#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eox s SER 2 N 0.00 3.83 -0.10 1.61 0.01 -1.26 -5.14 113.70 112.65 2eox s SER 2 Ca 0.00 -1.32 -0.00 0.00 1.31 0.00 0.00 55.95 55.93 2eox s SER 2 Cb 0.00 -0.38 0.02 0.00 0.21 0.00 0.00 66.02 65.87 2eox s SER 2 CO 0.00 -0.39 -0.07 -0.55 0.41 0.00 0.00 173.24 172.64 2eox s SER 3 N -3.68 1.96 0.00 2.44 0.15 -1.26 -5.10 113.70 108.21 2eox s SER 3 Ca 0.34 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2eox s SER 3 Cb 0.08 -0.76 0.00 0.00 -1.71 0.00 0.00 66.02 63.63 2eox s SER 3 CO 0.18 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.12 2eox n GLY 4 N 4.74 3.08 3.34 9.45 0.00 -1.26 -5.18 105.19 119.36 2eox n GLY 4 Ca -0.14 0.02 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 2eox n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eox s SER 5 N 0.00 2.37 -0.18 1.61 0.15 -1.26 -5.13 113.70 111.27 2eox s SER 5 Ca 0.00 -1.08 -0.19 0.00 0.70 0.00 0.00 55.95 55.37 2eox s SER 5 Cb 0.00 -0.10 -0.03 0.00 -1.71 0.00 0.00 66.02 64.18 2eox s SER 5 CO 0.00 -0.29 0.55 -0.44 1.20 0.00 0.00 173.24 174.27 2eox s SER 6 N -3.32 6.65 0.45 5.45 0.01 -1.26 -4.93 113.70 116.75 2eox s SER 6 Ca 0.24 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.28 2eox s SER 6 Cb 0.02 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.93 2eox s SER 6 CO 0.07 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.16 2eox n GLY 7 N 3.70 -2.41 2.22 3.44 0.00 -1.26 -4.43 105.19 106.45 2eox n GLY 7 Ca -0.04 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 2eox n GLY 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2eox n THR 8 N -4.06 3.39 -3.96 2.61 -1.04 -1.26 -4.90 114.28 105.06 2eox n THR 8 Ca -0.04 -2.89 -0.26 0.00 -2.04 0.00 0.00 64.05 58.82 2eox n THR 8 Cb 0.66 -0.99 -0.17 0.00 -1.82 0.00 0.00 70.33 68.00 2eox n THR 8 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2eox s ASP 9 N -1.97 2.04 -0.20 8.00 1.11 -1.26 -5.12 116.67 119.27 2eox s ASP 9 Ca 0.61 -0.27 -0.14 0.00 0.18 0.00 0.00 52.55 52.93 2eox s ASP 9 Cb 0.49 -0.78 0.06 0.00 1.07 0.00 0.00 42.92 43.75 2eox s ASP 9 CO 0.02 -0.11 0.50 -0.55 1.18 0.00 0.00 175.17 176.21 2eox s SER 10 N 1.62 -0.60 0.06 0.27 0.15 -1.26 -5.03 113.70 108.91 2eox s SER 10 Ca 0.03 1.06 0.02 0.00 0.70 0.00 0.00 55.95 57.76 2eox s SER 10 Cb -0.13 1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 65.14 2eox s SER 10 CO -0.07 -0.19 0.06 -1.59 1.20 0.00 0.00 173.24 172.65 2eox s LYS 11 N 0.94 2.86 -0.28 5.44 -2.85 -1.26 -5.11 119.74 119.47 2eox s LYS 11 Ca -0.05 -0.66 -0.17 0.00 -1.00 0.00 0.00 55.97 54.08 2eox s LYS 11 Cb -0.06 -2.72 0.11 0.00 -2.06 0.00 0.00 37.83 33.10 2eox s LYS 11 CO -0.08 0.58 0.82 -1.54 0.10 0.00 0.00 175.35 175.24 2eox s SER 12 N -2.15 -0.74 -0.14 0.03 1.04 -1.26 -5.11 113.70 105.37 2eox s SER 12 Ca 0.26 1.20 -0.01 0.00 0.48 0.00 0.00 55.95 57.88 2eox s SER 12 Cb -0.12 1.29 -0.01 0.00 0.10 0.00 0.00 66.02 67.28 2eox s SER 12 CO 0.19 -0.19 -0.11 -0.31 0.98 0.00 0.00 173.24 173.79 2eox s TYR 13 N 1.38 2.84 -0.03 5.02 2.02 -1.25 -5.05 117.35 122.29 2eox s TYR 13 Ca -0.08 -0.67 0.01 0.00 -0.37 0.00 0.00 57.07 55.96 2eox s TYR 13 Cb -0.04 -1.88 0.01 0.00 -0.40 0.00 0.00 41.96 39.65 2eox s TYR 13 CO -0.16 -0.25 -0.05 -0.80 -1.57 0.00 0.00 175.55 172.72 2eox s ASN 14 N 0.49 0.85 0.19 2.29 -0.87 -1.26 -0.35 114.94 116.28 2eox s ASN 14 Ca -0.08 -0.12 -0.30 0.00 -1.57 0.00 0.00 52.86 50.79 2eox s ASN 14 Cb -0.16 -0.31 -0.08 0.00 -0.02 0.00 0.00 41.25 40.68 2eox s ASN 14 CO 0.04 -0.01 1.27 0.00 -2.57 0.00 0.00 177.10 175.83 2eox n ASN 16 N 2.58 0.59 -0.22 0.00 2.85 -1.26 -1.70 115.26 118.10 2eox n ASN 16 Ca 0.05 0.28 0.03 0.00 -0.11 0.00 0.00 54.58 54.84 2eox n ASN 16 Cb 0.43 0.29 0.14 0.00 1.24 0.00 0.00 39.78 41.89 2eox n ASN 16 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2eox h GLU 17 N 0.00 0.26 0.00 1.20 3.07 -1.99 -3.34 114.58 113.79 2eox h GLU 17 Ca -0.36 -0.02 -0.14 0.00 -0.50 0.00 0.00 59.36 58.34 2eox h GLU 17 Cb 2.06 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 29.89 2eox h GLU 17 CO 0.06 0.17 -1.49 0.00 -1.40 0.00 0.00 179.01 176.35 2eox n GLY 19 N 2.62 0.59 2.99 0.00 0.00 -0.69 -5.10 105.19 105.59 2eox n GLY 19 Ca -0.17 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 44.89 2eox n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eox s LYS 20 N -0.63 0.74 -0.17 1.61 1.02 -1.02 -4.94 119.74 116.35 2eox s LYS 20 Ca 0.00 -0.26 -0.14 0.00 0.02 0.00 0.00 55.97 55.59 2eox s LYS 20 Cb 0.00 -0.71 -0.05 0.00 -0.52 0.00 0.00 37.83 36.55 2eox s LYS 20 CO 0.00 0.12 0.29 0.00 -0.92 0.00 0.00 175.35 174.84 2eox s ALA 21 N 0.05 3.59 0.28 5.17 0.00 -1.26 0.45 121.76 130.03 2eox s ALA 21 Ca -0.00 -0.50 0.11 0.00 0.00 0.00 0.00 51.96 51.56 2eox s ALA 21 Cb -0.06 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.61 2eox s ALA 21 CO -0.00 0.03 -0.11 -0.06 0.00 0.00 0.00 175.76 175.62 2eox s PHE 22 N 0.60 2.47 -0.18 0.00 0.08 0.53 -4.98 117.98 116.49 2eox s PHE 22 Ca 0.16 -0.29 0.16 0.00 0.12 0.00 0.00 56.93 57.08 2eox s PHE 22 Cb -0.13 -1.09 -0.24 0.00 -0.57 0.00 0.00 43.02 40.99 2eox s PHE 22 CO 0.04 0.67 0.14 0.25 -0.10 0.00 0.00 175.22 176.22 2eox n THR 23 N -0.75 1.43 -2.87 0.64 -2.24 -1.26 -3.74 114.28 105.49 2eox n THR 23 Ca -0.06 -0.83 -0.23 0.00 -2.27 0.00 0.00 64.05 60.66 2eox n THR 23 Cb 0.60 -0.61 0.02 0.00 -2.10 0.00 0.00 70.33 68.23 2eox n THR 23 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2eox s ARG 24 N -2.51 3.01 -0.12 -0.78 3.00 -1.26 -4.91 118.95 