#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rps s VAL 2 N 0.00 0.07 -0.28 0.44 1.01 -1.26 -5.13 120.40 115.25 2rps s VAL 2 Ca 0.00 -0.58 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 2rps s VAL 2 Cb 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 36.38 35.41 2rps s VAL 2 CO 0.00 -0.32 1.11 -1.58 0.00 0.00 0.00 175.10 174.32 2rps s GLN 3 N -2.67 4.11 -0.37 2.72 0.74 -1.26 -4.91 119.66 118.03 2rps s GLN 3 Ca -0.04 1.22 0.06 0.00 0.05 0.00 0.00 55.36 56.65 2rps s GLN 3 Cb -0.00 -3.74 0.56 0.00 1.10 0.00 0.00 33.01 30.93 2rps s GLN 3 CO -0.04 -0.85 1.65 0.44 -0.55 0.00 0.00 175.29 175.94 2rps n ILE 4 N 5.74 2.84 -2.70 -2.34 -6.64 -1.26 -4.50 119.36 110.49 2rps n ILE 4 Ca 0.13 -2.51 -0.05 0.00 -1.77 0.00 0.00 62.75 58.54 2rps n ILE 4 Cb 0.47 -0.43 0.09 0.00 -1.44 0.00 0.00 39.64 38.33 2rps n ILE 4 CO 0.00 0.00 0.00 -0.11 -1.77 0.00 0.00 176.55 174.67 2rps n LEU 5 N -1.12 -0.61 -4.89 7.28 0.00 -1.26 -5.13 117.00 111.27 2rps n LEU 5 Ca 0.45 -3.38 -0.29 0.00 0.00 0.00 0.00 56.01 52.79 2rps n LEU 5 Cb 1.25 0.19 0.00 0.00 0.00 0.00 0.00 43.42 44.87 2rps n LEU 5 CO 0.37 1.65 0.56 -0.60 0.00 0.00 0.00 177.39 179.38 2rps s ARG 6 N -1.07 3.58 -0.46 1.96 3.52 -1.26 -5.05 118.95 120.18 2rps s ARG 6 Ca 0.20 0.44 0.08 0.00 -0.13 0.00 0.00 55.73 56.33 2rps s ARG 6 Cb 0.41 -2.25 0.29 0.00 -1.56 0.00 0.00 34.95 31.84 2rps s ARG 6 CO -0.07 -0.35 0.67 0.00 -0.81 0.00 0.00 175.30 174.74 2rps n PRO 8 N 0.81 -0.79 -1.56 0.00 -0.02 -1.26 -4.43 135.00 127.75 2rps n PRO 8 Ca 0.25 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.32 2rps n PRO 8 Cb 0.52 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.97 2rps n PRO 8 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2rps n ASP 9 N -2.07 2.73 0.00 2.55 8.00 -1.26 -2.21 116.55 124.29 2rps n ASP 9 Ca 0.00 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.47 2rps n ASP 9 Cb 0.00 -1.52 0.00 0.00 -0.02 0.00 0.00 41.12 39.58 2rps n ASP 9 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rps n GLY 10 N 5.96 1.32 3.35 0.44 0.00 -1.26 -5.10 105.19 109.90 2rps n GLY 10 Ca 0.35 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.98 2rps n GLY 10 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2rps s MET 11 N 0.00 2.87 -0.09 1.61 -1.94 -0.94 -1.01 119.30 119.80 2rps s MET 11 Ca 0.00 -1.03 -0.26 0.00 -1.71 0.00 0.00 55.69 52.70 2rps s MET 11 Cb 0.00 -3.57 -0.03 0.00 2.01 0.00 0.00 34.83 33.25 2rps s MET 11 CO 0.00 -0.61 0.81 -1.14 -0.01 0.00 0.00 175.02 174.07 2rps s GLN 12 N 1.51 4.41 0.20 2.03 0.74 -0.46 -4.76 119.66 123.32 2rps s GLN 