#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 -0.77 0.08 1.61 0.01 -1.26 -5.17 113.70 108.19 2eoi s SER 2 Ca 0.00 1.29 0.06 0.00 1.31 0.00 0.00 55.95 58.61 2eoi s SER 2 Cb 0.00 1.32 -0.03 0.00 0.21 0.00 0.00 66.02 67.52 2eoi s SER 2 CO 0.00 -0.21 -0.16 -0.55 0.41 0.00 0.00 173.24 172.73 2eoi s SER 3 N 1.24 1.91 0.00 2.44 0.15 -1.26 -5.12 113.70 113.06 2eoi s SER 3 Ca -0.07 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 55.96 2eoi s SER 3 Cb -0.05 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.18 2eoi s SER 3 CO -0.14 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 174.88 2eoi n GLY 4 N 1.28 3.90 3.70 9.45 0.00 -1.26 -5.08 105.19 117.19 2eoi n GLY 4 Ca -0.20 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 2eoi n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eoi s SER 5 N 0.00 7.03 0.03 1.61 1.04 -1.26 -5.00 113.70 117.15 2eoi s SER 5 Ca 0.00 1.98 -0.27 0.00 0.48 0.00 0.00 55.95 58.14 2eoi s SER 5 Cb 0.00 -2.57 0.09 0.00 0.10 0.00 0.00 66.02 63.64 2eoi s SER 5 CO 0.00 -0.54 0.77 -0.55 0.98 0.00 0.00 173.24 173.90 2eoi s SER 6 N 1.28 -0.48 0.54 7.02 0.15 -1.26 -5.15 113.70 115.80 2eoi s SER 6 Ca 0.59 0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.39 2eoi s SER 6 Cb -0.29 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2eoi s SER 6 CO 0.27 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.61 2eoi n GLY 7 N -0.01 -1.47 3.45 9.45 0.00 -1.26 -4.84 105.19 110.50 2eoi n GLY 7 Ca -0.13 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.36 2eoi n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eoi s GLU 8 N -0.03 2.86 -0.29 1.61 -1.05 -1.26 -5.01 118.70 115.54 2eoi s GLU 8 Ca 0.00 -0.67 0.06 0.00 -0.15 0.00 0.00 54.97 54.21 2eoi s GLU 8 Cb 0.00 -2.50 0.57 0.00 -0.44 0.00 0.00 34.13 31.76 2eoi s GLU 8 CO 0.00 0.47 1.63 1.63 0.95 0.00 0.00 175.26 179.95 2eoi n LYS 9 N 2.76 2.74 -2.91 -4.83 4.76 -1.26 -4.95 118.16 114.47 2eoi n LYS 9 Ca -0.18 -2.40 -0.28 0.00 -2.87 0.00 0.00 58.31 52.59 2eoi n LYS 9 Cb 0.52 -1.99 -0.02 0.00 -1.84 0.00 0.00 35.03 31.71 2eoi n LYS 9 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2eoi s LEU 10 N -2.43 3.80 0.63 -0.35 1.43 -1.26 -5.09 118.68 115.41 2eoi s LEU 10 Ca 0.44 0.88 -0.07 0.00 -1.03 0.00 0.00 54.13 54.35 2eoi s LEU 10 Cb 0.36 -3.78 0.02 0.00 0.03 0.00 0.00 46.19 42.82 2eoi s LEU 10 CO 0.10 -0.43 0.96 -1.00 0.23 0.00 0.00 176.35 176.21 2eoi s HIS 11 N -2.48 3.23 0.23 0.29 3.76 -1.26 -4.96 115.29 114.09 2eoi s HIS 11 Ca 0.47 0.71 -0.17 0.00 -0.15 0.00 0.00 55.06 55.91 2eoi s HIS 11 Cb -0.10 -2.87 0.02 0.00 1.11 0.00 0.00 32.58 30.74 2eoi s HIS 11 CO 0.38 -0.97 0.56 -1.83 -0.85 0.00 0.00 174.74 172.02 2eoi s GLU 12 