#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 -3.81 -3.60 1.61 2.88 -1.26 -5.01 113.62 104.44 1x32 n SER 2 Ca 0.00 -0.49 -0.10 0.00 -1.33 0.00 0.00 58.87 56.95 1x32 n SER 2 Cb 0.00 -4.36 -0.06 0.00 -0.75 0.00 0.00 64.21 59.04 1x32 n SER 2 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x32 s GLY 3 N -3.72 -0.21 -0.61 0.46 0.00 -1.26 -4.94 107.32 97.04 1x32 s GLY 3 Ca 0.24 2.27 0.00 0.00 0.00 0.00 0.00 44.72 47.23 1x32 s GLY 3 CO 0.61 1.30 0.00 -1.84 0.00 0.00 0.00 173.10 173.17 1x32 n GLU 4 N 1.19 -1.83 0.00 2.90 0.28 -1.26 -4.79 120.64 117.14 1x32 n GLU 4 Ca -0.11 0.66 0.13 0.00 -0.16 0.00 0.00 57.16 57.68 1x32 n GLU 4 Cb 0.57 -5.00 0.43 0.00 1.43 0.00 0.00 31.44 28.88 1x32 n GLU 4 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1x32 n VAL 5 N -1.96 0.00 -3.69 3.84 0.31 -1.26 -4.35 118.33 111.22 1x32 n VAL 5 Ca -0.06 -0.14 -0.26 0.00 -0.01 0.00 0.00 64.34 63.87 1x32 n VAL 5 Cb 0.51 0.34 0.01 0.00 -0.91 0.00 0.00 33.84 33.79 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 -0.57 -4.67 0.00 4.52 2.85 -0.87 -4.94 115.26 111.57 1x32 n ASN 6 Ca 0.14 -0.81 0.00 0.00 -0.11 0.00 0.00 54.58 53.79 1x32 n ASN 6 Cb 0.34 -1.52 0.00 0.00 1.24 0.00 0.00 39.78 39.84 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 -2.16 0.00 -1.54 1.20 2.85 -1.26 -4.87 118.16 112.38 1x32 n LYS 7 Ca -0.28 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.56 1x32 n LYS 7 Cb 0.67 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 35.00 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 0.15 -3.97 0.58 0.00 -1.26 -4.78 119.36 110.09 1x32 n ILE 8 Ca 0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 62.75 62.17 1x32 n ILE 8 Cb 0.00 -2.29 -0.04 0.00 0.00 0.00 0.00 39.64 37.31 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 9.30 0.00 0.31 9.51 1.10 -1.26 -5.00 121.20 135.16 1x32 s ILE 9 Ca 1.04 -1.32 0.04 0.00 -0.51 0.00 0.00 60.65 59.90 1x32 s ILE 9 Cb -0.47 -2.23 -0.06 0.00 0.15 0.00 0.00 42.46 39.84 1x32 s ILE 9 CO 0.37 0.00 0.05 -0.83 -2.11 0.00 0.00 174.94 172.42 1x32 s GLY 10 N -3.02 1.98 -0.27 1.50 0.00 -1.26 -4.91 107.32 101.34 1x32 s GLY 10 Ca 0.20 -2.01 -0.00 0.00 0.00 0.00 0.00 44.72 42.91 1x32 s GLY 10 CO 0.10 -1.78 0.36 -1.35 0.00 0.00 0.00 173.10 170.43 1x32 s SER 11 N -3.45 0.69 -0.29 1.64 1.04 -1.26 -0.99 113.70 111.09 1x32 s SER 11 Ca 0.36 -0.26 0.05 0.00 0.48 0.00 0.00 55.95 56.58 1x32 s SER 11 Cb 0.08 0.93 0.20 0.00 0.10 0.00 0.00 66.02 67.32 1x32 s SER 11 CO 0.15 -0.34 0.58 -0.60 0.98 0.00 0.00 173.24 174.00 1x32 s ARG 12 N 2.49 0.55 0.00 4.02 3.52 -1.25 -4.59 118.95 123.69 1x32 s ARG 12 Ca 0.10 0.58 0.00 0.00 -0.13 0.00 0.00 55.73 56.29 1x32 s ARG 12 Cb -0.14 0.25 0.00 0.00 -1.56 0.00 0.00 34.95 33.50 1x32 s ARG 12 CO -0.25 -0.99 0.00 2.41 -0.81 0.00 0.00 175.30 175.66 1x32 n THR 13 N 5.42 0.00 0.03 4.11 -1.04 -1.21 -4.72 114.28 