12 Ca 0.01 1.05 -0.30 0.00 0.05 0.00 0.00 55.36 56.17 2rps s GLN 12 Cb -0.19 -3.50 -0.08 0.00 1.10 0.00 0.00 33.01 30.35 2rps s GLN 12 CO 0.05 -0.11 1.05 -1.64 -0.55 0.00 0.00 175.29 174.09 2rps s MET 13 N 1.36 4.66 0.35 1.67 -1.94 -1.26 -0.06 119.30 124.09 2rps s MET 13 Ca 0.41 1.65 0.03 0.00 -1.71 0.00 0.00 55.69 56.08 2rps s MET 13 Cb -0.18 -3.28 -0.02 0.00 2.01 0.00 0.00 34.83 33.37 2rps s MET 13 CO 0.18 0.20 0.52 -0.51 -0.01 0.00 0.00 175.02 175.40 2rps s LEU 14 N -0.64 3.95 0.50 -0.03 1.43 0.90 -4.92 118.68 119.87 2rps s LEU 14 Ca 0.47 0.13 0.15 0.00 -1.03 0.00 0.00 54.13 53.85 2rps s LEU 14 Cb -0.28 -3.00 1.20 0.00 0.03 0.00 0.00 46.19 44.13 2rps s LEU 14 CO 0.35 -0.41 2.10 0.08 0.23 0.00 0.00 176.35 178.69 2rps h ARG 15 N 0.77 0.13 0.01 1.70 0.11 -1.97 -1.11 114.38 114.01 2rps h ARG 15 Ca -0.48 -0.01 -0.19 0.00 0.10 0.00 0.00 59.98 59.40 2rps h ARG 15 Cb 1.24 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.28 2rps h ARG 15 CO 0.57 0.08 -0.88 0.77 0.10 0.00 0.00 179.97 180.62 2rps h SER 16 N 0.13 0.13 0.00 0.08 0.02 -2.03 -3.47 113.55 108.41 2rps h SER 16 Ca 0.08 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2rps h SER 16 Cb 0.16 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2rps h SER 16 CO -0.01 0.94 0.00 0.61 -1.14 0.00 0.00 176.83 177.23 2rps n GLY 17 N 0.92 1.16 3.40 -3.77 0.00 -0.42 -5.13 105.19 101.35 2rps n GLY 17 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2rps n GLY 17 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2rps n GLN 18 N 0.00 -3.09 -4.09 1.61 7.27 -1.26 -4.45 117.38 113.37 2rps n GLN 18 Ca 0.00 -0.89 -0.28 0.00 0.07 0.00 0.00 57.00 55.91 2rps n GLN 18 Cb 0.00 -2.09 -0.17 0.00 2.41 0.00 0.00 30.24 30.39 2rps n GLN 18 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2rps s VAL 20 N 1.43 5.30 0.38 0.00 1.01 0.92 -4.84 120.40 124.60 2rps s VAL 20 Ca 0.01 0.07 -0.27 0.00 0.00 0.00 0.00 61.98 61.79 2rps s VAL 20 Cb -0.13 -3.58 -0.10 0.00 0.00 0.00 0.00 36.38 32.57 2rps s VAL 20 CO -0.07 0.18 1.41 0.00 0.00 0.00 0.00 175.10 176.62 2rps s ALA 21 N 1.75 3.45 -1.06 5.51 0.00 -1.26 -1.36 121.76 128.79 2rps s ALA 21 Ca 0.07 1.44 -0.07 0.00 0.00 0.00 0.00 51.96 53.40 2rps s ALA 21 Cb -0.16 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.39 2rps s ALA 21 CO 0.11 -0.96 2.81 -2.37 0.00 0.00 0.00 175.76 175.35 2rps n THR 22 N 0.36 4.31 -1.63 0.00 5.66 -0.18 -4.41 114.28 118.40 2rps n THR 22 Ca 0.02 -3.17 -0.01 0.00 -3.05 0.00 0.00 64.05 57.84 2rps n THR 22 Cb 0.41 -2.14 0.18 0.00 -1.55 0.00 0.00 70.33 67.23 2rps n THR 22 