#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emc s SER 2 N 0.00 -0.46 -0.25 1.61 0.01 -1.26 -5.15 113.70 108.20 2emc s SER 2 Ca 0.00 0.66 -0.02 0.00 1.31 0.00 0.00 55.95 57.90 2emc s SER 2 Cb 0.00 0.69 0.14 0.00 0.21 0.00 0.00 66.02 67.06 2emc s SER 2 CO 0.00 -0.37 0.40 -0.44 0.41 0.00 0.00 173.24 173.24 2emc s SER 3 N -0.59 0.09 0.33 2.44 0.01 -1.26 -5.10 113.70 109.62 2emc s SER 3 Ca -0.07 0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.45 2emc s SER 3 Cb -0.03 1.22 0.00 0.00 0.21 0.00 0.00 66.02 67.42 2emc s SER 3 CO 0.04 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2emc n GLY 4 N 5.37 -4.86 3.10 3.44 0.00 -1.26 -4.89 105.19 106.09 2emc n GLY 4 Ca -0.03 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 2emc n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2emc s SER 5 N -1.86 5.54 -0.37 1.61 1.04 -1.26 -5.03 113.70 113.37 2emc s SER 5 Ca 0.00 -3.21 -0.05 0.00 0.48 0.00 0.00 55.95 53.18 2emc s SER 5 Cb 0.00 -1.88 0.08 0.00 0.10 0.00 0.00 66.02 64.32 2emc s SER 5 CO 0.00 -0.30 0.15 -0.94 0.98 0.00 0.00 173.24 173.14 2emc s SER 6 N 0.34 5.26 0.00 7.02 1.04 -1.26 -4.82 113.70 121.28 2emc s SER 6 Ca 0.21 -1.61 0.00 0.00 0.48 0.00 0.00 55.95 55.03 2emc s SER 6 Cb -0.15 -1.84 0.00 0.00 0.10 0.00 0.00 66.02 64.13 2emc s SER 6 CO -0.07 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.31 2emc n GLY 7 N 4.70 0.04 3.38 7.32 0.00 -1.26 -5.10 105.19 114.28 2emc n GLY 7 Ca -0.08 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2emc n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2emc s THR 8 N -1.00 2.79 -0.54 2.61 -4.23 -1.26 -5.09 115.64 108.91 2emc s THR 8 Ca 0.00 -0.79 -0.07 0.00 -1.18 0.00 0.00 61.69 59.64 2emc s THR 8 Cb 0.00 -2.10 0.14 0.00 1.34 0.00 0.00 72.50 71.88 2emc s THR 8 CO 0.00 0.56 0.40 -0.75 -0.54 0.00 0.00 174.62 174.29 2emc s LYS 9 N -0.20 2.57 -0.23 3.99 2.20 -1.26 -4.88 119.74 121.93 2emc s LYS 9 Ca -0.01 -2.04 -0.13 0.00 -0.36 0.00 0.00 55.97 53.43 2emc s LYS 9 Cb -0.13 -3.90 -0.10 0.00 -1.51 0.00 0.00 37.83 32.19 2emc s LYS 9 CO 0.03 -1.19 -0.32 0.39 -0.36 0.00 0.00 175.35 173.90 2emc n GLU 10 N 4.42 0.52 -4.16 4.03 4.71 -1.26 -5.00 120.64 123.89 2emc n GLU 10 Ca -0.01 0.22 -0.32 0.00 -0.01 0.00 0.00 57.16 57.05 2emc n GLU 10 Cb 0.41 -1.38 -0.08 0.00 -1.01 0.00 0.00 31.44 29.39 2emc n GLU 10 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 2emc s HIS 11 N -2.52 3.17 -1.14 -0.32 3.76 -1.26 -5.00 115.29 111.98 2emc s HIS 11 Ca -0.33 0.12 0.14 0.00 -0.15 0.00 0.00 55.06 54.84 2emc s HIS 11 Cb 0.12 -1.68 0.65 0.00 1.11 0.00 0.00 32.58 32.78 2emc s HIS 11 CO 0.43 0.51 1.44 -0.35 -0.85 0.00 0.00 174.74 175.91 2emc n PRO 12 N 1.09 0.07 -4.75 8.40 -0.04 -1.26 -4.59 135.00 133.92 2emc n PRO 12 Ca -0.13 0.22 -0.33 0.00 -0.04 0.00 0.00 63.50 63.23 2emc n PRO 12 Cb 0.52 