#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eoi s SER 2 N 0.00 5.94 -0.03 1.61 0.01 -1.26 -5.06 113.70 114.91 2eoi s SER 2 Ca 0.00 2.05 0.01 0.00 1.31 0.00 0.00 55.95 59.32 2eoi s SER 2 Cb 0.00 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.67 2eoi s SER 2 CO 0.00 -1.06 -0.05 -0.55 0.41 0.00 0.00 173.24 171.98 2eoi s SER 3 N -1.96 0.89 -0.05 2.44 0.15 -1.26 -5.14 113.70 108.76 2eoi s SER 3 Ca 0.70 -0.13 0.04 0.00 0.70 0.00 0.00 55.95 57.26 2eoi s SER 3 Cb -0.20 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 63.78 2eoi s SER 3 CO 0.26 -0.00 -0.17 -0.83 1.20 0.00 0.00 173.24 173.69 2eoi s GLY 4 N 0.53 0.94 0.51 9.45 0.00 -1.26 -5.14 107.32 112.35 2eoi s GLY 4 Ca -0.07 -0.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.89 2eoi s GLY 4 CO 0.00 -0.25 0.89 -0.45 0.00 0.00 0.00 173.10 173.29 2eoi s SER 5 N 0.20 6.40 0.08 1.64 0.15 -1.26 -5.10 113.70 115.82 2eoi s SER 5 Ca -0.08 1.26 -0.01 0.00 0.70 0.00 0.00 55.95 57.82 2eoi s SER 5 Cb -0.13 -2.39 -0.04 0.00 -1.71 0.00 0.00 66.02 61.75 2eoi s SER 5 CO 0.03 -0.61 -0.00 -0.94 1.20 0.00 0.00 173.24 172.92 2eoi s SER 6 N -3.65 0.46 0.00 5.45 1.04 -1.26 -5.00 113.70 110.74 2eoi s SER 6 Ca 0.53 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.89 2eoi s SER 6 Cb -0.10 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.24 2eoi s SER 6 CO 0.41 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.60 2eoi n GLY 7 N 0.03 1.48 3.57 7.32 0.00 -1.26 -5.14 105.19 111.20 2eoi n GLY 7 Ca -0.11 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2eoi n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eoi n GLU 8 N 0.00 1.15 -2.77 1.61 4.71 -1.26 -4.89 120.64 119.19 2eoi n GLU 8 Ca 0.00 0.41 -0.42 0.00 -0.01 0.00 0.00 57.16 57.14 2eoi n GLU 8 Cb 0.00 -1.90 0.01 0.00 -1.01 0.00 0.00 31.44 28.54 2eoi n GLU 8 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2eoi n LYS 9 N 0.26 4.84 -2.99 3.49 4.81 -1.26 -5.01 118.16 122.30 2eoi n LYS 9 Ca 0.10 -4.49 -0.26 0.00 -0.87 0.00 0.00 58.31 52.78 2eoi n LYS 9 Cb 0.39 -2.52 -0.01 0.00 0.02 0.00 0.00 35.03 32.90 2eoi n LYS 9 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2eoi s LEU 10 N -3.25 3.83 -0.12 3.14 1.43 -1.26 -4.94 118.68 117.51 2eoi s LEU 10 Ca 0.36 0.75 0.03 0.00 -1.03 0.00 0.00 54.13 54.24 2eoi s LEU 10 Cb 0.12 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2eoi s LEU 10 CO -0.00 -0.42 -0.22 -1.00 0.23 0.00 0.00 176.35 174.94 2eoi s HIS 11 N -2.49 2.63 0.15 0.29 3.76 -1.26 -5.00 115.29 113.36 2eoi s HIS 11 Ca 0.45 -1.07 0.07 0.00 -0.15 0.00 0.00 55.06 54.36 2eoi s HIS 11 Cb -0.10 -1.76 -0.04 0.00 1.11 0.00 0.00 32.58 31.79 2eoi s HIS 11 CO 0.39 -0.44 -0.02 -1.83 -0.85 0.00 0.00 174.74 171.98 