#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x32 s SER 2 N 0.00 2.46 0.00 1.61 0.15 -1.26 -5.09 113.70 111.57 1x32 s SER 2 Ca 0.00 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 55.96 1x32 s SER 2 Cb 0.00 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.10 1x32 s SER 2 CO 0.00 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.69 1x32 n GLY 3 N 5.28 0.28 3.51 9.45 0.00 -1.26 -4.84 105.19 117.62 1x32 n GLY 3 Ca -0.07 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1x32 n GLY 3 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1x32 n GLU 4 N 0.00 0.00 -0.05 1.61 0.28 -1.26 -4.82 120.64 116.40 1x32 n GLU 4 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.88 1x32 n GLU 4 Cb 0.00 -1.58 -0.11 0.00 1.43 0.00 0.00 31.44 31.19 1x32 n GLU 4 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1x32 h VAL 5 N 0.00 1.49 -0.13 3.84 2.07 -1.96 -3.12 116.25 118.44 1x32 h VAL 5 Ca 0.00 -1.93 0.00 0.00 0.82 0.00 0.00 66.70 65.59 1x32 h VAL 5 Cb 0.00 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 1x32 h VAL 5 CO 0.00 0.47 0.00 0.59 0.02 0.00 0.00 177.57 178.65 1x32 n ASN 6 N -4.69 -0.09 0.00 0.57 4.13 -1.26 -4.92 115.26 109.00 1x32 n ASN 6 Ca -0.09 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.17 1x32 n ASN 6 Cb 0.38 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.58 1x32 n ASN 6 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1x32 n LYS 7 N -0.02 0.00 -1.51 3.52 2.85 -1.26 -4.96 118.16 116.79 1x32 n LYS 7 Ca 0.00 0.00 -0.56 0.00 -1.05 0.00 0.00 58.31 56.70 1x32 n LYS 7 Cb 0.00 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.30 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 0.18 -3.99 0.58 0.00 -1.26 -4.91 119.36 109.96 1x32 n ILE 8 Ca 0.00 -0.12 -0.30 0.00 0.00 0.00 0.00 62.75 62.33 1x32 n ILE 8 Cb 0.00 -1.20 -0.16 0.00 0.00 0.00 0.00 39.64 38.28 1x32 n ILE 8 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 1x32 s ILE 9 N 5.57 1.57 -0.03 9.51 -4.36 -1.26 -4.73 121.20 127.47 1x32 s ILE 9 Ca 1.08 -0.85 -0.03 0.00 -0.26 0.00 0.00 60.65 60.59 1x32 s ILE 9 Cb -1.10 -1.60 -0.04 0.00 1.25 0.00 0.00 42.46 40.97 1x32 s ILE 9 CO 0.60 0.26 0.13 -0.83 0.24 0.00 0.00 174.94 175.35 1x32 s GLY 10 N 1.45 2.11 -0.28 6.27 0.00 -1.26 -4.85 107.32 110.75 1x32 s GLY 10 Ca 0.01 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 43.96 1x32 s GLY 10 CO -0.09 -0.63 0.48 -1.35 0.00 0.00 0.00 173.10 171.51 1x32 s SER 11 N -1.66 -0.42 -0.31 1.64 1.04 -1.26 0.99 113.70 113.72 1x32 s SER 11 Ca 0.23 0.13 0.06 0.00 0.48 0.00 0.00 55.95 56.85 1x32 s SER 11 Cb -0.12 1.51 0.19 0.00 0.10 0.00 0.00 66.02 67.70 1x32 s SER 11 CO 0.14 -0.31 0.58 -0.13 0.98 0.00 0.00 173.24 174.50 1x32 s ARG 12 N 2.67 0.59 0.00 4.02 3.00 -1.25 -4.56 118.95 123.41 1x32 s ARG 12 Ca 0.13 0.37 0.00 0.00 0.00 0.00 0.00 55.73 56.22 1x32 s ARG 12 Cb -0.13 0.17 0.00 0.00 0.00 0.00 0.00 34.95 34.99 1x32 s ARG 12 CO -0.24 -1.07 0.00 