#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eoi h SER 2 N 0.00 0.08 -6.26 1.61 4.64 -2.10 -3.45 113.55 108.08 2eoi h SER 2 Ca 0.00 -0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.86 2eoi h SER 2 Cb 0.00 -0.02 -0.22 0.00 -0.31 0.00 0.00 62.40 61.85 2eoi h SER 2 CO 0.00 0.07 -0.68 -0.24 -0.87 0.00 0.00 176.83 175.12 2eoi n SER 3 N -4.51 -0.43 -0.08 4.97 2.88 -1.26 -4.79 113.62 110.41 2eoi n SER 3 Ca -0.02 -0.91 -0.07 0.00 -1.33 0.00 0.00 58.87 56.54 2eoi n SER 3 Cb 0.10 -1.16 -0.02 0.00 -0.75 0.00 0.00 64.21 62.38 2eoi n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eoi n GLY 4 N -1.46 -0.71 3.87 0.46 0.00 -1.26 -5.05 105.19 101.04 2eoi n GLY 4 Ca -0.06 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.45 2eoi n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eoi s SER 5 N -5.68 4.53 -0.09 1.61 0.15 -1.26 -5.13 113.70 107.84 2eoi s SER 5 Ca -0.21 -1.30 -0.10 0.00 0.70 0.00 0.00 55.95 55.04 2eoi s SER 5 Cb 0.03 0.36 -0.05 0.00 -1.71 0.00 0.00 66.02 64.65 2eoi s SER 5 CO 0.31 -1.01 0.22 -0.55 1.20 0.00 0.00 173.24 173.41 2eoi s SER 6 N -4.18 6.51 0.00 5.45 0.15 -1.26 -4.94 113.70 115.43 2eoi s SER 6 Ca 0.29 0.60 0.00 0.00 0.70 0.00 0.00 55.95 57.55 2eoi s SER 6 Cb -0.01 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 2eoi s SER 6 CO 0.18 0.37 0.00 0.61 1.20 0.00 0.00 173.24 175.60 2eoi n GLY 7 N 2.03 0.05 3.88 9.45 0.00 -1.26 -5.11 105.19 114.23 2eoi n GLY 7 Ca -0.18 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 2eoi n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eoi s GLU 8 N -1.00 3.68 -0.03 1.61 8.01 -1.26 -5.09 118.70 124.63 2eoi s GLU 8 Ca 0.00 0.54 -0.01 0.00 0.01 0.00 0.00 54.97 55.51 2eoi s GLU 8 Cb 0.00 -2.26 0.02 0.00 -4.31 0.00 0.00 34.13 27.58 2eoi s GLU 8 CO 0.00 -0.27 0.05 0.15 0.01 0.00 0.00 175.26 175.20 2eoi s LYS 9 N -4.52 0.01 -0.08 1.61 1.02 -1.26 -5.15 119.74 111.37 2eoi s LYS 9 Ca 0.52 0.17 0.03 0.00 0.02 0.00 0.00 55.97 56.72 2eoi s LYS 9 Cb -0.10 -0.15 -0.02 0.00 -0.52 0.00 0.00 37.83 37.04 2eoi s LYS 9 CO 0.42 -0.12 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.05 2eoi s LEU 10 N 0.75 2.52 -0.20 3.17 1.02 -1.26 -5.10 118.68 119.59 2eoi s LEU 10 Ca -0.06 -0.34 -0.24 0.00 0.02 0.00 0.00 54.13 53.51 2eoi s LEU 10 Cb -0.09 -1.52 -0.01 0.00 0.02 0.00 0.00 46.19 44.59 2eoi s LEU 10 CO -0.03 0.26 0.78 -1.00 0.02 0.00 0.00 176.35 176.38 2eoi s HIS 11 N -0.21 3.37 0.25 0.29 3.76 -1.26 -4.96 115.29 116.53 2eoi s HIS 11 Ca -0.01 1.13 0.10 0.00 -0.15 0.00 0.00 55.06 56.14 2eoi s HIS 11 Cb -0.13 -2.98 -0.04 0.00 1.11 0.00 0.00 32.58 30.54 2eoi s HIS 11 CO 0.03 -0.28 -0.06 -1.83 -0.85 0.00 0.00 174.74 171.75 2eoi