115.38 2eox s ARG 24 Ca -0.11 -0.43 0.13 0.00 0.00 0.00 0.00 55.73 55.32 2eox s ARG 24 Cb 0.06 -2.51 -0.24 0.00 0.00 0.00 0.00 34.95 32.27 2eox s ARG 24 CO 0.82 -0.37 0.35 1.51 0.00 0.00 0.00 175.30 177.61 2eox n ILE 25 N -2.17 1.52 0.08 1.52 0.13 -1.26 -4.01 119.36 115.17 2eox n ILE 25 Ca 0.02 -0.80 0.02 0.00 -1.10 0.00 0.00 62.75 60.89 2eox n ILE 25 Cb 0.58 -0.86 -0.03 0.00 -0.84 0.00 0.00 39.64 38.49 2eox n ILE 25 CO 0.00 0.00 0.00 2.19 2.80 0.00 0.00 176.55 181.54 2eox h PHE 26 N 0.00 0.00 -0.22 9.51 -5.15 -2.00 -3.25 116.94 115.84 2eox h PHE 26 Ca -0.42 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.23 2eox h PHE 26 Cb 2.11 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 38.27 2eox h PHE 26 CO 0.01 0.49 -0.39 0.45 -2.00 0.00 0.00 178.31 176.87 2eox h HIS 27 N 0.00 0.57 -0.12 6.09 3.86 -1.99 -1.54 115.15 122.03 2eox h HIS 27 Ca -0.08 -0.16 -0.15 0.00 -1.16 0.00 0.00 60.37 58.82 2eox h HIS 27 Cb 1.45 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 29.80 2eox h HIS 27 CO 0.00 0.80 -0.51 1.25 0.86 0.00 0.00 177.93 180.33 2eox h LEU 28 N 0.41 0.66 -0.20 2.43 5.85 -1.70 -2.53 115.31 120.24 2eox h LEU 28 Ca 0.04 -0.63 -0.02 0.00 0.84 0.00 0.00 57.88 58.11 2eox h LEU 28 Cb 0.86 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 2eox h LEU 28 CO 0.07 1.18 0.05 0.74 -0.34 0.00 0.00 178.44 180.14 2eox h THR 29 N 0.19 1.20 0.00 1.05 2.02 -1.58 -1.83 112.91 113.96 2eox h THR 29 Ca -0.03 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.52 2eox h THR 29 Cb 1.15 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 2eox h THR 29 CO 0.11 0.20 0.00 -2.11 0.37 0.00 0.00 175.52 174.08 2eox n ARG 30 N -4.79 0.09 -0.04 6.66 1.85 -0.58 -3.42 116.66 116.42 2eox n ARG 30 Ca -0.04 0.36 -0.02 0.00 -1.00 0.00 0.00 57.85 57.15 2eox n ARG 30 Cb 0.16 -1.68 -0.01 0.00 -1.05 0.00 0.00 32.46 29.88 2eox n ARG 30 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2eox h HIS 31 N 0.00 0.00 -1.56 2.89 2.76 -0.94 -3.35 115.15 114.95 2eox h HIS 31 Ca 0.00 0.00 0.46 0.00 -2.20 0.00 0.00 60.37 58.63 2eox h HIS 31 Cb 0.27 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.16 2eox h HIS 31 CO 0.00 0.00 1.11 1.04 -1.30 0.00 0.00 177.93 178.78 2eox n GLN 32 N -4.05 -0.00 -0.22 5.26 6.02 -0.75 0.59 117.38 124.23 2eox n GLN 32 Ca -0.03 0.89 0.00 0.00 -0.01 0.00 0.00 57.00 57.86 2eox n GLN 32 Cb 0.09 -2.02 0.08 0.00 1.02 0.00 0.00 30.24 29.41 2eox n GLN 32 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2eox h LYS 33 N 0.00 0.03 -0.85 -1.09 1.57 -1.70 0.37 116.57 114.91 2eox h LYS 33 Ca 0.76 -0.00 0.25 0.00 -1.87 0.00 0.00 60.65 59.78 2eox h LYS 33 Cb 2.99 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 35.26 2eox h LYS 33 CO -0.04 0.02 1.04 -0.84 -0.57 