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.32 2emc n PRO 12 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2emc s PHE 13 N -2.86 2.68 -0.04 0.54 0.08 -1.24 -5.06 117.98 112.08 2emc s PHE 13 Ca 0.09 -1.18 -0.00 0.00 0.12 0.00 0.00 56.93 55.96 2emc s PHE 13 Cb 0.09 -1.81 0.03 0.00 -0.57 0.00 0.00 43.02 40.76 2emc s PHE 13 CO 0.25 -0.52 0.01 0.21 -0.10 0.00 0.00 175.22 175.06 2emc s LYS 14 N 0.70 0.38 -0.10 0.44 2.20 -1.26 -1.25 119.74 120.85 2emc s LYS 14 Ca -0.09 0.11 -0.29 0.00 -0.36 0.00 0.00 55.97 55.34 2emc s LYS 14 Cb -0.16 -0.66 -0.07 0.00 -1.51 0.00 0.00 37.83 35.43 2emc s LYS 14 CO 0.01 -0.21 2.11 0.00 -0.36 0.00 0.00 175.35 176.90 2emc n ASN 16 N 9.76 0.44 -0.06 0.00 2.85 -1.26 0.06 115.26 127.05 2emc n ASN 16 Ca 0.26 -2.01 -0.07 0.00 -0.11 0.00 0.00 54.58 52.65 2emc n ASN 16 Cb 0.43 -0.18 -0.09 0.00 1.24 0.00 0.00 39.78 41.17 2emc n ASN 16 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2emc n GLU 17 N -0.29 1.79 0.00 1.20 1.02 -1.26 -4.84 120.64 118.26 2emc n GLU 17 Ca 0.01 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 2emc n GLU 17 Cb 0.10 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 2emc n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2emc n GLY 19 N 2.30 1.49 1.68 0.00 0.00 0.11 -4.43 105.19 106.34 2emc n GLY 19 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2emc n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2emc n LYS 20 N -0.59 -2.01 -3.72 1.61 5.02 -1.24 -4.66 118.16 112.57 2emc n LYS 20 Ca 0.00 -0.84 -0.14 0.00 -2.02 0.00 0.00 58.31 55.31 2emc n LYS 20 Cb 0.00 -0.78 -0.09 0.00 -0.02 0.00 0.00 35.03 34.14 2emc n LYS 20 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2emc s THR 21 N -1.96 0.02 -0.04 -0.18 -4.23 -1.26 -1.34 115.64 106.65 2emc s THR 21 Ca 0.34 -0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 60.62 2emc s THR 21 Cb -0.03 -0.65 0.02 0.00 1.34 0.00 0.00 72.50 73.18 2emc s THR 21 CO 0.26 -0.11 0.11 -0.36 -0.54 0.00 0.00 174.62 173.98 2emc s PHE 22 N -0.59 -0.12 0.14 3.99 0.40 -0.38 -4.98 117.98 116.45 2emc s PHE 22 Ca -0.07 0.32 -0.22 0.00 -0.60 0.00 0.00 56.93 56.36 2emc s PHE 22 Cb -0.04 0.00 0.01 0.00 0.51 0.00 0.00 43.02 43.51 2emc s PHE 22 CO 0.03 -0.08 1.65 0.66 0.70 0.00 0.00 175.22 178.18 2emc h SER 23 N 6.28 -0.64 -1.93 1.36 4.64 -1.96 -3.29 113.55 118.02 2emc h SER 23 Ca -0.29 0.12 -0.47 0.00 -0.47 0.00 0.00 61.79 60.67 2emc h SER 23 Cb 1.19 0.30 -0.02 0.00 -0.31 0.00 0.00 62.40 63.56 2emc h SER 23 CO 0.44 -0.25 -0.42 -1.00 -0.87 0.00 0.00 176.83 174.73 2emc s HIS 24 N -6.11 3.07 -0.04 4.77 3.76 -1.26 -4.62 115.29 114.86 2emc s HIS 24 Ca -0.15 -0.21 -0.22 0.00 -0.15 0.00 0.00 55.06 54.34 2emc s HIS 24 Cb 0.11 -1.77 -0.16 0.00 1.11 0.00 0.00 32.58 31.88 2emc s HIS 24 CO 0.68 0.21 0.95 1.03 -0.85 0.00 0.00 174.74 176.75 2emc h SER 25 N 1.17 -0.22 -0.79 1.40 