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2rps n THR 23 N 2.23 2.35 -0.08 1.09 -2.24 -1.26 -4.77 114.28 111.60 2rps n THR 23 Ca 0.62 -3.28 -0.11 0.00 -2.27 0.00 0.00 64.05 59.01 2rps n THR 23 Cb 0.39 -0.39 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 2rps n THR 23 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2rps h GLU 24 N 1.18 0.38 -5.54 -0.78 3.07 -2.00 -3.42 114.58 107.46 2rps h GLU 24 Ca 0.11 -0.09 -0.57 0.00 -0.50 0.00 0.00 59.36 58.31 2rps h GLU 24 Cb 1.21 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 29.03 2rps h GLU 24 CO 0.21 0.48 1.59 -2.30 -1.40 0.00 0.00 179.01 177.59 2rps n PRO 25 N -4.74 0.56 0.00 2.33 -0.02 -1.26 -4.92 135.00 126.95 2rps n PRO 25 Ca -0.03 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2rps n PRO 25 Cb 0.17 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 2rps n PRO 25 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2rps n PRO 26 N 8.43 1.02 -2.96 0.52 -0.02 -1.26 -4.89 135.00 135.84 2rps n PRO 26 Ca 0.51 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 2rps n PRO 26 Cb 0.21 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.63 2rps n PRO 26 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2rps s PHE 27 N -0.06 3.13 0.08 6.00 5.36 -1.26 -4.96 117.98 126.27 2rps s PHE 27 Ca 0.00 0.59 -0.27 0.00 -0.96 0.00 0.00 56.93 56.28 2rps s PHE 27 Cb 0.00 -3.36 -0.17 0.00 -0.34 0.00 0.00 43.02 39.15 2rps s PHE 27 CO 0.00 -0.70 1.69 0.22 -1.46 0.00 0.00 175.22 174.97 2rps h ASP 28 N 8.42 -0.35 -0.42 6.13 3.58 -2.03 -3.40 116.42 128.36 2rps h ASP 28 Ca -0.25 0.01 -0.25 0.00 0.42 0.00 0.00 57.03 56.96 2rps h ASP 28 Cb 1.09 0.09 -0.05 0.00 1.72 0.00 0.00 39.33 42.19 2rps h ASP 28 CO 0.90 -0.25 1.13 -2.65 -2.88 0.00 0.00 179.24 175.49 2rps n PRO 29 N -5.27 0.41 0.01 0.28 -0.02 -1.26 -4.72 135.00 124.44 2rps n PRO 29 Ca -0.10 -0.34 -0.12 0.00 -2.02 0.00 0.00 63.50 60.92 2rps n PRO 29 Cb 0.18 -2.58 -0.14 0.00 -0.02 0.00 0.00 33.50 30.95 2rps n PRO 29 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2rps h ASP 30 N 13.37 0.16 0.00 2.55 2.03 -2.04 -3.43 116.42 129.06 2rps h ASP 30 Ca -0.04 -0.28 -0.06 0.00 -0.73 0.00 0.00 57.03 55.92 2rps h ASP 30 Cb 1.13 -0.05 -0.06 0.00 -0.83 0.00 0.00 39.33 39.52 2rps h ASP 30 CO 1.27 1.24 -0.11 -1.20 -1.03 0.00 0.00 179.24 179.41 2rps n SER 31 N -3.25 -0.51 0.00 4.15 7.64 -1.26 -5.25 113.62 115.14 2rps n SER 31 Ca -0.17 -1.20 0.00 0.00 1.01 0.00 0.00 58.87 58.52 2rps n SER 31 Cb 1.03 0.21 0.00 0.00 -1.01 0.00 0.00 64.21 64.44 2rps n SER 31 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03