#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x32 n SER 2 N 0.00 -0.19 0.00 1.61 2.88 -1.26 -5.16 113.62 111.50 1x32 n SER 2 Ca 0.00 -1.12 0.00 0.00 -1.33 0.00 0.00 58.87 56.42 1x32 n SER 2 Cb 0.00 0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1x32 n SER 2 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x32 n GLY 3 N -0.20 -0.71 2.05 0.46 0.00 -1.26 -4.86 105.19 100.68 1x32 n GLY 3 Ca -0.02 -2.25 -0.12 0.00 0.00 0.00 0.00 46.02 43.63 1x32 n GLY 3 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1x32 n GLU 4 N -0.40 -1.48 -0.01 1.61 2.13 -1.26 -4.74 120.64 116.49 1x32 n GLU 4 Ca 0.00 0.69 0.08 0.00 0.66 0.00 0.00 57.16 58.60 1x32 n GLU 4 Cb 0.00 -5.00 -0.12 0.00 0.27 0.00 0.00 31.44 26.59 1x32 n GLU 4 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1x32 n VAL 5 N -2.16 0.00 -3.04 6.31 0.31 -1.26 -4.66 118.33 113.84 1x32 n VAL 5 Ca -0.13 -0.31 -0.05 0.00 -0.01 0.00 0.00 64.34 63.84 1x32 n VAL 5 Cb 0.45 0.37 0.03 0.00 -0.91 0.00 0.00 33.84 33.77 1x32 n VAL 5 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1x32 n ASN 6 N -1.89 -7.05 0.00 4.52 2.85 -1.23 -4.95 115.26 107.51 1x32 n ASN 6 Ca -0.01 -0.30 0.00 0.00 -0.11 0.00 0.00 54.58 54.16 1x32 n ASN 6 Cb 0.39 -5.02 0.00 0.00 1.24 0.00 0.00 39.78 36.39 1x32 n ASN 6 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1x32 n LYS 7 N -2.26 0.00 -1.52 1.20 2.85 -1.26 -4.80 118.16 112.37 1x32 n LYS 7 Ca -0.03 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.87 1x32 n LYS 7 Cb 0.54 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.81 1x32 n LYS 7 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 1x32 n ILE 8 N 0.00 -0.03 -3.98 0.58 0.00 -1.26 -4.73 119.36 109.94 1x32 n ILE 8 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 62.75 62.33 1x32 n ILE 8 Cb 0.00 -1.29 -0.05 0.00 0.00 0.00 0.00 39.64 38.30 1x32 n ILE 8 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1x32 s ILE 9 N 9.62 0.00 0.28 9.51 1.10 -1.26 -5.01 121.20 135.44 1x32 s ILE 9 Ca 1.21 -1.36 0.03 0.00 -0.51 0.00 0.00 60.65 60.02 1x32 s ILE 9 Cb -0.81 -2.18 -0.06 0.00 0.15 0.00 0.00 42.46 39.56 1x32 s ILE 9 CO 0.40 0.00 0.05 -0.83 -2.11 0.00 0.00 174.94 172.45 1x32 s GLY 10 N -3.01 1.82 -0.27 1.50 0.00 -1.26 -4.89 107.32 101.22 1x32 s GLY 10 Ca 0.21 -1.92 -0.01 0.00 0.00 0.00 0.00 44.72 43.00 1x32 s GLY 10 CO 0.09 -1.71 0.31 -1.35 0.00 0.00 0.00 173.10 170.44 1x32 s SER 11 N -3.38 1.19 -0.29 1.64 1.04 -1.26 -1.10 113.70 111.53 1x32 s SER 11 Ca 0.34 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 56.39 1x32 s SER 11 Cb 0.07 0.68 0.20 0.00 0.10 0.00 0.00 66.02 67.07 1x32 s SER 11 CO 0.13 -0.36 0.59 -0.60 0.98 0.00 0.00 173.24 173.98 1x32 s ARG 12 N 2.41 0.56 0.00 4.02 3.52 -1.25 -4.62 118.95 123.59 1x32 s ARG 12 Ca 0.10 0.62 0.00 0.00 -0.13 0.00 0.00 55.73 56.32 1x32 s ARG 12 Cb -0.14 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.54 1x32 s ARG 12 CO -0.26 -0.98 0.00 2.41 -0.81 0.00 0.00 175.30 175.66 1x32 n THR 13 N 5.42 0.00 0.12 4.11 -1.04 -1.21 -4.72 114.28 116.95 1x32 n THR 13 