#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dan n SER 2 N 0.00 6.67 -4.52 1.61 7.64 -1.26 -4.96 113.62 118.80 2dan n SER 2 Ca 0.00 -3.78 -0.39 0.00 1.01 0.00 0.00 58.87 55.71 2dan n SER 2 Cb 0.00 -0.76 -0.11 0.00 -1.01 0.00 0.00 64.21 62.33 2dan n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dan s SER 3 N -2.41 5.85 -0.27 6.43 0.15 -1.26 -5.04 113.70 117.14 2dan s SER 3 Ca 0.59 -0.27 -0.27 0.00 0.70 0.00 0.00 55.95 56.70 2dan s SER 3 Cb 0.47 -2.08 0.17 0.00 -1.71 0.00 0.00 66.02 62.87 2dan s SER 3 CO -0.04 -0.14 1.30 -0.83 1.20 0.00 0.00 173.24 174.74 2dan s GLY 4 N 1.70 0.13 0.19 9.45 0.00 -1.26 -5.19 107.32 112.34 2dan s GLY 4 Ca 0.06 3.01 -0.02 0.00 0.00 0.00 0.00 44.72 47.78 2dan s GLY 4 CO 0.09 1.56 0.13 -0.56 0.00 0.00 0.00 173.10 174.32 2dan s SER 5 N -0.40 0.17 0.17 1.64 0.01 -1.26 -5.18 113.70 108.86 2dan s SER 5 Ca 0.06 -1.32 0.08 0.00 1.31 0.00 0.00 55.95 56.08 2dan s SER 5 Cb -0.03 0.37 -0.04 0.00 0.21 0.00 0.00 66.02 66.53 2dan s SER 5 CO -0.10 -0.83 -0.18 -0.44 0.41 0.00 0.00 173.24 172.11 2dan s SER 6 N -3.13 2.68 0.00 2.44 0.01 -1.26 -4.95 113.70 109.49 2dan s SER 6 Ca 0.35 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 56.73 2dan s SER 6 Cb 0.07 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.14 2dan s SER 6 CO 0.09 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.30 2dan n GLY 7 N 0.21 0.47 3.53 3.44 0.00 -1.26 -5.09 105.19 106.49 2dan n GLY 7 Ca -0.12 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2dan n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dan n LEU 8 N 0.00 1.55 -3.64 0.99 4.32 -1.26 -4.87 117.00 114.08 2dan n LEU 8 Ca 0.00 -0.40 -0.28 0.00 -0.02 0.00 0.00 56.01 55.32 2dan n LEU 8 Cb 0.00 -1.36 -0.16 0.00 -1.62 0.00 0.00 43.42 40.28 2dan n LEU 8 CO 0.00 -1.42 -0.34 -0.70 -1.22 0.00 0.00 177.39 173.71 2dan s GLU 9 N 8.50 0.33 -0.56 3.23 2.12 -1.26 -5.10 118.70 125.97 2dan s GLU 9 Ca 1.10 -0.38 -0.19 0.00 0.36 0.00 0.00 54.97 55.85 2dan s GLU 9 Cb -0.51 -1.78 0.08 0.00 0.26 0.00 0.00 34.13 32.18 2dan s GLU 9 CO 0.32 -0.77 0.71 0.00 -0.54 0.00 0.00 175.26 174.98 2dan s ALA 10 N 1.99 3.37 -0.21 6.30 0.00 -1.26 -5.02 121.76 126.93 2dan s ALA 10 Ca 0.03 -1.97 0.02 0.00 0.00 0.00 0.00 51.96 50.04 2dan s ALA 10 Cb -0.16 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.50 2dan s ALA 10 CO -0.17 -2.26 -0.14 0.54 0.00 0.00 0.00 175.76 173.73 2dan s VAL 11 N 2.83 2.01 0.07 0.00 0.11 -1.26 -5.12 120.40 119.05 2dan s VAL 11 Ca 0.14 -1.22 0.05 0.00 -2.93 0.00 0.00 61.98 58.02 2dan s VAL 11 Cb -0.21 -1.98 -0.04 0.00 -1.53 0.00 0.00 36.38 32.62 2dan s VAL 11 CO 0.09 0.24 -0.02 0.00 -3.33 0.00 0.00 175.10 172.09 2dan s ALA 12 N 1.24 3.22 1.00 1.54 0.00 -1.26 -5.13 121.76 122.38 2dan s