2.41 0.00 0.00 0.00 175.30 176.40 1x32 n THR 13 N 5.23 0.00 0.07 0.02 -1.04 -1.23 -4.74 114.28 112.58 1x32 n THR 13 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1x32 n THR 13 Cb 0.54 -0.82 0.00 0.00 -1.82 0.00 0.00 70.33 68.23 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 -1.77 2.60 0.00 2.41 0.00 0.51 -4.86 120.51 119.39 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 1.10 2.19 0.20 0.00 0.00 0.56 -4.88 105.19 104.35 1x32 n GLY 15 Ca 0.00 -0.52 0.02 0.00 0.00 0.00 0.00 46.02 45.52 1x32 n GLY 15 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1x32 h GLU 16 N 0.00 0.06 0.00 1.61 4.11 -1.99 -3.42 114.58 114.95 1x32 h GLU 16 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1x32 h GLU 16 Cb 0.00 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1x32 h GLU 16 CO 0.00 0.38 0.00 0.41 0.07 0.00 0.00 179.01 179.87 1x32 n GLY 17 N -0.55 -0.18 3.44 1.06 0.00 -1.26 -5.01 105.19 102.70 1x32 n GLY 17 Ca -0.02 0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.91 2.56 0.00 4.61 0.00 -1.26 -3.67 121.76 122.08 1x32 s ALA 18 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.47 1x32 s ALA 18 Cb 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1x32 s ALA 18 CO 0.00 0.52 0.84 -0.12 0.00 0.00 0.00 175.76 176.99 1x32 n MET 19 N 0.62 0.00 -2.58 0.00 1.56 -1.26 0.21 117.12 115.67 1x32 n MET 19 Ca -0.15 -0.69 -0.06 0.00 -0.27 0.00 0.00 57.70 56.53 1x32 n MET 19 Cb 0.54 0.35 -0.01 0.00 2.15 0.00 0.00 33.22 36.25 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 0.36 0.00 2.12 1.02 -1.06 -3.57 120.64 119.51 1x32 n GLU 20 Ca -0.19 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.73 1x32 n GLU 20 Cb 0.63 1.24 0.00 0.00 -0.02 0.00 0.00 31.44 33.29 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 -0.26 -1.22 -2.93 -0.32 9.36 -0.71 0.43 117.16 121.51 1x32 n TYR 21 Ca -0.01 0.00 -0.37 0.00 3.32 0.00 0.00 57.90 60.84 1x32 n TYR 21 Cb 0.27 0.37 -0.06 0.00 -0.63 0.00 0.00 39.34 39.29 1x32 n TYR 21 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 1x32 s LEU 22 N -4.24 4.42 0.00 2.98 1.43 0.28 -4.09 118.68 119.46 1x32 s LEU 22 Ca 0.00 1.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.76 1x32 s LEU 22 Cb 0.00 -3.67 0.00 0.00 0.03 0.00 0.00 46.19 42.55 1x32 s LEU 22 CO 0.00 0.05 0.00 -0.38 0.23 0.00 0.00 176.35 176.25 1x32 n ILE 23 N 0.92 0.00 -0.35 -0.59 2.08 -1.26 -4.56 119.36 115.60 1x32 n ILE 23 Ca -0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.29 1x32 n ILE 23 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.39 1x32 n ILE 23 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1x32 n GLU 24 N 0.00 0.00 -0.61 0.38 0.00 -1.26 -4.81 120.64 114.34 1x32 n GLU 24 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.22 1x32 n GLU 24 Cb 0.00 -1.61 0.18 0.00 0.00 0.00 0.00 31.44 30.01 1x32 n GLU 24 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.13 174.46 1x32 n TRP 25 N -2.00 0.00 -3.67 