#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9g s SER 2 N 0.00 1.69 -1.57 1.61 0.15 -1.26 -4.77 113.70 109.54 2d9g s SER 2 Ca 0.00 -0.27 -0.15 0.00 0.70 0.00 0.00 55.95 56.23 2d9g s SER 2 Cb 0.00 -0.55 0.10 0.00 -1.71 0.00 0.00 66.02 63.86 2d9g s SER 2 CO 0.00 0.09 0.95 -1.54 1.20 0.00 0.00 173.24 173.94 2d9g n SER 3 N 3.39 -4.57 -4.07 5.45 3.41 -1.26 -2.21 113.62 113.76 2d9g n SER 3 Ca -0.20 -0.82 -0.43 0.00 -0.26 0.00 0.00 58.87 57.17 2d9g n SER 3 Cb 0.53 -3.67 0.00 0.00 -0.26 0.00 0.00 64.21 60.82 2d9g n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9g n GLY 4 N -1.64 -0.73 0.12 5.00 0.00 -1.26 -4.87 105.19 101.81 2d9g n GLY 4 Ca 0.05 0.32 -0.21 0.00 0.00 0.00 0.00 46.02 46.18 2d9g n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d9g h SER 5 N -2.43 0.51 -0.01 1.61 4.64 -1.81 -3.37 113.55 112.69 2d9g h SER 5 Ca -0.70 -0.94 -0.06 0.00 -0.47 0.00 0.00 61.79 59.62 2d9g h SER 5 Cb 1.40 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2d9g h SER 5 CO 0.55 1.46 -0.22 0.77 -0.87 0.00 0.00 176.83 178.51 2d9g h SER 6 N -0.30 0.22 -0.03 4.97 4.64 -1.89 -3.50 113.55 117.67 2d9g h SER 6 Ca -0.17 -0.74 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 2d9g h SER 6 Cb 1.73 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 2d9g h SER 6 CO 0.16 0.92 0.00 0.61 -0.87 0.00 0.00 176.83 177.65 2d9g n GLY 7 N 0.93 1.77 3.63 -0.77 0.00 -1.26 -5.19 105.19 104.30 2d9g n GLY 7 Ca -0.09 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 44.96 2d9g n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2d9g s ASP 8 N 1.83 3.53 -0.12 1.61 1.47 -1.26 -4.52 116.67 119.21 2d9g s ASP 8 Ca 0.00 -1.54 -0.19 0.00 1.18 0.00 0.00 52.55 52.00 2d9g s ASP 8 Cb 0.00 0.19 -0.04 0.00 -0.34 0.00 0.00 42.92 42.73 2d9g s ASP 8 CO 0.00 -0.73 0.51 -1.61 0.68 0.00 0.00 175.17 174.03 2d9g s GLU 9 N -3.80 4.33 0.00 2.11 2.02 -1.26 -4.52 118.70 117.58 2d9g s GLU 9 Ca 0.21 0.51 0.00 0.00 0.02 0.00 0.00 54.97 55.71 2d9g s GLU 9 Cb 0.05 -3.45 0.00 0.00 0.10 0.00 0.00 34.13 30.83 2d9g s GLU 9 CO 0.11 0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.90 2d9g n GLY 10 N 3.33 2.02 3.67 -1.39 0.00 -1.26 -5.04 105.19 106.52 2d9g n GLY 10 Ca -0.06 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 2d9g n GLY 10 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2d9g n TYR 11 N 0.00 2.07 -4.97 1.61 4.11 -1.26 -3.94 117.16 114.77 2d9g n TYR 11 Ca 0.00 0.57 -0.32 0.00 -0.00 0.00 0.00 57.90 58.14 2d9g n TYR 11 Cb 0.00 -2.39 -0.15 0.00 -0.00 0.00 0.00 39.34 36.80 2d9g n TYR 11 