ALA 12 Ca -0.02 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.84 2dan s ALA 12 Cb -0.16 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.79 2dan s ALA 12 CO -0.09 0.68 0.00 -0.35 0.00 0.00 0.00 175.76 176.00 2dan n PRO 13 N 0.77 0.19 -3.93 0.00 -0.04 -1.26 -5.10 135.00 125.63 2dan n PRO 13 Ca -0.12 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.26 2dan n PRO 13 Cb 0.52 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.90 2dan n PRO 13 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2dan s GLU 14 N -1.20 0.75 -0.08 0.54 -1.05 -1.26 -5.17 118.70 111.23 2dan s GLU 14 Ca 0.00 -1.00 -0.27 0.00 -0.15 0.00 0.00 54.97 53.54 2dan s GLU 14 Cb 0.00 0.30 0.06 0.00 -0.44 0.00 0.00 34.13 34.05 2dan s GLU 14 CO 0.00 -0.21 0.62 -0.98 0.95 0.00 0.00 175.26 175.64 2dan s ARG 15 N -3.73 0.95 0.00 -4.83 1.04 -1.26 -5.17 118.95 105.95 2dan s ARG 15 Ca 0.04 0.30 0.00 0.00 -1.04 0.00 0.00 55.73 55.04 2dan s ARG 15 Cb 0.05 0.45 0.00 0.00 -2.04 0.00 0.00 34.95 33.41 2dan s ARG 15 CO -0.10 -0.27 0.00 -0.35 -0.04 0.00 0.00 175.30 174.54 2dan n PRO 16 N 1.27 0.22 -3.77 3.89 -0.04 -1.26 -4.91 135.00 130.41 2dan n PRO 16 Ca -0.18 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.15 2dan n PRO 16 Cb 0.57 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.92 2dan n PRO 16 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2dan s ARG 17 N -1.16 0.40 0.89 0.54 6.06 -1.26 -3.37 118.95 121.06 2dan s ARG 17 Ca 0.00 0.36 -0.10 0.00 -2.50 0.00 0.00 55.73 53.49 2dan s ARG 17 Cb 0.00 0.19 0.13 0.00 0.06 0.00 0.00 34.95 35.34 2dan s ARG 17 CO 0.00 -0.06 1.14 0.00 -2.50 0.00 0.00 175.30 173.88 2dan n ALA 19 N -4.13 2.35 0.00 0.00 0.00 -0.98 -3.05 120.51 114.69 2dan n ALA 19 Ca 0.12 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.57 2dan n ALA 19 Cb 0.52 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.35 2dan n ALA 19 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2dan n TYR 20 N 0.99 0.00 0.11 0.00 4.19 -1.26 -4.83 117.16 116.36 2dan n TYR 20 Ca 0.14 0.00 0.01 0.00 3.31 0.00 0.00 57.90 61.37 2dan n TYR 20 Cb 0.48 0.00 -0.01 0.00 0.49 0.00 0.00 39.34 40.29 2dan n TYR 20 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2dan n SER 22 N -1.08 -5.82 -4.89 0.00 7.64 -1.17 -4.93 113.62 103.36 2dan n SER 22 Ca 0.00 -0.44 -0.20 0.00 1.01 0.00 0.00 58.87 59.24 2dan n SER 22 Cb 0.04 -4.47 -0.03 0.00 -1.01 0.00 0.00 64.21 58.74 2dan n SER 22 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dan s ALA 23 N -3.25 3.98 -0.39 -0.43 0.00 -1.26 -4.52 121.76 115.89 2dan s ALA 23 Ca 0.47 -1.63 -0.33 0.00 0.00 0.00 0.00 51.96 50.47 2dan s ALA 23 Cb -0.21 -1.29 -0.11 0.00 0.00 0.00 0.00 23.12 21.51 2dan s ALA 23 CO 0.59 -0.04 2.26 0.39 0.00 0.00 0.00 