4.31 2.14 -1.26 -4.97 117.44 111.99 1x32 n TRP 25 Ca 0.00 -1.33 -0.19 0.00 2.07 0.00 0.00 57.50 58.05 1x32 n TRP 25 Cb 0.00 -0.23 0.01 0.00 -0.81 0.00 0.00 31.31 30.28 1x32 n TRP 25 CO 0.00 0.00 0.00 1.17 2.07 0.00 0.00 177.69 180.93 1x32 n LYS 26 N -1.01 -0.68 -2.13 -2.67 4.81 -1.26 0.21 118.16 115.43 1x32 n LYS 26 Ca 0.17 -0.09 -0.06 0.00 -0.87 0.00 0.00 58.31 57.47 1x32 n LYS 26 Cb 0.72 -0.72 -0.01 0.00 0.02 0.00 0.00 35.03 35.04 1x32 n LYS 26 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1x32 n ASP 27 N -0.61 -2.17 0.01 3.14 5.68 -1.18 -4.81 116.55 116.61 1x32 n ASP 27 Ca -0.08 0.30 -0.06 0.00 -0.50 0.00 0.00 54.79 54.45 1x32 n ASP 27 Cb 0.28 -2.01 -0.04 0.00 -1.14 0.00 0.00 41.12 38.20 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 -1.31 -7.14 6.12 0.00 0.21 -3.38 103.07 97.57 1x32 h GLY 28 Ca -0.14 0.64 -0.58 0.00 0.00 0.00 0.00 47.33 47.26 1x32 h GLY 28 CO 0.17 -0.42 -0.76 0.30 0.00 0.00 0.00 176.54 175.83 1x32 s HIS 29 N -4.12 1.58 0.00 5.60 0.09 -1.26 -5.05 115.29 112.13 1x32 s HIS 29 Ca -0.06 -1.63 0.00 0.00 -0.00 0.00 0.00 55.06 53.37 1x32 s HIS 29 Cb 0.03 -1.62 0.00 0.00 -0.00 0.00 0.00 32.58 30.99 1x32 s HIS 29 CO 0.25 -0.86 0.00 0.43 -0.00 0.00 0.00 174.74 174.56 1x32 n SER 30 N 4.88 -0.31 -3.32 1.40 7.64 -1.26 -4.42 113.62 118.23 1x32 n SER 30 Ca -0.03 0.85 -0.33 0.00 1.01 0.00 0.00 58.87 60.37 1x32 n SER 30 Cb 0.42 -1.28 -0.11 0.00 -1.01 0.00 0.00 64.21 62.23 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 1.95 0.00 -4.03 1.43 -0.01 -1.26 -4.83 135.00 128.25 1x32 n PRO 31 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 63.50 63.26 1x32 n PRO 31 Cb 0.00 -1.12 -0.05 0.00 -0.01 0.00 0.00 33.50 32.32 1x32 n PRO 31 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 175.50 175.94 1x32 n SER 32 N 7.38 2.34 -4.18 2.55 2.88 -1.26 -4.55 113.62 118.79 1x32 n SER 32 Ca 0.48 -2.74 -0.39 0.00 -1.33 0.00 0.00 58.87 54.89 1x32 n SER 32 Cb 0.01 0.49 -0.10 0.00 -0.75 0.00 0.00 64.21 63.87 1x32 n SER 32 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1x32 s TRP 33 N -2.57 3.49 0.04 0.66 -0.11 -1.26 -4.21 118.94 114.99 1x32 s TRP 33 Ca 0.06 -2.08 -0.18 0.00 1.22 0.00 0.00 56.10 55.12 1x32 s TRP 33 Cb 0.00 -3.38 0.04 0.00 -1.50 0.00 0.00 33.47 28.63 1x32 s TRP 33 CO 0.05 -0.98 0.41 0.54 -4.62 0.00 0.00 176.95 172.34 1x32 s VAL 34 N 1.28 0.06 -0.36 5.86 0.11 0.17 -4.83 120.40 122.69 1x32 s VAL 34 Ca 0.07 -0.46 0.16 0.00 -2.93 0.00 0.00 61.98 58.82 1x32 s VAL 34 Cb -0.25 -0.95 0.16 0.00 -1.53 0.00 0.00 36.38 33.81 1x32 s VAL 34 CO -0.02 -0.26 1.49 -0.81 -3.33 0.00 0.00 175.10 172.18 1x32 n PRO 35 N 0.50 0.11 0.00 1.54 -0.04 -1.25 -1.74 135.00 134.11 1x32 n PRO 35 Ca -0.18 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 63.88 1x32 n PRO 35 Cb 0.60 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1x32 n PRO 35 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1x32 n SER 36 N -2.08 0.00 0.00 3.54 