s GLU 12 N 2.34 2.13 1.03 1.40 -1.05 -1.26 -2.13 118.70 121.17 2eoi s GLU 12 Ca 0.35 -1.43 -0.15 0.00 -0.15 0.00 0.00 54.97 53.59 2eoi s GLU 12 Cb -0.16 -2.10 0.21 0.00 -0.44 0.00 0.00 34.13 31.64 2eoi s GLU 12 CO 0.10 0.38 1.13 0.00 0.95 0.00 0.00 175.26 177.82 2eoi n SER 14 N -4.21 2.77 -0.10 0.00 7.64 -1.26 -3.45 113.62 115.01 2eoi n SER 14 Ca 0.09 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.74 2eoi n SER 14 Cb 0.59 1.29 -0.12 0.00 -1.01 0.00 0.00 64.21 64.96 2eoi n SER 14 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2eoi n GLU 15 N -1.95 0.58 -0.00 1.43 1.02 -1.26 -4.51 120.64 115.95 2eoi n GLU 15 Ca -0.05 0.53 0.09 0.00 -0.02 0.00 0.00 57.16 57.72 2eoi n GLU 15 Cb 0.37 -1.73 -0.13 0.00 -0.02 0.00 0.00 31.44 29.94 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 -1.81 -7.07 -3.80 0.00 5.12 -1.22 -4.95 116.66 102.92 2eoi n ARG 17 Ca -0.00 0.77 -0.37 0.00 -1.93 0.00 0.00 57.85 56.33 2eoi n ARG 17 Cb 0.39 -5.64 -0.07 0.00 -1.16 0.00 0.00 32.46 25.99 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 -5.96 3.71 0.45 5.56 2.20 -1.26 -4.60 119.74 119.83 2eoi s LYS 18 Ca 0.40 -0.10 -0.12 0.00 -0.36 0.00 0.00 55.97 55.78 2eoi s LYS 18 Cb -0.18 -3.26 -0.07 0.00 -1.51 0.00 0.00 37.83 32.82 2eoi s LYS 18 CO 0.68 0.62 0.84 0.95 -0.36 0.00 0.00 175.35 178.08 2eoi s THR 19 N -0.60 4.72 0.03 3.43 -4.23 -1.26 -0.55 115.64 117.17 2eoi s THR 19 Ca 0.14 0.78 0.01 0.00 -1.18 0.00 0.00 61.69 61.43 2eoi s THR 19 Cb -0.12 -3.74 -0.02 0.00 1.34 0.00 0.00 72.50 69.96 2eoi s THR 19 CO 0.03 -0.60 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.10 2eoi s PHE 20 N -2.49 0.40 0.25 3.99 0.40 -0.90 -4.97 117.98 114.66 2eoi s PHE 20 Ca 0.53 -0.53 -0.03 0.00 -0.60 0.00 0.00 56.93 56.30 2eoi s PHE 20 Cb -0.10 -0.26 0.45 0.00 0.51 0.00 0.00 43.02 43.61 2eoi s PHE 20 CO 0.33 -0.16 1.80 0.66 0.70 0.00 0.00 175.22 178.55 2eoi h SER 21 N 4.56 0.65 -4.61 1.36 4.64 -1.99 -3.39 113.55 114.77 2eoi h SER 21 Ca -0.33 0.06 -0.20 0.00 -0.47 0.00 0.00 61.79 60.85 2eoi h SER 21 Cb 1.21 -0.06 -0.23 0.00 -0.31 0.00 0.00 62.40 63.01 2eoi h SER 21 CO 0.41 0.34 -0.71 -0.36 -0.87 0.00 0.00 176.83 175.65 2eoi s PHE 22 N -6.01 0.22 0.23 4.77 0.08 -1.26 -4.93 117.98 111.08 2eoi s PHE 22 Ca -0.12 -0.38 -0.06 0.00 0.12 0.00 0.00 56.93 56.49 2eoi s PHE 22 Cb 0.20 -0.16 0.37 0.00 -0.57 0.00 0.00 43.02 42.86 2eoi s PHE 22 CO 0.78 -0.13 1.76 1.25 -0.10 0.00 0.00 175.22 178.78 2eoi h HIS 23 N 5.07 0.57 -0.91 0.36 2.76 -1.90 -2.12 115.15 118.98 2eoi h HIS 23 Ca -0.30 0.03 0.19 0.00 -2.20 0.00 0.00 60.37 58.09 2eoi h HIS 23 Cb 1.21 -0.15 -0.17 0.00 1.55 0.00 0.00 27.41 29.85 2eoi h HIS 23 CO 0.59 0.16 -0.19 