175.76 178.95 2dan n GLU 24 N -1.47 1.13 -3.17 0.00 1.02 -1.26 0.47 120.64 117.37 2dan n GLU 24 Ca -0.00 0.27 -0.29 0.00 -0.02 0.00 0.00 57.16 57.12 2dan n GLU 24 Cb 0.60 -2.63 -0.03 0.00 -0.02 0.00 0.00 31.44 29.35 2dan n GLU 24 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dan s ALA 25 N 8.15 3.52 0.00 0.62 0.00 -1.22 -4.50 121.76 128.33 2dan s ALA 25 Ca 1.09 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.62 2dan s ALA 25 Cb -0.73 -2.45 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2dan s ALA 25 CO 0.44 0.16 0.00 0.43 0.00 0.00 0.00 175.76 176.79 2dan n SER 26 N -1.05 2.93 -4.39 0.00 7.64 -1.26 -4.12 113.62 113.37 2dan n SER 26 Ca -0.00 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.56 2dan n SER 26 Cb 0.54 0.18 -0.15 0.00 -1.01 0.00 0.00 64.21 63.78 2dan n SER 26 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2dan s LYS 27 N -1.64 2.29 0.46 1.43 -0.14 -1.26 -5.05 119.74 115.84 2dan s LYS 27 Ca 0.00 -0.82 0.04 0.00 -1.36 0.00 0.00 55.97 53.83 2dan s LYS 27 Cb 0.00 -2.20 0.01 0.00 -1.68 0.00 0.00 37.83 33.96 2dan s LYS 27 CO 0.00 0.59 0.64 1.03 -0.76 0.00 0.00 175.35 176.85 2dan s ARG 28 N -0.69 2.80 -0.09 1.68 0.52 -1.26 -2.46 118.95 119.44 2dan s ARG 28 Ca 0.11 -0.94 -0.33 0.00 -0.52 0.00 0.00 55.73 54.05 2dan s ARG 28 Cb -0.10 -2.64 -0.10 0.00 0.52 0.00 0.00 34.95 32.62 2dan s ARG 28 CO -0.00 -0.38 1.97 0.00 0.02 0.00 0.00 175.30 176.90 2dan n SER 30 N 7.69 0.00 -0.11 0.00 7.64 -1.26 0.24 113.62 127.82 2dan n SER 30 Ca 0.24 -0.86 -0.23 0.00 1.01 0.00 0.00 58.87 59.03 2dan n SER 30 Cb 0.34 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.42 2dan n SER 30 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2dan n ARG 31 N -0.84 0.63 0.00 1.43 1.74 -1.26 -4.76 116.66 113.60 2dan n ARG 31 Ca 0.11 0.25 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 2dan n ARG 31 Cb 0.05 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 29.93 2dan n ARG 31 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dan n GLN 33 N -0.90 -1.83 -0.02 0.00 3.00 0.65 -4.81 117.38 113.46 2dan n GLN 33 Ca 0.00 0.87 0.04 0.00 -0.01 0.00 0.00 57.00 57.91 2dan n GLN 33 Cb 0.00 -5.47 0.05 0.00 0.00 0.00 0.00 30.24 24.82 2dan n GLN 33 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2dan n ASN 34 N -1.80 1.90 -4.30 1.08 3.02 -1.26 -4.79 115.26 109.11 2dan n ASN 34 Ca -0.20 -1.47 -0.16 0.00 -0.03 0.00 0.00 54.58 52.71 2dan n ASN 34 Cb 0.65 -0.03 -0.10 0.00 -0.61 0.00 0.00 39.78 39.68 2dan n ASN 34 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2dan s GLU 35 N -0.78 1.22 0.13 3.52 2.56 -1.26 -5.00 118.70 119.09 2dan s GLU 35 Ca 0.12 -1.57 0.11 0.00 0.00 0.00 0.00 54.97 53.62 2dan s GLU 35 Cb 0.08 -0.69 -0.04 0.00 2.00 0.00 0.00 34.13 