2eoi s GLU 12 N 0.48 2.36 1.05 1.40 -1.05 -1.26 -1.65 118.70 120.02 2eoi s GLU 12 Ca -0.14 -1.05 -0.13 0.00 -0.15 0.00 0.00 54.97 53.50 2eoi s GLU 12 Cb -0.17 -2.37 0.22 0.00 -0.44 0.00 0.00 34.13 31.36 2eoi s GLU 12 CO 0.06 0.48 1.08 0.00 0.95 0.00 0.00 175.26 177.82 2eoi n SER 14 N -4.37 1.57 -0.13 0.00 2.88 -1.26 -3.38 113.62 108.93 2eoi n SER 14 Ca 0.05 -0.33 -0.27 0.00 -1.33 0.00 0.00 58.87 56.99 2eoi n SER 14 Cb 0.57 1.30 -0.11 0.00 -0.75 0.00 0.00 64.21 65.22 2eoi n SER 14 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2eoi n GLU 15 N -1.62 0.60 -0.00 -1.46 1.02 -1.26 -4.62 120.64 113.30 2eoi n GLU 15 Ca -0.00 0.27 0.09 0.00 -0.02 0.00 0.00 57.16 57.49 2eoi n GLU 15 Cb 0.24 -1.52 -0.12 0.00 -0.02 0.00 0.00 31.44 30.02 2eoi n GLU 15 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2eoi n ARG 17 N -1.71 -6.82 -4.24 0.00 5.12 -1.22 -4.95 116.66 102.84 2eoi n ARG 17 Ca 0.01 0.83 -0.34 0.00 -1.93 0.00 0.00 57.85 56.41 2eoi n ARG 17 Cb 0.35 -5.81 -0.10 0.00 -1.16 0.00 0.00 32.46 25.74 2eoi n ARG 17 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2eoi s LYS 18 N -5.56 3.52 0.47 5.56 2.20 -1.26 -4.63 119.74 120.03 2eoi s LYS 18 Ca 0.14 -0.41 -0.14 0.00 -0.36 0.00 0.00 55.97 55.20 2eoi s LYS 18 Cb -0.06 -2.98 -0.07 0.00 -1.51 0.00 0.00 37.83 33.21 2eoi s LYS 18 CO 0.72 0.44 0.90 0.95 -0.36 0.00 0.00 175.35 178.00 2eoi s THR 19 N -0.15 4.63 0.07 3.43 -4.23 -1.26 -0.50 115.64 117.62 2eoi s THR 19 Ca 0.05 1.00 0.01 0.00 -1.18 0.00 0.00 61.69 61.57 2eoi s THR 19 Cb -0.12 -3.72 -0.03 0.00 1.34 0.00 0.00 72.50 69.96 2eoi s THR 19 CO 0.02 -0.61 -0.06 -0.36 -0.54 0.00 0.00 174.62 173.07 2eoi s PHE 20 N -2.51 0.71 0.15 3.99 0.40 -0.66 -4.96 117.98 115.11 2eoi s PHE 20 Ca 0.56 -0.77 -0.17 0.00 -0.60 0.00 0.00 56.93 55.96 2eoi s PHE 20 Cb -0.10 -0.43 0.06 0.00 0.51 0.00 0.00 43.02 43.05 2eoi s PHE 20 CO 0.31 -0.16 1.74 0.77 0.70 0.00 0.00 175.22 178.57 2eoi h SER 21 N 3.63 0.07 -3.86 1.36 0.02 -1.99 -3.35 113.55 109.43 2eoi h SER 21 Ca -0.35 0.05 -0.25 0.00 -0.84 0.00 0.00 61.79 60.39 2eoi h SER 21 Cb 1.18 0.05 -0.28 0.00 0.14 0.00 0.00 62.40 63.49 2eoi h SER 21 CO 0.55 0.08 -0.73 -0.36 -1.14 0.00 0.00 176.83 175.23 2eoi s PHE 22 N -6.16 0.16 0.27 3.45 0.40 -1.26 -4.87 117.98 109.97 2eoi s PHE 22 Ca -0.13 -0.06 -0.05 0.00 -0.60 0.00 0.00 56.93 56.08 2eoi s PHE 22 Cb 0.12 -0.10 0.52 0.00 0.51 0.00 0.00 43.02 44.07 2eoi s PHE 22 CO 0.71 -0.01 1.59 1.25 0.70 0.00 0.00 175.22 179.45 2eoi h HIS 23 N 6.00 -0.26 -0.74 0.36 2.76 -1.91 0.03 115.15 121.39 2eoi h HIS 23 Ca -0.26 0.07 0.12 0.00 -2.20 0.00 0.00 60.37 58.10 2eoi h HIS 23 Cb 1.20 0.26 -0.12 0.00 1.55 0.00 0.00 27.41 30.30 2eoi h HIS 23 CO 0.43 -0.37 -0.28 0.45 -1.30 0.00 0.00 177.93 176.85 2eoi n SER 24 N -5.51 -0.47 0.30 3.26 2.88 -1.26 0.24 113.62 113.07 2eoi n SER 24 Ca 0.17 1.30 -0.17 0.00 -1.33 0.00 0.00 58.87 58.84 2eoi n SER 24 Cb 0.55 -0.30 -0.09 0.00 -0.75 0.00 0.00 64.21 63.63 2eoi n SER 24 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 2eoi h GLN 25 N 0.00 -0.70 -0.42 -1.46 7.50 -1.41 -3.13 115.11 115.49 2eoi h GLN 25 Ca 0.26 0.05 0.04 0.00 0.50 0.00 0.00 58.65 59.50 2eoi h GLN 25 Cb 0.45 0.16 -0.05 0.00 0.05 0.00 0.00 27.48 28.09 2eoi h GLN 25 CO -0.74 -0.47 -0.25 -0.11 -1.50 0.00 0.00 178.83 175.77 2eoi n LEU 26 N -5.40 -0.45 -0.34 1.46 7.94 0.14 0.40 117.00 120.75 2eoi n LEU 26 Ca -0.12 1.25 0.18 0.00 -1.11 0.00 0.00 56.01 56.21 2eoi n LEU 26 Cb 0.30 -0.35 0.35 0.00 0.53 0.00 0.00 43.42 44.25 2eoi n LEU 26 CO 0.37 -0.86 0.86 0.58 -1.11 0.00 0.00 177.39 177.23 2eoi h VAL 27 N 0.00 0.03 -0.48 1.96 2.07 -1.39 1.38 116.25 119.82 2eoi h VAL 27 Ca 0.07 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 67.52 2eoi h VAL 27 Cb 0.17 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.93 2eoi h VAL 27 CO -0.39 0.00 0.06 0.40 0.02 0.00 0.00 177.57 177.66 2eoi h ILE 28 N 0.02 1.23 0.19 4.57 2.04 0.00 -3.11 117.51 122.45 2eoi h ILE 28 Ca 0.64 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 2eoi h ILE 28 Cb 1.42 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2eoi h ILE 28 CO -0.88 0.32 -0.09 -0.74 0.00 0.00 0.00 178.15 176.75 2eoi h HIS 29 N 0.73 -0.24 -1.37 1.37 2.76 0.35 -2.86 115.15 115.89 2eoi h HIS 29 Ca 0.15 -0.01 0.40 0.00 -2.20 0.00 0.00 60.37 58.71 2eoi h HIS 29 Cb 0.36 0.08 -0.05 0.00 1.55 0.00 0.00 27.41 29.34 2eoi h HIS 29 CO 0.02 0.07 1.26 1.04 -1.30 0.00 0.00 177.93 179.02 2eoi n GLN 30 N -5.07 0.01 0.28 5.26 6.02 -0.27 0.16 117.38 123.77 2eoi n GLN 30 Ca -0.09 1.01 -0.16 0.00 -0.01 0.00 0.00 57.00 57.74 2eoi n GLN 30 Cb 0.22 -2.43 -0.08 0.00 1.02 0.00 0.00 30.24 28.98 2eoi n GLN 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2eoi h ARG 31 N 0.00 -0.77 -1.32 -1.09 3.08 -1.57 -2.09 114.38 110.62 2eoi h ARG 31 Ca 0.65 0.05 0.45 0.00 0.07 0.00 0.00 59.98 61.20 2eoi h ARG 31 Cb 3.16 0.17 -0.12 0.00 0.08 0.00 0.00 29.97 33.26 2eoi h ARG 31 CO -0.01 -0.51 0.87 0.44 -1.07 0.00 0.00 179.97 179.69 2eoi n ILE 32 N -5.47 -0.20 -0.03 2.04 -5.35 0.12 0.11 119.36 110.59 2eoi n ILE 32 Ca -0.11 1.62 -0.15 0.00 -0.27 0.00 0.00 62.75 63.83 2eoi n ILE 32 Cb 0.36 -2.65 -0.12 0.00 -1.74 0.00 0.00 39.64 35.49 2eoi n ILE 32 CO 0.00 0.00 0.00 0.45 -1.76 0.00 0.00 176.55 175.24 2eoi h HIS 33 N 0.00 0.22 -1.84 4.28 3.86 -1.51 -3.40 115.15 116.76 2eoi h HIS 33 Ca 0.81 -0.13 -0.65 0.00 -1.16 0.00 0.00 60.37 59.24 2eoi h HIS 33 Cb 2.69 -0.02 -0.14 0.00 1.06 0.00 