0.00 0.00 179.45 179.06 2eox h ILE 34 N 0.04 0.07 -1.62 1.86 3.07 -0.09 -3.30 117.51 117.54 2eox h ILE 34 Ca 0.32 0.00 -0.58 0.00 1.55 0.00 0.00 64.86 66.15 2eox h ILE 34 Cb 0.51 0.14 -0.10 0.00 -0.27 0.00 0.00 36.82 37.11 2eox h ILE 34 CO -0.63 0.00 1.30 -1.00 -1.05 0.00 0.00 178.15 176.77 2eox s HIS 35 N -4.45 2.48 0.06 0.16 3.76 0.13 -4.68 115.29 112.75 2eox s HIS 35 Ca -0.03 -0.59 -0.01 0.00 -0.15 0.00 0.00 55.06 54.28 2eox s HIS 35 Cb 0.14 -4.65 -0.00 0.00 1.11 0.00 0.00 32.58 29.17 2eox s HIS 35 CO 0.46 -1.96 -0.02 0.25 -0.85 0.00 0.00 174.74 172.62 2eox n THR 36 N 6.63 0.95 -3.37 1.30 -2.24 -1.25 -4.97 114.28 111.34 2eox n THR 36 Ca 0.22 0.30 -0.45 0.00 -2.27 0.00 0.00 64.05 61.85 2eox n THR 36 Cb 0.50 -1.50 -0.06 0.00 -2.10 0.00 0.00 70.33 67.17 2eox n THR 36 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2eox s ARG 37 N -1.81 2.92 0.61 -0.78 3.52 -1.26 -4.92 118.95 117.23 2eox s ARG 37 Ca -0.02 -1.60 0.31 0.00 -0.13 0.00 0.00 55.73 54.29 2eox s ARG 37 Cb 0.00 -4.19 1.79 0.00 -1.56 0.00 0.00 34.95 30.99 2eox s ARG 37 CO 0.02 -1.21 2.14 1.57 -0.81 0.00 0.00 175.30 177.01 2eox h LYS 38 N 8.78 0.00 -1.50 5.12 2.10 -1.98 -3.44 116.57 125.66 2eox h LYS 38 Ca -0.28 0.00 0.26 0.00 -2.00 0.00 0.00 60.65 58.63 2eox h LYS 38 Cb 1.10 0.00 -0.18 0.00 -0.90 0.00 0.00 32.23 32.25 2eox h LYS 38 CO 0.96 0.00 0.80 0.45 -2.00 0.00 0.00 179.45 179.67 2eox s SER 39 N -5.57 -0.13 0.00 7.07 0.15 -1.26 -5.18 113.70 108.78 2eox s SER 39 Ca -0.05 -0.03 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2eox s SER 39 Cb 0.14 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 2eox s SER 39 CO 0.50 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.29 2eox n GLY 40 N -0.17 3.22 3.74 9.45 0.00 -1.26 -5.06 105.19 115.12 2eox n GLY 40 Ca -0.01 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 2eox n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eox s PRO 41 N -4.33 4.40 0.48 1.61 0.04 -1.26 -4.96 135.00 130.98 2eox s PRO 41 Ca 0.00 2.05 -0.21 0.00 0.04 0.00 0.00 61.00 62.88 2eox s PRO 41 Cb 0.00 -3.19 -0.11 0.00 0.04 0.00 0.00 34.50 31.24 2eox s PRO 41 CO 0.00 -0.23 0.57 0.43 0.04 0.00 0.00 177.00 177.80 2eox n SER 42 N 2.52 -0.80 -0.51 6.66 7.64 -1.26 -4.75 113.62 123.11 2eox n SER 42 Ca 0.06 0.84 0.43 0.00 1.01 0.00 0.00 58.87 61.21 2eox n SER 42 Cb 0.43 -1.16 0.76 0.00 -1.01 0.00 0.00 64.21 63.23 2eox n SER 42 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2eox h SER 43 N 0.62 0.06 0.00 6.43 4.64 -2.04 -3.57 113.55 119.69 2eox h SER 43 Ca -0.43 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2eox h SER 43 Cb 1.39 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 2eox h SER 43 CO 0.50 -0.02 0.00 0.61 -0.87 0.00 0.00 176.83 177.04