35.48 2dan s GLU 35 CO 0.11 0.01 -0.25 -1.58 -0.56 0.00 0.00 175.26 172.99 2dan s TRP 36 N -3.32 2.36 -0.24 5.30 0.52 -1.26 -1.33 118.94 120.97 2dan s TRP 36 Ca 0.23 -0.36 -0.10 0.00 0.02 0.00 0.00 56.10 55.90 2dan s TRP 36 Cb 0.04 -1.27 0.10 0.00 -1.15 0.00 0.00 33.47 31.18 2dan s TRP 36 CO 0.05 0.35 0.54 0.71 0.02 0.00 0.00 176.95 178.62 2dan s TYR 37 N -1.08 -1.01 0.36 -1.98 2.02 -1.03 -2.33 117.35 112.31 2dan s TYR 37 Ca 0.15 1.87 0.04 0.00 -0.37 0.00 0.00 57.07 58.76 2dan s TYR 37 Cb -0.10 0.53 0.70 0.00 -0.40 0.00 0.00 41.96 42.68 2dan s TYR 37 CO 0.07 -0.54 1.98 0.00 -1.57 0.00 0.00 175.55 175.49 2dan h ARG 40 N 3.06 0.68 -0.47 0.00 9.65 -1.99 -2.88 114.38 122.43 2dan h ARG 40 Ca -0.34 -0.05 0.09 0.00 -1.10 0.00 0.00 59.98 58.58 2dan h ARG 40 Cb 1.16 -0.15 -0.10 0.00 -1.39 0.00 0.00 29.97 29.49 2dan h ARG 40 CO 0.64 0.47 -0.29 1.49 2.80 0.00 0.00 179.97 185.08 2dan h GLU 41 N 0.68 -0.18 -0.34 0.20 4.81 -1.98 -0.90 114.58 116.88 2dan h GLU 41 Ca 0.18 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.49 2dan h GLU 41 Cb -0.05 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.31 2dan h GLU 41 CO -0.04 -0.12 -0.03 0.00 -0.73 0.00 0.00 179.01 178.10 2dan h GLN 43 N 0.06 0.00 0.00 0.00 4.15 -0.99 -0.43 115.11 117.90 2dan h GLN 43 Ca 0.16 0.00 -0.38 0.00 0.77 0.00 0.00 58.65 59.21 2dan h GLN 43 Cb 0.24 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.86 2dan h GLN 43 CO -0.30 0.00 -2.40 0.28 -1.93 0.00 0.00 178.83 174.48 2dan n VAL 44 N -2.44 1.46 -0.06 2.39 0.31 0.64 -3.81 118.33 116.82 2dan n VAL 44 Ca -0.02 -0.70 -0.12 0.00 -0.01 0.00 0.00 64.34 63.49 2dan n VAL 44 Cb 0.14 -1.01 -0.06 0.00 -0.91 0.00 0.00 33.84 32.00 2dan n VAL 44 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2dan h LYS 45 N 0.00 0.37 0.00 5.55 1.57 0.84 -2.77 116.57 122.13 2dan h LYS 45 Ca -0.55 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.08 2dan h LYS 45 Cb 2.06 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.35 2dan h LYS 45 CO -0.03 0.65 0.00 1.58 -0.57 0.00 0.00 179.45 181.08 2dan n HIS 46 N -4.62 0.24 -0.38 -1.35 -0.00 -0.30 -3.85 115.22 104.96 2dan n HIS 46 Ca -0.05 0.08 -0.04 0.00 0.46 0.00 0.00 57.72 58.17 2dan n HIS 46 Cb 0.29 -0.64 -0.00 0.00 -0.12 0.00 0.00 29.99 29.52 2dan n HIS 46 CO 0.00 0.00 0.00 2.35 0.46 0.00 0.00 176.34 179.15 2dan h TRP 47 N 0.00 -1.31 -1.07 1.57 2.91 -1.59 0.78 115.95 117.25 2dan h TRP 47 Ca 0.00 0.11 0.38 0.00 1.13 0.00 0.00 58.89 60.51 2dan h TRP 47 Cb 0.40 0.71 -0.12 0.00 -0.51 0.00 0.00 29.16 29.64 2dan h TRP 47 CO 0.00 -0.40 0.67 -1.91 -1.03 0.00 0.00 178.44 175.78 2dan n GLU 48 N -5.41 -0.03 -0.11 2.65 2.13 -1.25 0.13 120.64 118.74 2dan n GLU 48 Ca 0.08 1.02 -0.21 0.00 0.66 0.00 0.00 57.16 58.71 2dan