N -5.10 1.51 0.93 1.40 1.03 -1.26 -2.23 118.70 114.98 2eoi s GLU 12 Ca 0.56 -0.97 -0.12 0.00 0.03 0.00 0.00 54.97 54.47 2eoi s GLU 12 Cb -0.11 0.53 0.15 0.00 -0.80 0.00 0.00 34.13 33.90 2eoi s GLU 12 CO 0.46 -0.65 1.10 0.00 -1.33 0.00 0.00 175.26 174.84 2eoi n SER 14 N -3.93 1.78 -0.07 0.00 2.88 -1.26 -3.22 113.62 109.81 2eoi n SER 14 Ca 0.06 -0.31 -0.21 0.00 -1.33 0.00 0.00 58.87 57.08 2eoi n SER 14 Cb 0.57 1.25 -0.13 0.00 -0.75 0.00 0.00 64.21 65.16 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 -1.58 0.68 -0.00 -1.46 -0.58 -1.26 -4.55 120.64 111.89 2eoi n GLU 15 Ca -0.00 0.25 0.05 0.00 -0.42 0.00 0.00 57.16 57.04 2eoi n GLU 15 Cb 0.21 -1.62 -0.06 0.00 -0.57 0.00 0.00 31.44 29.39 2eoi n GLU 15 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2eoi n ARG 17 N -1.44 -6.74 -3.49 0.00 5.12 -1.20 -4.97 116.66 103.95 2eoi n ARG 17 Ca 0.01 0.71 -0.38 0.00 -1.93 0.00 0.00 57.85 56.26 2eoi n ARG 17 Cb 0.19 -5.39 -0.06 0.00 -1.16 0.00 0.00 32.46 26.03 2eoi n ARG 17 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2eoi s LYS 18 N -6.05 4.00 0.50 5.56 1.02 -1.26 -4.65 119.74 118.87 2eoi s LYS 18 Ca 0.46 0.36 -0.12 0.00 0.02 0.00 0.00 55.97 56.70 2eoi s LYS 18 Cb -0.20 -3.27 -0.06 0.00 -0.52 0.00 0.00 37.83 33.77 2eoi s LYS 18 CO 0.62 0.56 0.91 0.95 -0.92 0.00 0.00 175.35 177.47 2eoi s THR 19 N -0.65 4.70 -0.05 2.17 -4.23 -1.26 0.28 115.64 116.60 2eoi s THR 19 Ca 0.23 0.83 -0.02 0.00 -1.18 0.00 0.00 61.69 61.54 2eoi s THR 19 Cb -0.16 -3.78 0.04 0.00 1.34 0.00 0.00 72.50 69.94 2eoi s THR 19 CO 0.12 -0.78 0.11 -0.36 -0.54 0.00 0.00 174.62 173.17 2eoi s PHE 20 N -2.70 -0.09 0.30 3.99 0.40 -0.95 -4.93 117.98 114.00 2eoi s PHE 20 Ca 0.54 0.39 0.03 0.00 -0.60 0.00 0.00 56.93 57.30 2eoi s PHE 20 Cb -0.10 -0.20 0.77 0.00 0.51 0.00 0.00 43.02 43.99 2eoi s PHE 20 CO 0.39 -0.17 1.62 1.03 0.70 0.00 0.00 175.22 178.79 2eoi h SER 21 N 7.61 -0.08 -3.61 1.36 0.87 -1.98 -3.39 113.55 114.32 2eoi h SER 21 Ca -0.35 0.22 -0.57 0.00 -1.23 0.00 0.00 61.79 59.87 2eoi h SER 21 Cb 1.13 0.32 -0.32 0.00 -0.44 0.00 0.00 62.40 63.08 2eoi h SER 21 CO 0.35 -0.22 -0.84 -0.36 -0.53 0.00 0.00 176.83 175.23 2eoi s PHE 22 N -5.92 1.77 0.17 2.24 0.08 -1.26 -4.92 117.98 110.13 2eoi s PHE 22 Ca -0.12 -0.61 -0.18 0.00 0.12 0.00 0.00 56.93 56.14 2eoi s PHE 22 Cb 0.27 -1.22 0.10 0.00 -0.57 0.00 0.00 43.02 41.60 2eoi s PHE 22 CO 0.77 -0.25 1.65 1.25 -0.10 0.00 0.00 175.22 178.54 2eoi h HIS 23 N 6.61 -0.37 -0.86 0.36 2.76 -1.94 -1.30 115.15 120.40 2eoi h HIS 23 Ca -0.29 0.04 0.26 0.00 -2.20 0.00 0.00 60.37 58.18 2eoi h HIS 23 Cb 1.19 0.23 -0.16 0.00 1.55 0.00 0.00 27.41 30.22 2eoi h HIS 23 CO 0.46 -0.24 0.11 0.43 -1.30 0.00 0.00 177.93 177.39 