 -1.46 0.00 -1.26 -4.79 120.51 112.24 2bmt n ALA 9 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.69 2bmt n ALA 9 Cb 0.85 0.00 0.39 0.00 0.00 0.00 0.00 19.45 20.69 2bmt n ALA 9 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2bmt h SER 10 N 0.00 0.59 -0.54 0.00 4.64 -1.89 -0.89 113.55 115.46 2bmt h SER 10 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.35 2bmt h SER 10 Cb 0.00 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 61.93 2bmt h SER 10 CO 0.00 0.38 0.32 0.28 -0.87 0.00 0.00 176.83 176.95 2bmt h SER 11 N 0.67 0.53 0.19 4.97 0.02 -1.91 -0.31 113.55 117.72 2bmt h SER 11 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2bmt h SER 11 Cb 0.30 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.73 2bmt h SER 11 CO -0.10 0.37 0.00 0.00 -1.14 0.00 0.00 176.83 175.96 2bmt n GLN 12 N -4.78 0.35 -0.09 3.45 1.13 -0.37 -3.21 117.38 113.86 2bmt n GLN 12 Ca 0.04 0.08 -0.13 0.00 -1.94 0.00 0.00 57.00 55.05 2bmt n GLN 12 Cb 0.08 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 28.84 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 -0.22 -0.57 0.00 6.55 -1.21 0.55 115.95 121.05 2bmt h TRP 14 Ca -0.42 0.06 0.01 0.00 0.95 0.00 0.00 58.89 59.48 2bmt h TRP 14 Cb 1.68 0.21 -0.03 0.00 -0.86 0.00 0.00 29.16 30.16 2bmt h TRP 14 CO 0.02 -0.27 0.38 -1.00 -1.05 0.00 0.00 178.44 176.51 2bmt h PRO 15 N 0.05 0.75 0.70 0.49 0.13 -1.83 0.87 132.00 133.14 2bmt h PRO 15 Ca 0.37 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.42 2bmt h PRO 15 Cb 0.61 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 31.58 2bmt h PRO 15 CO -0.69 0.49 -0.33 0.28 -0.23 0.00 0.00 178.00 177.51 2bmt h VAL 16 N 0.77 0.00 -1.04 1.56 2.07 -0.28 0.13 116.25 119.46 2bmt h VAL 16 Ca 0.21 -0.21 0.28 0.00 0.82 0.00 0.00 66.70 67.79 2bmt h VAL 16 Cb -0.09 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.56 2bmt h VAL 16 CO -0.04 0.00 0.63 0.00 0.02 0.00 0.00 177.57 178.17 2bmt h LYS 18 N 0.45 0.94 -0.21 0.00 1.63 0.29 0.27 116.57 119.95 2bmt h LYS 18 Ca 0.66 -0.43 -0.10 0.00 -0.85 0.00 0.00 60.65 59.93 2bmt h LYS 18 Cb 1.48 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 33.09 2bmt h LYS 18 CO -0.44 1.10 -0.24 -0.22 -3.45 0.00 0.00 179.45 176.19 2bmt h LYS 19 N 0.78 0.53 0.03 1.90 1.63 0.16 -2.52 116.57 119.08 2bmt h LYS 19 Ca 0.09 -0.29 -0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2bmt h LYS 19 Cb 0.84 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.49 2bmt h LYS 19 CO 0.07 0.88 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.88 2bmt h LEU 20 N 0.21 -0.03 0.00 5.20 3.38 -0.91 -3.41 115.31 119.75 2bmt h LEU 20 Ca 0.03 -0.52 -0.33 0.00 0.09 0.00 0.00 57.88 57.15 2bmt h LEU 20 Cb 0.81 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.51 2bmt h LEU 20 CO 0.06 0.52 -2.18 0.49 0.09 0.00 0.00 178.44 177.42 2bmt n PHE 21 N -4.84 0.00 0.00 1.13 3.01 0.04 -5.02 117.46 111.77 2bmt n PHE 21 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 2bmt n PHE 21 Cb 0.28 -0.78 0.00 0.00 -0.01 0.00 0.00 39.48 38.97 2bmt n PHE 21 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2bmt