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.86 178.53 2d9g s TRP 12 N -0.93 2.65 -0.38 -3.48 1.48 -1.24 -4.87 118.94 112.17 2d9g s TRP 12 Ca 0.58 -0.49 -0.27 0.00 -1.06 0.00 0.00 56.10 54.86 2d9g s TRP 12 Cb -0.61 -1.69 0.02 0.00 -1.16 0.00 0.00 33.47 30.03 2d9g s TRP 12 CO 0.60 -0.07 0.98 0.16 -4.06 0.00 0.00 176.95 174.56 2d9g s ASP 13 N -0.21 6.71 0.97 -2.66 -4.77 -1.26 -3.24 116.67 112.21 2d9g s ASP 13 Ca -0.00 0.62 -0.11 0.00 -3.30 0.00 0.00 52.55 49.76 2d9g s ASP 13 Cb -0.13 -2.49 0.17 0.00 -1.09 0.00 0.00 42.92 39.37 2d9g s ASP 13 CO 0.03 -0.92 1.05 0.00 0.70 0.00 0.00 175.17 176.04 2d9g n SER 15 N -4.13 3.66 0.39 0.00 2.88 -1.26 -3.69 113.62 111.46 2d9g n SER 15 Ca 0.10 -0.01 -0.15 0.00 -1.33 0.00 0.00 58.87 57.47 2d9g n SER 15 Cb 0.53 0.41 -0.07 0.00 -0.75 0.00 0.00 64.21 64.32 2d9g n SER 15 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2d9g h VAL 16 N 0.00 0.00 -0.20 2.46 2.07 -1.95 -3.33 116.25 115.30 2d9g h VAL 16 Ca -0.14 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2d9g h VAL 16 Cb 1.29 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2d9g h VAL 16 CO -0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 2d9g n THR 18 N 0.66 -1.10 -3.21 0.00 -2.24 -1.24 -4.94 114.28 102.20 2d9g n THR 18 Ca 0.10 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.50 2d9g n THR 18 Cb 0.38 -2.25 -0.06 0.00 -2.10 0.00 0.00 70.33 66.29 2d9g n THR 18 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2d9g s PHE 19 N -2.90 3.77 -0.37 4.78 5.36 -1.26 -4.71 117.98 122.66 2d9g s PHE 19 Ca 0.23 1.32 -0.28 0.00 -0.96 0.00 0.00 56.93 57.24 2d9g s PHE 19 Cb -0.12 -2.54 0.02 0.00 -0.34 0.00 0.00 43.02 40.04 2d9g s PHE 19 CO 0.28 0.52 1.06 0.50 -1.46 0.00 0.00 175.22 176.12 2d9g s ARG 20 N -1.35 3.93 0.54 10.12 3.52 -1.26 -2.27 118.95 132.17 2d9g s ARG 20 Ca 0.33 0.84 0.06 0.00 -0.13 0.00 0.00 55.73 56.83 2d9g s ARG 20 Cb -0.19 -3.79 0.04 0.00 -1.56 0.00 0.00 34.95 29.45 2d9g s ARG 20 CO 0.20 -1.03 0.45 -0.80 -0.81 0.00 0.00 175.30 173.31 2d9g s ASN 21 N 1.90 4.71 0.01 -2.12 0.01 -1.20 -5.01 114.94 113.25 2d9g s ASN 21 Ca 0.44 -1.17 0.01 0.00 -0.71 0.00 0.00 52.86 51.44 2d9g s ASN 21 Cb -0.11 0.34 -0.04 0.00 0.41 0.00 0.00 41.25 41.86 2d9g s ASN 21 CO 0.20 -1.11 0.02 -0.94 -1.51 0.00 0.00 177.10 173.77 2d9g s SER 22 N -4.32 5.25 0.25 -1.22 1.04 -1.26 -3.71 113.70 109.73 2d9g s SER 22 Ca 0.38 0.01 -0.05 0.00 0.48 0.00 0.00 55.95 56.78 2d9g s SER 22 Cb -0.03 -1.40 0.48 0.00 0.10 0.00 0.00 66.02 65.18 2d9g s SER 22 CO 0.24 0.26 1.67 0.00 0.98 0.00 0.00 173.24 