2eoi n SER 24 N -5.35 -0.02 0.11 3.26 7.64 -1.26 0.60 113.62 118.61 2eoi n SER 24 Ca 0.02 1.46 -0.13 0.00 1.01 0.00 0.00 58.87 61.22 2eoi n SER 24 Cb 0.26 -0.57 -0.08 0.00 -1.01 0.00 0.00 64.21 62.81 2eoi n SER 24 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2eoi h GLN 25 N 0.00 -0.26 -0.48 1.43 4.20 -1.64 -3.23 115.11 115.13 2eoi h GLN 25 Ca 0.56 0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.34 2eoi h GLN 25 Cb 1.24 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 29.02 2eoi h GLN 25 CO -0.78 -0.00 -0.32 1.25 -0.67 0.00 0.00 178.83 178.31 2eoi h LEU 26 N -0.50 -1.15 -1.00 1.46 5.85 0.28 0.43 115.31 120.68 2eoi h LEU 26 Ca -0.03 0.17 0.40 0.00 0.84 0.00 0.00 57.88 59.26 2eoi h LEU 26 Cb 0.38 0.50 -0.18 0.00 0.37 0.00 0.00 40.66 41.73 2eoi h LEU 26 CO 0.05 -0.15 0.46 0.52 -0.34 0.00 0.00 178.44 178.98 2eoi n VAL 27 N -4.22 -0.42 -0.18 1.05 0.31 -0.97 0.15 118.33 114.05 2eoi n VAL 27 Ca 0.00 2.05 -0.09 0.00 -0.01 0.00 0.00 64.34 66.29 2eoi n VAL 27 Cb 0.15 -3.28 0.01 0.00 -0.91 0.00 0.00 33.84 29.82 2eoi n VAL 27 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2eoi h ILE 28 N 0.00 1.25 0.47 2.52 2.04 -0.19 -3.20 117.51 120.39 2eoi h ILE 28 Ca 0.81 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 2eoi h ILE 28 Cb 2.09 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 2eoi h ILE 28 CO -0.79 0.34 -0.23 -0.74 0.00 0.00 0.00 178.15 176.74 2eoi h HIS 29 N 0.75 -0.58 -1.62 1.37 2.76 0.23 -2.51 115.15 115.55 2eoi h HIS 29 Ca 0.16 -0.01 0.47 0.00 -2.20 0.00 0.00 60.37 58.78 2eoi h HIS 29 Cb 0.42 0.19 -0.06 0.00 1.55 0.00 0.00 27.41 29.51 2eoi h HIS 29 CO 0.03 -0.33 1.19 1.04 -1.30 0.00 0.00 177.93 178.55 2eoi n GLN 30 N -5.34 0.00 0.23 5.26 6.02 -0.58 0.38 117.38 123.35 2eoi n GLN 30 Ca -0.11 0.90 -0.16 0.00 -0.01 0.00 0.00 57.00 57.62 2eoi n GLN 30 Cb 0.28 -2.10 -0.08 0.00 1.02 0.00 0.00 30.24 29.36 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 -1.23 -1.09 3.08 -1.52 -1.70 114.38 111.15 2eoi h ARG 31 Ca 0.77 0.05 0.39 0.00 0.07 0.00 0.00 59.98 61.26 2eoi h ARG 31 Cb 3.14 0.17 -0.09 0.00 0.08 0.00 0.00 29.97 33.27 2eoi h ARG 31 CO -0.01 -0.51 0.83 0.44 -1.07 0.00 0.00 179.97 179.65 2eoi n ILE 32 N -5.49 -0.12 -0.05 2.04 -5.35 0.16 0.01 119.36 110.57 2eoi n ILE 32 Ca -0.10 1.28 -0.00 0.00 -0.27 0.00 0.00 62.75 63.66 2eoi n ILE 32 Cb 0.39 -2.11 -0.00 0.00 -1.74 0.00 0.00 39.64 36.18 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 0.00 -2.47 4.28 3.86 -1.45 -3.44 115.15 115.93 2eoi h HIS 33 Ca 0.69 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 59.35 2eoi h HIS 33 Cb 2.44 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.87 2eoi h HIS 33 CO -0.00 0.00 1.28 0.95 