0.45 -1.30 0.00 0.00 177.93 177.64 2eoi n SER 24 N -4.92 -0.30 0.16 3.26 2.88 -1.26 -0.26 113.62 113.19 2eoi n SER 24 Ca 0.12 1.57 -0.14 0.00 -1.33 0.00 0.00 58.87 59.09 2eoi n SER 24 Cb 0.32 -0.49 -0.08 0.00 -0.75 0.00 0.00 64.21 63.21 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 -0.40 -0.85 -1.46 1.08 -1.81 -3.17 115.11 108.50 2eoi h GLN 25 Ca 0.46 0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.76 2eoi h GLN 25 Cb 0.74 0.09 -0.10 0.00 -0.05 0.00 0.00 27.48 28.16 2eoi h GLN 25 CO -0.93 -0.11 -0.50 -0.11 -0.95 0.00 0.00 178.83 176.23 2eoi n LEU 26 N -5.16 -0.90 -0.28 1.46 7.94 0.64 0.18 117.00 120.87 2eoi n LEU 26 Ca -0.10 1.62 0.06 0.00 -1.11 0.00 0.00 56.01 56.48 2eoi n LEU 26 Cb 0.25 -0.25 0.16 0.00 0.53 0.00 0.00 43.42 44.12 2eoi n LEU 26 CO 0.32 -1.29 0.79 0.58 -1.11 0.00 0.00 177.39 176.68 2eoi h VAL 27 N 0.00 0.25 -0.70 1.96 2.07 -1.39 0.46 116.25 118.90 2eoi h VAL 27 Ca 0.14 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 2eoi h VAL 27 Cb 0.35 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2eoi h VAL 27 CO -0.80 0.01 0.31 0.40 0.02 0.00 0.00 177.57 177.51 2eoi h ILE 28 N 0.06 1.23 0.43 4.57 2.04 -0.24 -3.07 117.51 122.54 2eoi h ILE 28 Ca 0.43 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 2eoi h ILE 28 Cb 0.76 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2eoi h ILE 28 CO -0.75 0.28 -0.20 -0.74 0.00 0.00 0.00 178.15 176.74 2eoi h HIS 29 N 1.01 -0.53 -1.20 1.37 2.76 0.22 -2.57 115.15 116.20 2eoi h HIS 29 Ca 0.24 -0.01 0.35 0.00 -2.20 0.00 0.00 60.37 58.75 2eoi h HIS 29 Cb 0.14 0.18 -0.05 0.00 1.55 0.00 0.00 27.41 29.23 2eoi h HIS 29 CO 0.01 -0.26 1.20 1.04 -1.30 0.00 0.00 177.93 178.63 2eoi n GLN 30 N -5.28 0.01 0.36 5.26 6.02 -0.18 0.16 117.38 123.73 2eoi n GLN 30 Ca -0.11 0.98 -0.18 0.00 -0.01 0.00 0.00 57.00 57.68 2eoi n GLN 30 Cb 0.27 -2.38 -0.09 0.00 1.02 0.00 0.00 30.24 29.06 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 -0.91 -1.09 -1.09 3.08 -1.52 -2.39 114.38 110.47 2eoi h ARG 31 Ca 0.57 0.06 0.36 0.00 0.07 0.00 0.00 59.98 61.04 2eoi h ARG 31 Cb 2.97 0.21 -0.09 0.00 0.08 0.00 0.00 29.97 33.13 2eoi h ARG 31 CO -0.01 -0.61 0.72 0.44 -1.07 0.00 0.00 179.97 179.45 2eoi n ILE 32 N -5.51 -0.14 -0.02 2.04 -5.35 0.12 0.16 119.36 110.66 2eoi n ILE 32 Ca -0.13 1.24 -0.12 0.00 -0.27 0.00 0.00 62.75 63.48 2eoi n ILE 32 Cb 0.40 -2.05 -0.10 0.00 -1.74 0.00 0.00 39.64 36.15 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 -0.05 -0.03 4.28 3.86 -1.56 -3.35 115.15 118.30 2eoi h HIS 33 Ca 0.64 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.85 2eoi h HIS 33 Cb 2.19 0.02 -0.00 0.00 1.06 0.00 0.00 27.41 30.68 2eoi h HIS 33 