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1x32 n THR 13 Cb 0.54 -0.37 0.00 0.00 -1.82 0.00 0.00 70.33 68.67 1x32 n THR 13 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1x32 n ALA 14 N -2.02 1.41 0.00 2.41 0.00 0.18 -4.88 120.51 117.61 1x32 n ALA 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1x32 n ALA 14 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1x32 n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x32 n GLY 15 N -0.09 1.60 0.28 0.00 0.00 0.46 -4.90 105.19 102.54 1x32 n GLY 15 Ca 0.00 -0.47 0.11 0.00 0.00 0.00 0.00 46.02 45.66 1x32 n GLY 15 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1x32 h GLU 16 N 0.00 0.00 0.00 1.61 4.57 -1.97 -3.40 114.58 115.39 1x32 h GLU 16 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1x32 h GLU 16 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1x32 h GLU 16 CO 0.00 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 178.24 1x32 n GLY 17 N -1.53 0.10 3.19 1.92 0.00 -1.26 -4.98 105.19 102.63 1x32 n GLY 17 Ca -0.01 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1x32 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x32 s ALA 18 N -1.12 1.24 0.00 4.61 0.00 -1.26 -3.48 121.76 121.74 1x32 s ALA 18 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1x32 s ALA 18 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.03 1x32 s ALA 18 CO 0.00 0.14 0.75 -0.12 0.00 0.00 0.00 175.76 176.53 1x32 n MET 19 N 1.09 0.00 -3.94 0.00 1.56 -1.26 0.17 117.12 114.75 1x32 n MET 19 Ca -0.20 -0.65 -0.13 0.00 -0.27 0.00 0.00 57.70 56.45 1x32 n MET 19 Cb 0.55 0.39 -0.02 0.00 2.15 0.00 0.00 33.22 36.29 1x32 n MET 19 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1x32 n GLU 20 N 0.00 0.81 -0.05 2.12 1.02 -0.91 -3.31 120.64 120.32 1x32 n GLU 20 Ca -0.18 -2.67 0.00 0.00 -0.02 0.00 0.00 57.16 54.28 1x32 n GLU 20 Cb 0.58 2.73 0.00 0.00 -0.02 0.00 0.00 31.44 34.73 1x32 n GLU 20 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1x32 n TYR 21 N -0.57 0.00 -2.98 -0.32 9.36 -0.90 0.25 117.16 122.01 1x32 n TYR 21 Ca -0.02 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.79 1x32 n TYR 21 Cb 0.59 0.16 -0.05 0.00 -0.63 0.00 0.00 39.34 39.41 1x32 n TYR 21 CO 0.00 0.00 0.00 -0.48 0.22 0.00 0.00 176.86 176.60 1x32 s LEU 22 N 0.00 4.09 0.34 2.98 2.34 -0.26 -4.37 118.68 123.80 1x32 s LEU 22 Ca 0.00 0.94 0.17 0.00 0.06 0.00 0.00 54.13 55.30 1x32 s LEU 22 Cb 0.00 -3.07 0.95 0.00 -0.56 0.00 0.00 46.19 43.51 1x32 s LEU 22 CO 0.00 -0.44 1.48 0.16 -1.06 0.00 0.00 176.35 176.49 1x32 h ILE 23 N 5.37 0.00 -1.45 1.48 3.07 -1.87 -2.81 117.51 121.30 1x32 h ILE 23 Ca -0.26 0.00 0.42 0.00 1.55 0.00 0.00 64.86 66.57 1x32 h ILE 23 Cb 1.11 0.39 -0.06 0.00 -0.27 0.00 0.00 36.82 37.99 1x32 h ILE 23 CO 0.83 0.00 1.28 1.21 -1.05 0.00 0.00 178.15 180.42 1x32 n GLU 24 N -2.17 0.01 0.00 0.16 4.07 -1.26 -3.53 120.64 117.92 1x32 n GLU 24 Ca -0.01 1.01 0.00 0.00 -0.06 0.00 0.00 57.16 58.10 1x32 n GLU 24 Cb 0.20 -2.42 0.00 0.00 -0.06 0.00 0.00 31.44 29.15 1x32 n GLU 24 CO 0.00 0.00 0.00 -2.67 -0.06 0.00 0.00 177.13 