176.39 2d9g h ALA 23 N 4.14 0.95 -0.77 5.32 0.00 -1.90 0.67 119.26 127.68 2d9g h ALA 23 Ca -0.49 0.19 0.15 0.00 0.00 0.00 0.00 54.91 54.76 2d9g h ALA 23 Cb 1.18 0.27 -0.10 0.00 0.00 0.00 0.00 17.79 19.14 2d9g h ALA 23 CO 0.59 -0.37 0.31 0.93 0.00 0.00 0.00 179.25 180.71 2d9g h GLU 24 N 0.23 0.43 -6.27 0.00 3.07 -1.95 -3.39 114.58 106.70 2d9g h GLU 24 Ca 0.43 -0.03 -0.55 0.00 -0.50 0.00 0.00 59.36 58.71 2d9g h GLU 24 Cb 0.75 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.55 2d9g h GLU 24 CO -0.55 0.28 0.91 0.00 -1.40 0.00 0.00 179.01 178.25 2d9g s ALA 25 N -6.01 3.61 0.04 3.43 0.00 0.23 -4.92 121.76 118.14 2d9g s ALA 25 Ca -0.12 0.74 -0.18 0.00 0.00 0.00 0.00 51.96 52.40 2d9g s ALA 25 Cb 0.21 -3.64 -0.18 0.00 0.00 0.00 0.00 23.12 19.51 2d9g s ALA 25 CO 0.76 -1.11 1.23 0.74 0.00 0.00 0.00 175.76 177.38 2d9g h PHE 26 N 8.37 0.67 -0.80 0.00 0.04 -1.82 -3.44 116.94 119.98 2d9g h PHE 26 Ca -0.34 -0.29 -0.55 0.00 2.80 0.00 0.00 57.97 59.59 2d9g h PHE 26 Cb 1.15 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 39.17 2d9g h PHE 26 CO 0.80 1.07 -0.28 -1.59 -0.60 0.00 0.00 178.31 177.71 2d9g s LYS 27 N -3.69 2.31 0.74 1.51 0.00 -1.26 -4.37 119.74 114.98 2d9g s LYS 27 Ca -0.13 -1.86 -0.11 0.00 0.00 0.00 0.00 55.97 53.87 2d9g s LYS 27 Cb 0.05 -2.25 0.03 0.00 0.00 0.00 0.00 37.83 35.66 2d9g s LYS 27 CO 0.82 -0.58 1.08 0.00 0.00 0.00 0.00 175.35 176.67 2d9g n MET 29 N -3.21 1.54 -0.04 0.00 1.56 -1.26 -3.55 117.12 112.15 2d9g n MET 29 Ca 0.07 0.01 -0.01 0.00 -0.27 0.00 0.00 57.70 57.50 2d9g n MET 29 Cb 0.55 -1.35 -0.00 0.00 2.15 0.00 0.00 33.22 34.57 2d9g n MET 29 CO 0.00 0.00 0.00 1.98 -0.73 0.00 0.00 175.97 177.22 2d9g h MET 30 N 0.00 0.00 0.00 2.12 1.85 -1.96 -3.38 114.93 113.56 2d9g h MET 30 Ca -0.38 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.71 2d9g h MET 30 Cb 1.81 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.84 2d9g h MET 30 CO 0.01 0.00 -0.47 0.00 -0.40 0.00 0.00 176.91 176.04 2d9g n ASP 32 N -2.53 -3.36 -4.58 0.00 2.03 -1.23 -4.97 116.55 101.89 2d9g n ASP 32 Ca 0.03 -0.80 -0.32 0.00 0.52 0.00 0.00 54.79 54.21 2d9g n ASP 32 Cb 0.49 -3.90 -0.11 0.00 -0.72 0.00 0.00 41.12 36.89 2d9g n ASP 32 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2d9g s VAL 33 N -3.46 3.59 0.51 5.18 1.01 -1.26 -4.77 120.40 121.20 2d9g s VAL 33 Ca 0.41 -0.77 -0.21 0.00 0.00 0.00 0.00 61.98 61.41 2d9g s VAL 33 Cb -0.21 -2.54 -0.08 0.00 0.00 0.00 0.00 36.38 33.55 2d9g s VAL 33 CO 0.83 0.42 0.84 -2.11 0.00 0.00 0.00 175.10 175.07 2d9g n ARG 34 N 1.64 0.94 -0.06 2.72 0.00 -1.26 -3.01 116.66 117.63 2d9g n ARG 34 Ca -0.16 0.35 -0.07 0.00 -0.00 0.00 0.00 57.85 57.97 2d9g n ARG 34 Cb 0.53 -1.95 -0.07 0.00 -0.00 0.00 0.00 32.46 30.96 2d9g n ARG 34 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 2d9g n LYS 35 N -0.22 1.29 -1.04 2.89 2.85 -1.26 -4.91 118.16 117.76 2d9g n LYS 35 Ca 0.11 0.04 -0.34 0.00 -1.05 0.00 0.00 58.31 57.07 2d9g n LYS 35 Cb 0.44 -1.27 -0.00 0.00 -0.65 0.00 0.00 35.03 33.54 2d9g n LYS 35 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2d9g n GLY 36 N 2.60 -2.08 0.35 2.58 0.00 -1.26 -4.81 105.19 102.56 2d9g n GLY 36 Ca -0.21 0.02 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 2d9g n GLY 36 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2d9g h THR 37 N 0.32 1.23 -3.45 2.61 1.35 -2.03 -3.43 112.91 109.51 2d9g h THR 37 Ca -0.28 -0.54 -0.22 0.00 -0.55 0.00 0.00 66.41 64.81 2d9g h THR 37 Cb 1.15 0.15 -0.28 0.00 -1.73 0.00 0.00 68.15 67.44 2d9g h THR 37 CO 0.38 0.25 -0.61 -0.44 -0.25 0.00 0.00 175.52 174.85 2d9g s SER 38 N -6.34 -0.09 -0.30 5.36 0.01 -1.26 -5.13 113.70 105.94 2d9g s SER 38 Ca -0.11 0.21 -0.18 0.00 1.31 0.00 0.00 55.95 57.17 2d9g s SER 38 Cb 0.17 0.18 -0.02 0.00 0.21 0.00 0.00 66.02 66.57 2d9g s SER 38 CO 0.80 -0.06 0.52 -0.89 0.41 0.00 0.00 173.24 174.03 2d9g s THR 39 N 0.33 5.04 0.22 1.44 2.01 -1.26 -5.04 115.64 118.37 2d9g s THR 39 Ca -0.02 0.68 -0.30 0.00 0.31 0.00 0.00 61.69 62.35 2d9g s THR 39 Cb -0.03 -3.89 -0.09 0.00 0.01 0.00 0.00 72.50 68.49 2d9g s THR 39 CO -0.01 -0.05 1.35 -0.60 -0.69 0.00 0.00 174.62 174.62 2d9g s ARG 40 N 2.38 4.35 -0.21 4.92 3.52 -1.26 -5.01 118.95 127.64 2d9g s ARG 40 Ca 0.21 2.13 -0.08 0.00 -0.13 0.00 0.00 55.73 57.85 2d9g s ARG 40 Cb -0.15 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.03 2d9g s ARG 40 CO 0.11 -0.30 0.10 0.15 -0.81 0.00 0.00 175.30 174.55 2d9g s LYS 41 N -0.23 3.96 0.50 5.12 -0.14 -1.26 -5.09 119.74 122.60 2d9g s LYS 41 Ca 0.57 -0.34 -0.21 0.00 -1.36 0.00 0.00 55.97 54.63 2d9g s LYS 41 Cb -0.38 -3.34 -0.07 0.00 -1.68 0.00 0.00 37.83 32.36 2d9g s LYS 41 CO 0.40 0.13 1.15 -1.25 -0.76 0.00 0.00 175.35 175.01 2d9g s PRO 42 N 0.80 3.56 0.13 -1.68 0.04 -1.26 -4.97 135.00 131.61 2d9g s PRO 42 Ca 0.05 1.69 -0.31 0.00 0.04 0.00 0.00 61.00 62.47 2d9g s PRO 42 Cb -0.13 -2.21 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 2d9g s PRO 42 CO 0.02 -0.70 1.46 0.50 0.04 0.00 0.00 177.00 178.32 2d9g s ARG 43 N -2.99 4.28 0.51 4.56 6.06 -1.26 -4.90 118.95 125.21 2d9g s ARG 43 Ca 0.68 2.17 0.30 0.00 -2.50 0.00 0.00 55.73 56.38 2d9g s ARG 43 Cb -0.26 -3.24 1.24 0.00 0.06 0.00 0.00 34.95 32.75 2d9g s ARG 43 CO 0.31 -0.51 1.95 -1.00 -2.50 0.00 0.00 175.30 173.55 2d9g h PRO 44 N 6.88 0.00 0.09 5.12 0.13 -2.01 -3.15 132.00 139.07 2d9g h PRO 44 Ca -0.42 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.35 2d9g h PRO 44 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2d9g h PRO 44 CO 0.88 0.10 -2.03 1.33 -0.23 0.00 0.00 178.00 178.05 2d9g n VAL 45 N -3.27 1.72 -1.85 1.56 0.24 -1.26 -4.60 118.33 110.87 2d9g n VAL 45 Ca 0.00 -0.67 -0.37 0.00 -2.04 0.00 0.00 64.34 61.26 2d9g n VAL 45 Cb 0.34 -1.60 0.05 0.00 -1.47 0.00 0.00 33.84 31.16 2d9g n VAL 45 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2d9g s SER 46 N -6.85 4.96 -0.31 -1.34 0.15 -1.19 -2.40 113.70 106.73 2d9g s SER 46 Ca -0.22 2.57 -0.04 0.00 0.70 0.00 0.00 55.95 58.96 2d9g s SER 46 Cb 0.07 -2.62 0.04 0.00 -1.71 0.00 0.00 66.02 61.80 2d9g s SER 46 CO 0.76 -1.76 0.10 0.00 1.20 0.00 0.00 173.24 173.54 2d9g n GLN 47 N -1.59 -2.26 -4.18 5.44 10.64 -1.26 -4.82 117.38 119.35 2d9g n GLN 47 Ca 0.14 0.02 -0.11 0.00 -1.83 0.00 0.00 57.00 55.22 2d9g n GLN 47 Cb 0.48 -3.73 -0.10 0.00 -0.86 0.00 0.00 30.24 26.03 2d9g n GLN 47 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2d9g s SER 48 N -1.88 0.34 0.00 2.61 0.15 -1.01 -5.07 113.70 108.84 2d9g s SER 48 Ca 0.14 -1.27 0.00 0.00 0.70 0.00 0.00 55.95 55.52 2d9g s SER 48 Cb -0.08 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 2d9g s SER 48 CO 0.17 -0.75 0.00 0.61 1.20 0.00 0.00 173.24 174.47 2d9g n GLY 49 N -0.17 3.55 3.69 9.45 0.00 -1.26 -4.88 105.19 115.57 2d9g n GLY 49 Ca -0.03 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2d9g n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9g s PRO 50 N -3.77 4.28 -1.35 1.61 0.04 -1.26 -3.02 135.00 131.53 2d9g s PRO 50 Ca 0.00 2.03 -0.08 0.00 0.04 0.00 0.00 61.00 62.98 2d9g s PRO 50 Cb 0.00 -3.51 0.01 0.00 0.04 0.00 0.00 34.50 31.05 2d9g s PRO 50 CO 0.00 -0.56 1.14 0.43 0.04 0.00 0.00 177.00 178.05 2d9g n SER 51 N 5.09 -5.68 -4.27 6.66 7.64 -1.26 -4.99 113.62 116.81 2d9g n SER 51 Ca 0.13 -0.57 -0.32 0.00 1.01 0.00 0.00 58.87 59.12 2d9g n SER 51 Cb 0.43 -4.94 -0.16 0.00 -1.01 0.00 0.00 64.21 58.52 2d9g n SER 51 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2d9g s SER 52 N -3.46 3.32 0.00 6.43 1.04 -1.17 -5.23 113.70 114.64 2d9g s SER 52 Ca 0.52 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2d9g s SER 52 Cb -0.23 -1.36 0.00 0.00 0.10 0.00 0.00 66.02 64.53 2d9g s SER 52 CO 0.74 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.75