0.87 -1.99 -3.23 113.55 110.76 2emc h SER 25 Ca -0.47 -0.31 0.31 0.00 -1.23 0.00 0.00 61.79 60.09 2emc h SER 25 Cb 1.25 0.06 -0.14 0.00 -0.44 0.00 0.00 62.40 63.12 2emc h SER 25 CO 0.57 0.29 0.34 0.00 -0.53 0.00 0.00 176.83 177.51 2emc n ALA 26 N -2.55 0.73 -0.08 6.23 0.00 -1.26 0.20 120.51 123.78 2emc n ALA 26 Ca -0.08 0.81 -0.10 0.00 0.00 0.00 0.00 53.44 54.07 2emc n ALA 26 Cb 0.26 -0.76 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 2emc n ALA 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2emc h HIS 27 N 0.00 0.38 0.77 0.00 -0.00 -1.96 -1.56 115.15 112.77 2emc h HIS 27 Ca 0.63 -0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.94 2emc h HIS 27 Cb 1.61 -0.11 0.01 0.00 -0.00 0.00 0.00 27.41 28.91 2emc h HIS 27 CO -0.09 0.39 -0.37 1.25 -0.00 0.00 0.00 177.93 179.11 2emc h LEU 28 N 0.26 -0.87 -0.93 2.43 5.85 0.22 0.42 115.31 122.68 2emc h LEU 28 Ca 0.08 0.03 0.25 0.00 0.84 0.00 0.00 57.88 59.08 2emc h LEU 28 Cb 0.17 0.23 -0.13 0.00 0.37 0.00 0.00 40.66 41.29 2emc h LEU 28 CO -0.01 -0.56 0.42 0.77 -0.34 0.00 0.00 178.44 178.73 2emc h SER 29 N -1.16 0.35 -0.29 1.25 4.64 -1.27 0.22 113.55 117.28 2emc h SER 29 Ca -0.11 0.17 -0.07 0.00 -0.47 0.00 0.00 61.79 61.31 2emc h SER 29 Cb 0.79 0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 2emc h SER 29 CO 0.17 -0.05 -0.10 0.50 -0.87 0.00 0.00 176.83 176.48 2emc h LYS 30 N 0.37 0.58 0.00 4.77 3.64 -1.18 -2.62 116.57 122.12 2emc h LYS 30 Ca 0.61 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2emc h LYS 30 Cb 1.23 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2emc h LYS 30 CO -0.57 0.80 0.00 1.58 -2.27 0.00 0.00 179.45 178.99 2emc n HIS 31 N -4.46 0.68 0.08 1.91 -0.00 0.48 -2.07 115.22 111.85 2emc n HIS 31 Ca -0.03 0.29 -0.09 0.00 0.46 0.00 0.00 57.72 58.34 2emc n HIS 31 Cb 0.34 -0.96 -0.09 0.00 -0.12 0.00 0.00 29.99 29.15 2emc n HIS 31 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 2emc h GLN 32 N 0.00 0.10 -0.00 1.57 4.20 -0.40 -3.19 115.11 117.39 2emc h GLN 32 Ca 0.00 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2emc h GLN 32 Cb 0.26 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2emc h GLN 32 CO 0.00 1.03 0.01 -0.07 -0.67 0.00 0.00 178.83 179.13 2emc h LEU 33 N 0.04 0.00 -0.68 1.46 3.38 -1.37 -0.29 115.31 117.85 2emc h LEU 33 Ca -0.05 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 2emc h LEU 33 Cb 1.75 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.48 2emc h LEU 33 CO 0.15 0.00 -0.64 0.16 0.09 0.00 0.00 178.44 178.20 2emc h ILE 34 N 0.00 1.42 0.03 1.22 3.07 -1.69 -3.14 117.51 118.43 2emc h ILE 34 Ca 0.00 -2.22 -0.22 0.00 1.55 0.00 0.00 64.86 63.97 2emc h ILE 34 Cb 0.01 2.21 -0.00 0.00 -0.27 0.00 0.00 36.82 38.77 2emc h ILE 34 CO -0.00 0.63 -0.98 0.45 -1.05 0.00 0.00 178.15 177.20 2emc h HIS 35 N 0.00 0.41 -2.19 0.16 3.86 -1.21 -3.40 