174.40 1x32 n TRP 25 N -3.50 -1.16 -1.84 4.31 2.14 -1.06 -4.80 117.44 111.52 1x32 n TRP 25 Ca 0.33 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.57 1x32 n TRP 25 Cb 1.71 0.00 0.04 0.00 -0.81 0.00 0.00 31.31 32.25 1x32 n TRP 25 CO 0.00 0.00 0.00 1.63 2.07 0.00 0.00 177.69 181.39 1x32 n LYS 26 N -0.56 3.02 -2.28 -2.67 5.02 -1.26 -4.71 118.16 114.72 1x32 n LYS 26 Ca 0.00 -3.74 -0.02 0.00 -2.02 0.00 0.00 58.31 52.52 1x32 n LYS 26 Cb 0.00 -2.28 -0.00 0.00 -0.02 0.00 0.00 35.03 32.73 1x32 n LYS 26 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1x32 n ASP 27 N -0.69 -1.36 0.09 4.39 5.68 -1.26 -4.78 116.55 118.62 1x32 n ASP 27 Ca 0.52 0.39 -0.13 0.00 -0.50 0.00 0.00 54.79 55.08 1x32 n ASP 27 Cb 0.59 -1.33 -0.06 0.00 -1.14 0.00 0.00 41.12 39.18 1x32 n ASP 27 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1x32 h GLY 28 N 0.00 -0.58 -6.88 6.12 0.00 -1.94 -3.37 103.07 96.42 1x32 h GLY 28 Ca -0.05 0.39 -0.59 0.00 0.00 0.00 0.00 47.33 47.08 1x32 h GLY 28 CO 0.06 -0.24 -0.78 0.30 0.00 0.00 0.00 176.54 175.88 1x32 s HIS 29 N -6.00 1.41 0.02 5.60 3.76 -1.26 -5.07 115.29 113.74 1x32 s HIS 29 Ca -0.16 -1.92 0.00 0.00 -0.15 0.00 0.00 55.06 52.84 1x32 s HIS 29 Cb 0.08 -1.48 0.00 0.00 1.11 0.00 0.00 32.58 32.30 1x32 s HIS 29 CO 0.65 -0.82 0.00 0.43 -0.85 0.00 0.00 174.74 174.15 1x32 n SER 30 N 4.10 -0.75 -3.21 1.40 7.64 -1.26 -4.41 113.62 117.13 1x32 n SER 30 Ca 0.06 1.04 -0.25 0.00 1.01 0.00 0.00 58.87 60.73 1x32 n SER 30 Cb 0.37 -1.80 -0.12 0.00 -1.01 0.00 0.00 64.21 61.65 1x32 n SER 30 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1x32 n PRO 31 N 1.56 0.00 -4.41 1.43 -0.01 -1.26 -4.82 135.00 127.50 1x32 n PRO 31 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 63.50 63.24 1x32 n PRO 31 Cb 0.00 -0.97 -0.11 0.00 -0.01 0.00 0.00 33.50 32.41 1x32 n PRO 31 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 175.50 174.37 1x32 s SER 32 N 4.63 3.30 -0.88 2.55 0.01 -1.26 -4.91 113.70 117.13 1x32 s SER 32 Ca 0.96 -0.89 -0.19 0.00 1.31 0.00 0.00 55.95 57.15 1x32 s SER 32 Cb -0.82 -0.24 0.13 0.00 0.21 0.00 0.00 66.02 65.31 1x32 s SER 32 CO 0.36 0.08 1.05 0.86 0.41 0.00 0.00 173.24 176.01 1x32 s TRP 33 N -1.86 3.14 0.36 2.43 -0.11 -1.26 -4.24 118.94 117.41 1x32 s TRP 33 Ca 0.21 -1.36 -0.12 0.00 1.22 0.00 0.00 56.10 56.05 1x32 s TRP 33 Cb -0.07 -4.22 0.03 0.00 -1.50 0.00 0.00 33.47 27.71 1x32 s TRP 33 CO 0.10 -1.44 0.67 0.08 -4.62 0.00 0.00 176.95 171.74 1x32 s VAL 34 N 2.54 0.00 -0.42 5.86 1.01 0.70 -4.82 120.40 125.27 1x32 s VAL 34 Ca 0.29 -1.21 -0.24 0.00 0.00 0.00 0.00 61.98 60.82 1x32 s VAL 34 Cb -0.07 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.61 1x32 s VAL 34 CO -0.07 0.00 0.85 -2.16 0.00 0.00 0.00 175.10 173.72 1x32 s PRO 35 N -2.72 3.61 -1.01 2.72 0.04 -1.26 -2.14 135.00 134.24 1x32 s PRO 35 Ca 0.20 0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.45 1x32 s PRO 35 Cb -0.03 -3.88 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1x32 s PRO 35 CO 0.14 -1.06 0.00 0.45 0.04 0.00 0.00 177.00 176.57 1x32 n SER 36 N 6.80 -2.69 