116.87 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 0.53 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.71 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 -2.13 2.10 0.00 2.41 0.00 0.31 -4.87 120.51 118.32 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 0.60 2.11 0.31 0.00 0.00 0.49 -4.90 105.19 103.80 1x32 n GLY 15 Ca 0.00 -0.61 -0.04 0.00 0.00 0.00 0.00 46.02 45.37 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 1.05 0.00 1.61 4.11 -1.97 -3.40 114.58 115.97 1x32 h GLU 16 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1x32 h GLU 16 Cb 0.00 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.01 1x32 h GLU 16 CO 0.00 0.70 -0.20 0.41 0.07 0.00 0.00 179.01 179.99 1x32 n GLY 17 N -1.32 0.00 3.18 1.06 0.00 -1.26 -4.95 105.19 101.90 1x32 n GLY 17 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.25 1.21 0.00 4.61 0.00 -1.26 -3.74 121.76 121.33 1x32 s ALA 18 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.92 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 0.15 0.63 -0.12 0.00 0.00 0.00 175.76 176.42 1x32 n MET 19 N 1.17 0.00 -4.03 0.00 1.56 -1.26 0.18 117.12 114.74 1x32 n MET 19 Ca -0.20 -0.40 -0.14 0.00 -0.27 0.00 0.00 57.70 56.70 1x32 n MET 19 Cb 0.55 0.23 -0.03 0.00 2.15 0.00 0.00 33.22 36.12 1x32 n MET 19 CO 0.00 0.00 0.00 -1.21 -0.73 0.00 0.00 175.97 174.03 1x32 s GLU 20 N 0.00 2.00 0.00 2.12 2.02 -1.11 -3.28 118.70 120.44 1x32 s GLU 20 Ca 0.00 -1.70 0.00 0.00 0.02 0.00 0.00 54.97 53.29 1x32 s GLU 20 Cb 0.00 0.49 0.00 0.00 0.10 0.00 0.00 34.13 34.72 1x32 s GLU 20 CO 0.00 -0.86 0.06 0.98 0.02 0.00 0.00 175.26 175.46 1x32 n TYR 21 N -0.57 0.00 -2.90 1.61 9.36 -0.94 0.24 117.16 123.98 1x32 n TYR 21 Ca -0.01 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.80 1x32 n TYR 21 Cb 0.61 0.13 -0.04 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 4.35 0.00 2.98 0.05 -0.16 -4.49 118.68 121.41 1x32 s LEU 22 Ca 0.00 1.41 0.00 0.00 0.05 0.00 0.00 54.13 55.59 1x32 s LEU 22 Cb 0.00 -3.30 0.00 0.00 -2.05 0.00 0.00 46.19 40.84 1x32 s LEU 22 CO 0.00 -0.17 0.62 -0.38 -0.55 0.00 0.00 176.35 175.87 1x32 n ILE 23 N 3.76 0.00 1.78 1.48 -0.00 -1.26 -3.49 119.36 121.63 1x32 n ILE 23 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.77 1x32 n ILE 23 Cb 0.51 -0.19 0.00 0.00 -0.00 0.00 0.00 39.64 39.96 1x32 n ILE 23 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1x32 n GLU 24 N -0.49 0.93 -0.52 0.38 4.07 -1.26 -2.06 120.64 121.69 1x32 n GLU 24 Ca 0.00 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 57.01 1x32 n GLU 24 Cb 0.00 -1.04 0.05 0.00 -0.06 0.00 0.00 31.44 30.40 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 -0.45 1.09 -3.51 4.31 2.14 -1.23 -4.83 117.44 114.96 1x32 n TRP 25 Ca 0.00 -1.16 -0.25 0.00 2.07 0.00 0.00 57.50 58.16 1x32 n TRP 25 Cb 0.02 -0.58 -0.01 0.00 -0.81 0.00 0.00 31.31 29.93 