n GLY 22 N 2.13 1.36 3.31 1.37 0.00 -0.91 -5.02 105.19 107.43 2bmt n GLY 22 Ca -0.39 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.55 1.55 -0.36 2.61 -1.32 -1.18 -4.86 115.64 110.54 2bmt s THR 23 Ca 0.00 -2.09 0.07 0.00 -1.21 0.00 0.00 61.69 58.46 2bmt s THR 23 Cb 0.00 -1.91 0.59 0.00 -1.51 0.00 0.00 72.50 69.66 2bmt s THR 23 CO 0.00 -0.59 1.67 0.00 -2.21 0.00 0.00 174.62 173.49 2bmt n TYR 24 N -0.17 1.97 -3.89 9.09 9.36 -1.26 0.77 117.16 133.04 2bmt n TYR 24 Ca -0.10 -1.68 -0.30 0.00 3.32 0.00 0.00 57.90 59.14 2bmt n TYR 24 Cb 0.60 -0.69 -0.14 0.00 -0.63 0.00 0.00 39.34 38.48 2bmt n TYR 24 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2bmt s ARG 25 N -3.26 1.59 0.23 2.98 3.52 -1.26 -4.75 118.95 118.00 2bmt s ARG 25 Ca 0.50 -2.17 -0.11 0.00 -0.13 0.00 0.00 55.73 53.82 2bmt s ARG 25 Cb 0.44 -2.93 -0.01 0.00 -1.56 0.00 0.00 34.95 30.89 2bmt s ARG 25 CO 0.05 -1.08 0.41 0.20 -0.81 0.00 0.00 175.30 174.08 2bmt s GLY 26 N 0.29 0.67 0.20 8.12 0.00 -1.26 -3.17 107.32 112.17 2bmt s GLY 26 Ca 0.15 -1.00 0.04 0.00 0.00 0.00 0.00 44.72 43.91 2bmt s GLY 26 CO -0.04 -0.76 -0.04 0.54 0.00 0.00 0.00 173.10 172.80 2bmt s LYS 27 N -4.04 1.25 -0.26 2.90 -0.14 0.52 -4.57 119.74 115.40 2bmt s LYS 27 Ca 0.25 -1.60 -0.02 0.00 -1.36 0.00 0.00 55.97 53.24 2bmt s LYS 27 Cb 0.01 -0.66 0.03 0.00 -1.68 0.00 0.00 37.83 35.53 2bmt s LYS 27 CO 0.09 -0.02 -0.04 0.00 -0.76 0.00 0.00 175.35 174.62 2bmt s MET 29 N 1.32 0.39 -1.46 0.00 0.23 -0.37 -4.70 119.30 114.71 2bmt s MET 29 Ca -0.01 -0.59 -0.04 0.00 -1.03 0.00 0.00 55.69 54.03 2bmt s MET 29 Cb -0.17 -0.12 0.03 0.00 -1.53 0.00 0.00 34.83 33.03 2bmt s MET 29 CO -0.03 0.01 0.49 0.09 -2.03 0.00 0.00 175.02 173.55 2bmt n ASN 30 N 1.77 -0.92 -2.62 -1.18 4.13 -1.26 -0.47 115.26 114.71 2bmt n ASN 30 Ca -0.22 -1.01 -0.05 0.00 1.68 0.00 0.00 54.58 54.99 2bmt n ASN 30 Cb 0.55 -3.00 -0.01 0.00 -1.54 0.00 0.00 39.78 35.79 2bmt n ASN 30 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2bmt n SER 31 N -2.93 -1.55 -4.03 6.41 7.64 -1.26 -4.90 113.62 112.99 2bmt n SER 31 Ca -0.24 0.34 -0.19 0.00 1.01 0.00 0.00 58.87 59.80 2bmt n SER 31 Cb 0.65 -1.44 -0.15 0.00 -1.01 0.00 0.00 64.21 62.27 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 -5.15 0.75 0.83 1.43 -0.14 0.38 -1.25 119.74 116.60 2bmt s LYS 32 Ca 0.05 -0.36 -0.11 0.00 -1.36 0.00 0.00 55.97 54.19 2bmt s LYS 32 Cb -0.03 -0.72 0.09 0.00 -1.68 0.00 0.00 37.83 35.49 2bmt s LYS 32 CO 0.07 0.20 1.09 0.00 -0.76 0.00 0.00 175.35 175.94 2bmt s ARG 34 N -5.02 0.61 0.39 0.00 3.52 0.29 -3.10 118.95 115.65 2bmt s ARG 34 Ca 0.62 -0.40 0.03 0.00 -0.13 0.00 0.00 55.73 55.85 2bmt s ARG 34 Cb -0.16 0.26 -0.04 0.00 -1.56 0.00 0.00 34.95 33.45 2bmt s ARG 34 CO 0.56 -0.16 0.09 0.00 -0.81 0.00 0.00 175.30 174.97 2bmt n TYR 36 N -0.88 -0.46 0.00 0.00 4.01 -1.19 -4.44 117.16 114.20 2bmt n TYR 36 Ca -0.06 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 2bmt n TYR 36 Cb 0.66 0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.80 2bmt n TYR 36 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27