0.00 27.41 31.00 2eoi h HIS 33 CO -0.00 1.00 1.14 0.95 0.86 0.00 0.00 177.93 181.87 2eoi s THR 34 N -2.81 4.39 0.00 2.45 -4.23 0.31 -4.85 115.64 110.91 2eoi s THR 34 Ca -0.16 -1.27 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 2eoi s THR 34 Cb -0.00 -4.90 0.00 0.00 1.34 0.00 0.00 72.50 68.93 2eoi s THR 34 CO 0.74 -1.70 0.00 0.61 -0.54 0.00 0.00 174.62 173.73 2eoi n GLY 35 N 6.04 1.18 3.92 3.99 0.00 -1.25 -4.81 105.19 114.26 2eoi n GLY 35 Ca 0.28 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.03 2eoi n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eoi s GLU 36 N 2.10 3.56 0.45 1.61 2.56 -1.26 -5.06 118.70 122.66 2eoi s GLU 36 Ca 0.00 -0.23 -0.25 0.00 0.00 0.00 0.00 54.97 54.50 2eoi s GLU 36 Cb 0.00 -2.77 -0.08 0.00 2.00 0.00 0.00 34.13 33.29 2eoi s GLU 36 CO 0.00 0.33 1.33 -0.80 -0.56 0.00 0.00 175.26 175.56 2eoi s ASN 37 N -3.19 5.96 1.09 -1.70 -0.87 -1.26 -5.01 114.94 109.96 2eoi s ASN 37 Ca 0.40 2.70 -0.15 0.00 -1.57 0.00 0.00 52.86 54.24 2eoi s ASN 37 Cb -0.11 -2.64 0.23 0.00 -0.02 0.00 0.00 41.25 38.72 2eoi s ASN 37 CO 0.29 -1.09 1.10 -2.16 -2.57 0.00 0.00 177.10 172.67 2eoi s PRO 38 N -2.49 -0.32 0.49 -0.60 0.04 -1.26 -4.95 135.00 125.91 2eoi s PRO 38 Ca 0.62 0.26 -0.21 0.00 0.04 0.00 0.00 61.00 61.70 2eoi s PRO 38 Cb -0.39 -1.67 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 2eoi s PRO 38 CO 0.49 -3.18 0.76 0.43 0.04 0.00 0.00 177.00 175.54 2eoi n SER 39 N -4.44 0.03 0.00 6.66 7.64 -1.26 -4.73 113.62 117.51 2eoi n SER 39 Ca 0.08 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.85 2eoi n SER 39 Cb 0.58 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 2eoi n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eoi n GLY 40 N 1.51 -2.03 0.11 0.23 0.00 -1.26 -4.71 105.19 99.05 2eoi n GLY 40 Ca 0.11 -1.30 0.11 0.00 0.00 0.00 0.00 46.02 44.94 2eoi n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eoi n PRO 41 N -0.67 0.16 -3.49 1.61 -0.04 -1.26 -4.64 135.00 126.66 2eoi n PRO 41 Ca 0.00 0.40 -0.37 0.00 -0.04 0.00 0.00 63.50 63.48 2eoi n PRO 41 Cb 0.00 -1.81 -0.08 0.00 -0.04 0.00 0.00 33.50 31.57 2eoi n PRO 41 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2eoi s SER 42 N -4.01 6.32 0.22 3.54 1.04 -1.26 -5.08 113.70 114.47 2eoi s SER 42 Ca 0.05 0.37 0.10 0.00 0.48 0.00 0.00 55.95 56.95 2eoi s SER 42 Cb 0.09 -2.18 -0.05 0.00 0.10 0.00 0.00 66.02 63.98 2eoi s SER 42 CO 0.36 -0.02 -0.20 -0.44 0.98 0.00 0.00 173.24 173.93 2eoi s SER 43 N 1.02 3.21 0.00 7.02 0.01 -1.26 -4.96 113.70 118.74 2eoi s SER 43 Ca 0.15 -0.95 0.21 0.00 1.31 0.00 0.00 55.95 56.67 2eoi s SER 43 Cb -0.14 -0.23 1.25 0.00 0.21 0.00 0.00 66.02 67.10 2eoi s SER 43 CO 0.06 0.02 1.63 0.61 0.41 0.00 0.00 173.24 175.97