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 0.11 -3.38 -1.80 -2.67 4.81 -1.25 0.15 118.16 114.13 1x32 n LYS 26 Ca 0.21 0.45 -0.18 0.00 -0.87 0.00 0.00 58.31 57.92 1x32 n LYS 26 Cb 0.82 -5.16 -0.06 0.00 0.02 0.00 0.00 35.03 30.65 1x32 n LYS 26 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1x32 n ASP 27 N -2.35 -4.88 -0.14 3.14 2.03 -1.26 -4.85 116.55 108.24 1x32 n ASP 27 Ca 0.00 0.32 -0.07 0.00 0.52 0.00 0.00 54.79 55.57 1x32 n ASP 27 Cb 0.53 -4.29 -0.06 0.00 -0.72 0.00 0.00 41.12 36.59 1x32 n ASP 27 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1x32 h GLY 28 N 0.00 -1.53 -6.98 0.27 0.00 0.97 -3.36 103.07 92.45 1x32 h GLY 28 Ca -0.39 0.85 -0.57 0.00 0.00 0.00 0.00 47.33 47.23 1x32 h GLY 28 CO 0.53 -0.41 -0.77 0.30 0.00 0.00 0.00 176.54 176.19 1x32 s HIS 29 N -4.45 1.17 0.00 5.60 0.09 -1.26 -5.08 115.29 111.36 1x32 s HIS 29 Ca -0.08 -1.46 0.00 0.00 -0.00 0.00 0.00 55.06 53.52 1x32 s HIS 29 Cb 0.05 -1.39 0.00 0.00 -0.00 0.00 0.00 32.58 31.24 1x32 s HIS 29 CO 0.35 -0.85 0.00 0.43 -0.00 0.00 0.00 174.74 174.66 1x32 n SER 30 N 4.87 0.00 -2.70 1.40 7.64 -1.26 -4.57 113.62 119.01 1x32 n SER 30 Ca -0.02 0.62 -0.39 0.00 1.01 0.00 0.00 58.87 60.10 1x32 n SER 30 Cb 0.41 -0.93 -0.06 0.00 -1.01 0.00 0.00 64.21 62.62 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 1.31 0.00 -3.69 1.43 -0.01 -1.26 -4.87 135.00 127.91 1x32 n PRO 31 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 63.50 63.36 1x32 n PRO 31 Cb 0.00 -0.86 -0.07 0.00 -0.01 0.00 0.00 33.50 32.56 1x32 n PRO 31 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 175.50 175.94 1x32 s SER 32 N 1.91 -0.24 -0.88 2.55 0.15 -1.26 -4.96 113.70 110.97 1x32 s SER 32 Ca 0.61 -0.03 -0.18 0.00 0.70 0.00 0.00 55.95 57.05 1x32 s SER 32 Cb -0.86 0.40 0.14 0.00 -1.71 0.00 0.00 66.02 63.99 1x32 s SER 32 CO 0.46 -0.64 1.03 0.86 1.20 0.00 0.00 173.24 176.16 1x32 s TRP 33 N -2.39 3.19 0.32 3.44 -0.11 -1.26 -4.14 118.94 117.99 1x32 s TRP 33 Ca -0.06 -1.42 -0.15 0.00 1.22 0.00 0.00 56.10 55.69 1x32 s TRP 33 Cb -0.01 -4.19 0.02 0.00 -1.50 0.00 0.00 33.47 27.80 1x32 s TRP 33 CO -0.02 -1.40 0.66 0.08 -4.62 0.00 0.00 176.95 171.65 1x32 s VAL 34 N 2.34 0.00 -0.23 5.86 1.01 0.67 -4.81 120.40 125.24 1x32 s VAL 34 Ca 0.28 -1.16 -0.18 0.00 0.00 0.00 0.00 61.98 60.92 1x32 s VAL 34 Cb -0.08 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 1x32 s VAL 34 CO -0.07 0.00 0.50 -2.16 0.00 0.00 0.00 175.10 173.37 1x32 s PRO 35 N -3.30 4.13 0.00 2.72 0.04 -1.26 -2.21 135.00 135.12 1x32 s PRO 35 Ca 0.17 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.55 1x32 s PRO 35 Cb -0.04 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.90 1x32 s PRO 35 CO 0.11 -0.24 0.00 0.43 0.04 0.00 0.00 177.00 177.34 1x32 n SER 36 N 5.12 0.00 0.08 6.66 7.64 -1.26 -4.00 113.62 127.86 1x32 n SER 36 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1x32 