0.86 0.00 0.00 177.93 181.02 2eoi s THR 34 N -1.56 3.48 0.00 2.45 -4.23 0.10 -4.10 115.64 111.78 2eoi s THR 34 Ca -0.01 0.43 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 2eoi s THR 34 Cb 0.00 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2eoi s THR 34 CO 0.01 -0.65 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 2eoi n GLY 35 N 5.49 -1.55 3.71 3.99 0.00 -1.26 -4.79 105.19 110.77 2eoi n GLY 35 Ca 0.21 0.55 -0.43 0.00 0.00 0.00 0.00 46.02 46.35 2eoi n GLY 35 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2eoi n GLU 36 N 0.00 2.45 -3.41 1.61 0.28 -1.26 -4.97 120.64 115.34 2eoi n GLU 36 Ca 0.00 0.88 -0.38 0.00 -0.16 0.00 0.00 57.16 57.50 2eoi n GLU 36 Cb 0.00 -2.64 -0.06 0.00 1.43 0.00 0.00 31.44 30.17 2eoi n GLU 36 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 2eoi s ASN 37 N 0.69 6.88 0.75 -1.84 3.84 -1.26 -5.07 114.94 118.92 2eoi s ASN 37 Ca 0.70 1.06 -0.12 0.00 0.21 0.00 0.00 52.86 54.72 2eoi s ASN 37 Cb -0.57 -2.29 0.04 0.00 -0.55 0.00 0.00 41.25 37.89 2eoi s ASN 37 CO 0.43 0.27 1.10 -2.16 -2.79 0.00 0.00 177.10 173.94 2eoi s PRO 38 N -1.28 2.38 -0.19 0.43 0.04 -1.26 -4.90 135.00 130.22 2eoi s PRO 38 Ca 0.28 1.22 -0.39 0.00 0.04 0.00 0.00 61.00 62.16 2eoi s PRO 38 Cb -0.17 -1.91 -0.15 0.00 0.04 0.00 0.00 34.50 32.31 2eoi s PRO 38 CO 0.16 -1.55 1.71 -1.13 0.04 0.00 0.00 177.00 176.23 2eoi n SER 39 N -3.26 2.47 0.00 6.66 3.41 -1.26 -4.82 113.62 116.82 2eoi n SER 39 Ca 0.09 1.07 0.00 0.00 -0.26 0.00 0.00 58.87 59.77 2eoi n SER 39 Cb 0.53 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 2eoi n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eoi n GLY 40 N 3.98 -1.17 3.56 5.00 0.00 -1.26 -5.07 105.19 110.23 2eoi n GLY 40 Ca 0.25 -0.94 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 2eoi n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eoi s PRO 41 N -0.78 2.57 0.24 1.61 0.04 -1.26 -4.90 135.00 132.52 2eoi s PRO 41 Ca 0.00 -0.12 -0.01 0.00 0.04 0.00 0.00 61.00 60.91 2eoi s PRO 41 Cb 0.00 -4.93 -0.03 0.00 0.04 0.00 0.00 34.50 29.58 2eoi s PRO 41 CO 0.00 -3.25 0.22 -1.12 0.04 0.00 0.00 177.00 172.89 2eoi s SER 42 N 8.04 0.46 0.03 6.66 0.01 -1.26 -5.07 113.70 122.57 2eoi s SER 42 Ca 0.69 -1.41 -0.23 0.00 1.31 0.00 0.00 55.95 56.31 2eoi s SER 42 Cb -0.08 0.46 -0.16 0.00 0.21 0.00 0.00 66.02 66.45 2eoi s SER 42 CO 0.03 -0.95 1.45 0.77 0.41 0.00 0.00 173.24 174.95 2eoi h SER 43 N 2.45 0.10 0.00 2.44 4.64 -2.03 -3.55 113.55 117.60 2eoi h SER 43 Ca -0.32 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 60.68 2eoi h SER 43 Cb 1.25 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2eoi h SER 43 CO 0.47 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.43