115.15 112.78 2emc h HIS 35 Ca -0.01 -0.24 -0.67 0.00 -1.16 0.00 0.00 60.37 58.29 2emc h HIS 35 Cb 1.16 -0.04 -0.16 0.00 1.06 0.00 0.00 27.41 29.43 2emc h HIS 35 CO 0.00 1.09 0.94 0.00 0.86 0.00 0.00 177.93 180.82 2emc s ALA 36 N -3.08 3.23 -0.67 2.45 0.00 -1.13 -4.97 121.76 117.60 2emc s ALA 36 Ca -0.04 -2.62 -0.26 0.00 0.00 0.00 0.00 51.96 49.04 2emc s ALA 36 Cb 0.09 -4.12 -0.01 0.00 0.00 0.00 0.00 23.12 19.07 2emc s ALA 36 CO 0.85 -3.09 1.75 0.20 0.00 0.00 0.00 175.76 175.48 2emc s GLY 37 N 3.88 0.34 -0.57 0.00 0.00 -1.26 -4.92 107.32 104.78 2emc s GLY 37 Ca 0.34 -0.89 -0.23 0.00 0.00 0.00 0.00 44.72 43.95 2emc s GLY 37 CO -0.08 3.27 0.88 -0.54 0.00 0.00 0.00 173.10 176.63 2emc s GLU 38 N 6.76 3.23 -0.06 2.90 2.02 -1.26 -5.00 118.70 127.29 2emc s GLU 38 Ca 0.61 -0.54 -0.10 0.00 0.02 0.00 0.00 54.97 54.96 2emc s GLU 38 Cb -0.11 -4.11 0.02 0.00 0.10 0.00 0.00 34.13 30.03 2emc s GLU 38 CO 0.17 -1.52 0.25 -0.80 0.02 0.00 0.00 175.26 173.39 2emc s ASN 39 N 3.03 -0.20 0.00 -0.19 -0.87 -1.26 -5.03 114.94 110.42 2emc s ASN 39 Ca 0.25 0.29 0.14 0.00 -1.57 0.00 0.00 52.86 51.98 2emc s ASN 39 Cb -0.15 0.43 0.61 0.00 -0.02 0.00 0.00 41.25 42.12 2emc s ASN 39 CO 0.15 -0.22 1.45 -0.81 -2.57 0.00 0.00 177.10 175.10 2emc n PRO 40 N 2.29 0.01 -2.28 -0.60 -0.04 -1.26 -4.72 135.00 128.40 2emc n PRO 40 Ca -0.17 0.25 -0.42 0.00 -0.04 0.00 0.00 63.50 63.12 2emc n PRO 40 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 2emc n PRO 40 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2emc s SER 41 N -2.97 6.87 -0.32 3.54 0.15 -1.26 -4.17 113.70 115.54 2emc s SER 41 Ca 0.07 1.95 -0.23 0.00 0.70 0.00 0.00 55.95 58.44 2emc s SER 41 Cb 0.09 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 61.89 2emc s SER 41 CO 0.26 -0.77 0.44 0.61 1.20 0.00 0.00 173.24 174.98 2emc n GLY 42 N 3.71 -0.43 0.00 9.45 0.00 -1.26 -4.79 105.19 111.87 2emc n GLY 42 Ca 0.14 0.83 0.07 0.00 0.00 0.00 0.00 46.02 47.06 2emc n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2emc n PRO 43 N 0.25 0.31 -2.87 1.61 -0.04 -1.26 -4.85 135.00 128.16 2emc n PRO 43 Ca -0.03 0.09 -0.09 0.00 -0.04 0.00 0.00 63.50 63.43 2emc n PRO 43 Cb 0.55 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.55 2emc n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2emc n SER 44 N -1.18 -3.44 -4.67 3.54 2.88 -1.26 -4.94 113.62 104.55 2emc n SER 44 Ca 0.09 -0.21 -0.42 0.00 -1.33 0.00 0.00 58.87 56.99 2emc n SER 44 Cb 0.09 -2.26 -0.03 0.00 -0.75 0.00 0.00 64.21 61.26 2emc n SER 44 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2emc s SER 45 N -3.19 6.45 0.00 -3.46 0.15 -1.26 -5.32 113.70 107.07 2emc s SER 45 Ca 0.19 2.68 0.00 0.00 0.70 0.00 0.00 55.95 59.53 2emc s SER 45 Cb -0.08 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 2emc s SER 45 CO 0.28 -1.04 0.00 0.61 1.20 0.00 0.00 173.24 174.30