n SER 36 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1x32 n SER 36 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x32 n SER 37 N 3.16 -0.49 0.00 6.43 7.64 -1.26 -4.69 113.62 124.41 1x32 n SER 37 Ca 0.00 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.15 1x32 n SER 37 Cb 0.00 0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 1x32 n SER 37 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x32 n TYR 38 N -2.95 0.00 -2.03 1.43 4.19 -1.26 -4.58 117.16 111.96 1x32 n TYR 38 Ca 0.00 0.00 -0.06 0.00 3.31 0.00 0.00 57.90 61.15 1x32 n TYR 38 Cb 0.00 0.00 -0.05 0.00 0.49 0.00 0.00 39.34 39.78 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 -0.06 0.00 -1.87 2.97 -0.00 -1.26 0.26 119.36 119.39 1x32 n ILE 39 Ca 0.00 -0.08 -0.22 0.00 -0.00 0.00 0.00 62.75 62.46 1x32 n ILE 39 Cb 0.00 0.51 -0.06 0.00 -0.00 0.00 0.00 39.64 40.09 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 0.01 1.30 0.00 -1.28 0.00 -1.26 -3.44 121.76 117.09 1x32 s ALA 40 Ca 0.01 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.71 1x32 s ALA 40 Cb 0.03 -4.57 0.00 0.00 0.00 0.00 0.00 23.12 18.59 1x32 s ALA 40 CO -0.01 -5.24 0.00 0.00 0.00 0.00 0.00 175.76 170.51 1x32 n ALA 41 N 15.74 0.00 -2.85 0.00 0.00 -1.26 -5.03 120.51 127.10 1x32 n ALA 41 Ca 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.80 1x32 n ALA 41 Cb 0.46 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.91 1x32 n ALA 41 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1x32 n ASP 42 N 0.00 -7.82 0.00 0.00 9.92 -1.22 -5.05 116.55 112.37 1x32 n ASP 42 Ca 0.00 0.83 0.00 0.00 -0.53 0.00 0.00 54.79 55.09 1x32 n ASP 42 Cb 0.00 -5.05 0.00 0.00 -0.64 0.00 0.00 41.12 35.43 1x32 n ASP 42 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1x32 n VAL 43 N 0.14 0.00 -3.44 2.53 0.31 -1.25 -5.15 118.33 111.47 1x32 n VAL 43 Ca 0.06 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.40 1x32 n VAL 43 Cb 0.30 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.19 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 -1.02 -0.51 0.00 2.52 0.11 -1.25 -4.45 120.40 115.80 1x32 s VAL 44 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1x32 s VAL 44 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1x32 s VAL 44 CO 0.00 0.00 0.00 -0.24 -3.33 0.00 0.00 175.10 171.53 1x32 n SER 45 N 4.93 -3.61 0.00 3.54 2.88 -1.25 -4.89 113.62 115.22 1x32 n SER 45 Ca -0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1x32 n SER 45 Cb 0.53 -2.38 0.00 0.00 -0.75 0.00 0.00 64.21 61.60 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 -0.70 0.00 0.00 -1.46 2.13 -1.24 -4.51 120.64 114.86 1x32 n GLU 46 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1x32 n GLU 46 Cb 0.25 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.96 1x32 n GLU 46 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20