CO -0.00 0.61 0.02 1.79 0.86 0.00 0.00 177.93 181.20 2eoi h THR 34 N -0.85 1.08 0.00 2.45 1.35 0.17 -3.37 112.91 113.74 2eoi h THR 34 Ca -0.01 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 2eoi h THR 34 Cb 0.68 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2eoi h THR 34 CO 0.01 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.96 2eoi n GLY 35 N -0.84 0.00 3.59 5.82 0.00 0.10 -4.61 105.19 109.25 2eoi n GLY 35 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2eoi n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eoi s GLU 36 N 0.00 0.04 0.48 1.61 2.02 -1.25 -4.93 118.70 116.66 2eoi s GLU 36 Ca 0.00 0.97 -0.23 0.00 0.02 0.00 0.00 54.97 55.72 2eoi s GLU 36 Cb 0.00 -1.66 -0.08 0.00 0.10 0.00 0.00 34.13 32.49 2eoi s GLU 36 CO 0.00 -3.12 1.23 0.09 0.02 0.00 0.00 175.26 173.48 2eoi n ASN 37 N -4.51 2.23 -4.70 -0.19 4.13 -1.26 -4.87 115.26 106.10 2eoi n ASN 37 Ca 0.06 1.03 -0.42 0.00 1.68 0.00 0.00 54.58 56.93 2eoi n ASN 37 Cb 0.54 -1.49 -0.03 0.00 -1.54 0.00 0.00 39.78 37.26 2eoi n ASN 37 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2eoi s PRO 38 N -2.43 4.30 -0.56 3.52 0.04 -1.26 -4.99 135.00 133.61 2eoi s PRO 38 Ca 0.66 2.03 0.04 0.00 0.04 0.00 0.00 61.00 63.77 2eoi s PRO 38 Cb -0.48 -3.42 0.15 0.00 0.04 0.00 0.00 34.50 30.79 2eoi s PRO 38 CO 0.54 -0.51 0.34 -1.54 0.04 0.00 0.00 177.00 175.87 2eoi s SER 39 N 1.52 4.25 -0.06 6.66 1.04 -1.26 -5.07 113.70 120.78 2eoi s SER 39 Ca 0.65 -3.23 -0.14 0.00 0.48 0.00 0.00 55.95 53.70 2eoi s SER 39 Cb -0.34 -1.49 0.03 0.00 0.10 0.00 0.00 66.02 64.32 2eoi s SER 39 CO 0.29 -0.19 0.34 -0.83 0.98 0.00 0.00 173.24 173.83 2eoi s GLY 40 N -0.55 -0.20 -0.59 7.32 0.00 -1.26 -5.11 107.32 106.92 2eoi s GLY 40 Ca 0.20 0.58 -0.27 0.00 0.00 0.00 0.00 44.72 45.24 2eoi s GLY 40 CO -0.06 0.39 1.86 2.56 0.00 0.00 0.00 173.10 177.84 2eoi s PRO 41 N -0.81 2.67 0.08 2.90 0.04 -1.26 -4.97 135.00 133.65 2eoi s PRO 41 Ca -0.09 0.66 0.09 0.00 0.04 0.00 0.00 61.00 61.70 2eoi s PRO 41 Cb -0.04 -4.37 -0.03 0.00 0.04 0.00 0.00 34.50 30.09 2eoi s PRO 41 CO 0.03 -2.68 -0.24 -1.54 0.04 0.00 0.00 177.00 172.62 2eoi s SER 42 N 7.97 3.44 0.93 6.66 1.04 -1.26 -5.13 113.70 127.34 2eoi s SER 42 Ca 0.68 -0.61 -0.11 0.00 0.48 0.00 0.00 55.95 56.39 2eoi s SER 42 Cb -0.13 -0.36 0.15 0.00 0.10 0.00 0.00 66.02 65.77 2eoi s SER 42 CO 0.22 0.22 1.09 -0.55 0.98 0.00 0.00 173.24 175.20 2eoi s SER 43 N -1.68 3.14 0.00 7.02 0.15 -1.26 -5.30 113.70 115.78 2eoi s SER 43 Ca 0.14 1.60 0.00 0.00 0.70 0.00 0.00 55.95 58.38 2eoi s SER 43 Cb -0.10 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 2eoi s SER 43 CO 0.05 -2.86 0.00 0.61 1.20 0.00 0.00 173.24 172.24