3.41 -1.26 -4.43 113.62 112.80 1x32 n SER 36 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1x32 n SER 36 Cb 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1x32 n SER 36 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1x32 n SER 37 N 0.00 0.00 0.00 4.04 2.88 -1.26 -4.56 113.62 114.72 1x32 n SER 37 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1x32 n SER 37 Cb 0.00 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 1x32 n SER 37 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x32 n TYR 38 N -2.02 0.00 -2.23 0.66 4.19 -1.26 -4.58 117.16 111.93 1x32 n TYR 38 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1x32 n TYR 38 Cb 0.00 0.00 -0.01 0.00 0.49 0.00 0.00 39.34 39.82 1x32 n TYR 38 CO 0.00 0.00 0.00 0.44 0.91 0.00 0.00 176.86 178.21 1x32 n ILE 39 N -0.02 0.00 -1.80 2.97 -0.00 -1.26 0.29 119.36 119.53 1x32 n ILE 39 Ca 0.00 -0.46 -0.20 0.00 -0.00 0.00 0.00 62.75 62.09 1x32 n ILE 39 Cb 0.00 0.68 -0.06 0.00 -0.00 0.00 0.00 39.64 40.25 1x32 n ILE 39 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1x32 s ALA 40 N 0.00 1.14 0.00 -1.28 0.00 -1.26 -2.77 121.76 117.60 1x32 s ALA 40 Ca 0.16 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1x32 s ALA 40 Cb 0.18 -4.58 0.00 0.00 0.00 0.00 0.00 23.12 18.71 1x32 s ALA 40 CO -0.08 -5.50 0.00 0.00 0.00 0.00 0.00 175.76 170.18 1x32 n ALA 41 N 16.55 0.00 -2.66 0.00 0.00 -1.26 -5.04 120.51 128.09 1x32 n ALA 41 Ca 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.87 1x32 n ALA 41 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.96 0.00 -0.08 -1.11 -5.08 116.55 101.62 1x32 n ASP 42 Ca 0.00 1.25 0.00 0.00 -1.51 0.00 0.00 54.79 54.53 1x32 n ASP 42 Cb 0.00 -5.11 0.00 0.00 2.34 0.00 0.00 41.12 38.35 1x32 n ASP 42 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1x32 n VAL 43 N 0.54 0.00 -3.70 5.18 0.31 -1.24 -5.12 118.33 114.31 1x32 n VAL 43 Ca 0.01 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.20 1x32 n VAL 43 Cb 0.06 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 32.84 1x32 n VAL 43 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1x32 s VAL 44 N -2.85 -0.20 -0.96 2.52 -7.23 -1.26 -4.28 120.40 106.13 1x32 s VAL 44 Ca 0.00 0.26 0.00 0.00 -1.81 0.00 0.00 61.98 60.43 1x32 s VAL 44 Cb 0.00 -0.32 0.00 0.00 0.56 0.00 0.00 36.38 36.62 1x32 s VAL 44 CO 0.00 0.11 0.00 -0.24 -0.31 0.00 0.00 175.10 174.66 1x32 n SER 45 N 4.88 -3.94 0.00 4.85 2.88 -1.24 -4.83 113.62 116.22 1x32 n SER 45 Ca -0.14 0.22 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1x32 n SER 45 Cb 0.51 -3.17 0.00 0.00 -0.75 0.00 0.00 64.21 60.80 1x32 n SER 45 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1x32 n GLU 46 N -0.97 0.00 0.00 -1.46 2.13 -1.25 -4.35 120.64 114.74 1x32 n GLU 46 Ca -0.09 0.00 0.14 0.00 0.66 0.00 0.00 57.16 57.87 1x32 n GLU 46 Cb 0.43 0.00 0.82 0.00 0.27 0.00 0.00 31.44 32.96 1x32 n GLU 46 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70