0.00 6.66 2.88 -1.26 -4.23 113.62 121.77 1x32 n SER 36 Ca 0.05 0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1x32 n SER 36 Cb 0.48 -2.58 0.00 0.00 -0.75 0.00 0.00 64.21 61.36 1x32 n SER 36 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x32 n SER 37 N -0.08 0.00 -3.21 -3.46 2.88 -1.26 -4.91 113.62 103.58 1x32 n SER 37 Ca -0.10 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.48 1x32 n SER 37 Cb 0.33 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.76 1x32 n SER 37 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1x32 s TYR 38 N 1.82 -0.27 -0.04 0.66 -0.85 -1.26 -4.59 117.35 112.82 1x32 s TYR 38 Ca 0.00 0.39 0.24 0.00 -0.52 0.00 0.00 57.07 57.18 1x32 s TYR 38 Cb 0.00 0.13 0.41 0.00 0.38 0.00 0.00 41.96 42.89 1x32 s TYR 38 CO 0.00 -0.14 1.16 0.44 -1.52 0.00 0.00 175.55 175.49 1x32 n ILE 39 N 4.95 0.17 -1.56 -3.49 -5.35 -1.26 -1.09 119.36 111.73 1x32 n ILE 39 Ca -0.08 -1.19 -0.13 0.00 -0.27 0.00 0.00 62.75 61.09 1x32 n ILE 39 Cb 0.55 1.01 -0.07 0.00 -1.74 0.00 0.00 39.64 39.38 1x32 n ILE 39 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1x32 n ALA 40 N 0.30 0.34 0.00 -1.28 0.00 -1.26 -3.31 120.51 115.30 1x32 n ALA 40 Ca 0.04 -1.40 0.00 0.00 0.00 0.00 0.00 53.44 52.07 1x32 n ALA 40 Cb 1.07 -3.27 0.00 0.00 0.00 0.00 0.00 19.45 17.25 1x32 n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x32 n ALA 41 N 18.57 0.00 -2.87 0.00 0.00 -1.26 -5.04 120.51 129.91 1x32 n ALA 41 Ca 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.85 1x32 n ALA 41 Cb 0.42 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.88 1x32 n ALA 41 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1x32 n ASP 42 N 0.00 -7.70 0.00 0.00 2.03 -1.21 -5.06 116.55 104.62 1x32 n ASP 42 Ca 0.00 0.88 0.00 0.00 0.52 0.00 0.00 54.79 56.19 1x32 n ASP 42 Cb 0.00 -4.75 0.00 0.00 -0.72 0.00 0.00 41.12 35.65 1x32 n ASP 42 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1x32 n VAL 43 N 0.31 0.00 -3.59 5.18 0.31 -1.25 -5.15 118.33 114.13 1x32 n VAL 43 Ca 0.04 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.34 1x32 n VAL 43 Cb 0.27 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.15 1x32 n VAL 43 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1x32 s VAL 44 N -2.25 -0.88 0.00 2.52 0.11 -1.25 -4.43 120.40 114.22 1x32 s VAL 44 Ca 0.00 0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 1x32 s VAL 44 Cb 0.00 -0.89 0.00 0.00 -1.53 0.00 0.00 36.38 33.96 1x32 s VAL 44 CO 0.00 0.02 0.00 -1.54 -3.33 0.00 0.00 175.10 170.25 1x32 n SER 45 N 5.43 -2.43 0.00 3.54 3.41 -1.23 -4.87 113.62 117.47 1x32 n SER 45 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1x32 n SER 45 Cb 0.49 -2.16 0.00 0.00 -0.26 0.00 0.00 64.21 62.29 1x32 n SER 45 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1x32 n GLU 46 N -1.14 0.00 0.00 4.33 2.13 -1.26 -4.60 120.64 120.10 1x32 n GLU 46 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 1x32 n GLU 46 Cb 0.17 0.00 0.17 0.00 0.27 0.00 0.00 31.44 32.05 1x32 n GLU 46 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70