n GLU 48 Cb 0.36 -1.99 -0.12 0.00 0.27 0.00 0.00 31.44 29.96 2dan n GLU 48 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2dan n LYS 49 N -4.37 0.65 0.36 5.31 5.02 0.23 -4.47 118.16 120.89 2dan n LYS 49 Ca 0.32 0.21 -0.17 0.00 -2.02 0.00 0.00 58.31 56.66 2dan n LYS 49 Cb 1.23 -1.56 -0.08 0.00 -0.02 0.00 0.00 35.03 34.60 2dan n LYS 49 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2dan h HIS 50 N -0.24 -0.85 -1.72 2.13 2.76 0.37 -2.82 115.15 114.79 2dan h HIS 50 Ca -0.57 -0.02 0.50 0.00 -2.20 0.00 0.00 60.37 58.09 2dan h HIS 50 Cb 1.84 0.28 -0.07 0.00 1.55 0.00 0.00 27.41 31.00 2dan h HIS 50 CO 0.02 -0.49 1.23 0.41 -1.30 0.00 0.00 177.93 177.80 2dan n GLY 51 N -1.04 -0.87 0.12 5.26 0.00 0.34 0.84 105.19 109.84 2dan n GLY 51 Ca -0.13 0.62 -0.08 0.00 0.00 0.00 0.00 46.02 46.43 2dan n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dan h LYS 52 N 0.00 0.08 -0.01 1.61 1.57 -1.66 -2.86 116.57 115.30 2dan h LYS 52 Ca 0.83 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.61 2dan h LYS 52 Cb 3.30 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 35.59 2dan h LYS 52 CO -0.04 0.05 -0.81 0.25 -0.57 0.00 0.00 179.45 178.33 2dan n THR 53 N -5.14 0.00 -0.62 -0.16 -2.24 0.25 -4.99 114.28 101.37 2dan n THR 53 Ca -0.01 -0.10 -0.31 0.00 -2.27 0.00 0.00 64.05 61.36 2dan n THR 53 Cb 0.12 1.08 0.20 0.00 -2.10 0.00 0.00 70.33 69.63 2dan n THR 53 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dan n SER 55 N -2.76 -4.06 0.00 0.00 7.64 -1.26 -4.94 113.62 108.24 2dan n SER 55 Ca 0.02 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 59.01 2dan n SER 55 Cb 0.58 -3.27 0.00 0.00 -1.01 0.00 0.00 64.21 60.51 2dan n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dan n GLY 56 N -1.52 -2.21 3.62 0.23 0.00 -1.19 -4.65 105.19 99.46 2dan n GLY 56 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2dan n GLY 56 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dan s PRO 57 N 0.00 3.64 0.37 1.61 0.04 -1.26 -4.99 135.00 134.42 2dan s PRO 57 Ca 0.00 1.52 0.04 0.00 0.04 0.00 0.00 61.00 62.59 2dan s PRO 57 Cb 0.00 -4.08 -0.04 0.00 0.04 0.00 0.00 34.50 30.42 2dan s PRO 57 CO 0.00 -1.48 0.09 0.45 0.04 0.00 0.00 177.00 176.10 2dan s SER 58 N 4.71 2.62 0.25 6.66 0.15 -1.26 -5.01 113.70 121.82 2dan s SER 58 Ca 0.73 -1.53 0.10 0.00 0.70 0.00 0.00 55.95 55.95 2dan s SER 58 Cb -0.23 0.23 0.83 0.00 -1.71 0.00 0.00 66.02 65.14 2dan s SER 58 CO 0.31 -0.77 1.14 -1.54 1.20 0.00 0.00 173.24 173.58 2dan n SER 59 N -0.99 0.14 0.00 5.45 3.41 -1.26 -5.27 113.62 115.09 2dan n SER 59 Ca -0.05 1.21 0.07 0.00 -0.26 0.00 0.00 58.87 59.84 2dan n SER 59 Cb 0.66 -0.54 0.40 0.00 -0.26 0.00 0.00 64.21 64.47 2dan n SER 59 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49