#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy6 n VAL 4 N 0.00 0.00 -2.79 0.00 3.14 -1.26 -4.92 118.33 112.50 1iy6 n VAL 4 Ca 0.00 -0.11 -0.41 0.00 -2.96 0.00 0.00 64.34 60.85 1iy6 n VAL 4 Cb 0.00 -0.92 -0.04 0.00 -1.06 0.00 0.00 33.84 31.82 1iy6 n VAL 4 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1iy6 s SER 5 N -2.47 7.34 0.06 6.55 0.01 -1.26 -5.04 113.70 118.89 1iy6 s SER 5 Ca 0.65 1.61 0.02 0.00 1.31 0.00 0.00 55.95 59.54 1iy6 s SER 5 Cb -0.23 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.43 1iy6 s SER 5 CO 0.61 -0.16 -0.07 0.54 0.41 0.00 0.00 173.24 174.58 1iy6 s VAL 6 N 0.58 0.54 -0.57 3.43 0.11 -1.26 -5.11 120.40 118.12 1iy6 s VAL 6 Ca 0.47 -1.45 -0.06 0.00 -2.93 0.00 0.00 61.98 58.01 1iy6 s VAL 6 Cb -0.21 -1.06 0.15 0.00 -1.53 0.00 0.00 36.38 33.73 1iy6 s VAL 6 CO 0.27 -0.63 0.42 1.51 -3.33 0.00 0.00 175.10 173.34 1iy6 s ASP 7 N -2.23 5.59 -0.04 3.54 -4.77 -1.26 -4.82 116.67 112.68 1iy6 s ASP 7 Ca -0.01 -2.41 0.13 0.00 -3.30 0.00 0.00 52.55 46.96 1iy6 s ASP 7 Cb -0.03 -1.95 0.24 0.00 -1.09 0.00 0.00 42.92 40.10 1iy6 s ASP 7 CO -0.02 -0.53 1.11 0.00 0.70 0.00 0.00 175.17 176.43 1iy6 s SER 9 N -1.87 3.92 -1.14 0.00 0.15 -1.26 -2.80 113.70 110.70 1iy6 s SER 9 Ca 0.21 -0.37 -0.02 0.00 0.70 0.00 0.00 55.95 56.47 1iy6 s SER 9 Cb 0.22 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 1iy6 s SER 9 CO -0.07 -3.99 0.97 -0.62 1.20 0.00 0.00 173.24 170.73 1iy6 n GLU 10 N 8.63 -6.43 -2.94 5.44 -0.58 -1.26 -4.94 120.64 118.55 1iy6 n GLU 10 Ca 0.45 0.78 -0.21 0.00 -0.42 0.00 0.00 57.16 57.76 1iy6 n GLU 10 Cb 0.45 -5.62 -0.02 0.00 -0.57 0.00 0.00 31.44 25.68 1iy6 n GLU 10 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 1iy6 n TYR 11 N -4.12 2.01 -1.84 -0.32 9.36 -1.12 -5.09 117.16 116.05 1iy6 n TYR 11 Ca -0.20 -3.64 -0.31 0.00 3.32 0.00 0.00 57.90 57.07 1iy6 n TYR 11 Cb 0.63 -0.40 0.02 0.00 -0.63 0.00 0.00 39.34 38.96 1iy6 n TYR 11 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1iy6 s PRO 12 N -3.02 3.43 -0.35 2.98 0.04 -1.26 -4.78 135.00 132.04 1iy6 s PRO 12 Ca 0.42 0.85 0.01 0.00 0.04 0.00 0.00 61.00 62.32 1iy6 s PRO 12 Cb 0.35 -2.06 0.19 0.00 0.04 0.00 0.00 34.50 33.02 1iy6 s PRO 12 CO -0.10 -0.71 0.77 0.15 0.04 0.00 0.00 177.00 177.15 1iy6 s LYS 13 N -5.00 0.52 -0.25 4.56 1.02 -1.26 -4.90 119.74 114.45 1iy6 s LYS 13 Ca 0.57 0.04 0.06 0.00 0.02 0.00 0.00 55.97 56.66 1iy6 s LYS 13 Cb -0.12 0.12 0.54 0.00 -0.52 0.00 0.00 37.83 37.84 1iy6 s LYS 13 CO 0.52 -0.83 1.53 0.00 -0.92 0.00 0.00 175.35 175.65 1iy6 n ALA 15 N -0.11 1.84 -2.28 0.00 0.00 -1.26 -5.12 120.51 113.59 1iy6 n ALA 15 Ca 0.31 -3.20 -0.24 0.00 0.00 0.00 0.00 53.44 50.31 1iy6 n ALA 15 Cb 1.14 -0.92 0.02 0.00 0.00 0.00 0.00 19.45 19.69 1iy6 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iy6 n THR 17 N -1.99 0.00 -2.44 0.00 5.66 -1.26 -4.99 114.28 109.26 1iy6 n THR 17 Ca 0.05 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 61.02 1iy6 n THR 17 Cb 0.64 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 69.47 1iy6 n THR 17 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1iy6 n MET 18 N 0.00 1.57 -1.20 1.09 0.00 -1.26 -5.10 117.12 112.23 1iy6 n MET 18 Ca 0.00 -3.18 -0.37 0.00 0.00 0.00 0.00 57.70 54.15 1iy6 n MET 18 Cb 0.00 -1.28 0.05 0.00 0.00 0.00 0.00 33.22 31.99 1iy6 n MET 18 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1iy6 n GLU 19 N -0.37 0.15 -3.47 0.03 2.13 -1.26 -4.89 120.64 112.96 1iy6 n GLU 19 Ca 0.15 0.08 -0.43 0.00 0.66 0.00 0.00 57.16 57.62 1iy6 n GLU 19 Cb 0.92 -1.48 -0.08 0.00 0.27 0.00 0.00 31.44 31.06 1iy6 n GLU 19 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1iy6 s TYR 20 N -1.97 3.29 -0.34 4.31 6.14 -1.26 -4.58 117.35 122.94 1iy6 s TYR 20 Ca 0.59 -1.22 0.05 0.00 0.64 0.00 0.00 57.07 57.13 1iy6 s TYR 20 Cb -0.35 -3.16 0.17 0.00 0.42 0.00 0.00 41.96 39.04 1iy6 s TYR 20 CO 0.65 -0.84 0.50 1.03 0.64 0.00 0.00 175.55 177.53 1iy6 s ARG 21 N 1.55 0.61 -0.06 4.97 1.81 0.68 -5.00 118.95 123.51 1iy6 s ARG 21 Ca 0.04 -0.12 -0.30 0.00 -1.72 0.00 0.00 55.73 53.63 1iy6 s ARG 21 Cb -0.24 -0.16 -0.03 0.00 -0.45 0.00 0.00 34.95 34.06 1iy6 s ARG 21 CO 0.04 -1.12 1.20 -1.25 -0.68 0.00 0.00 175.30 173.49 1iy6 s PRO 22 N 2.16 4.35 -0.09 3.54 0.04 -1.24 -2.50 135.00 141.26 1iy6 s PRO 22 Ca 0.13 1.67 0.03 0.00 0.04 0.00 0.00 61.00 62.87 1iy6 s PRO 22 Cb -0.10 -3.56 0.01 0.00 0.04 0.00 0.00 34.50 30.89 1iy6 s PRO 22 CO -0.17 -0.45 -0.18 -0.51 0.04 0.00 0.00 177.00 175.73 1iy6 s LEU 23 N 2.25 1.84 -1.24 -3.56 1.43 -1.06 -1.50 118.68 116.84 1iy6 s LEU 23 Ca 0.56 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 53.11 1iy6 s LEU 23 Cb -0.25 -1.11 0.17 0.00 0.03 0.00 0.00 46.19 45.03 1iy6 s LEU 23 CO 0.22 0.08 1.62 0.00 0.23 0.00 0.00 176.35 178.50 1iy6 n GLY 25 N 3.61 -2.04 0.29 0.00 0.00 -0.13 0.21 105.19 107.13 1iy6 n GLY 25 Ca 0.38 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 46.21 1iy6 n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1iy6 h SER 26 N -0.12 0.00 -0.25 1.61 0.87 -1.21 0.40 113.55 114.85 1iy6 h SER 26 Ca -0.45 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.04 1iy6 h SER 26 Cb 1.38 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.30 1iy6 h SER 26 CO 0.43 0.00 0.10 -0.90 -0.53 0.00 0.00 176.83 175.92 1iy6 n ASP 27 N -2.58 2.85 -3.91 6.23 5.75 -1.26 -4.83 116.55 118.80 1iy6 n ASP 27 Ca -0.01 -2.40 -0.29 0.00 -0.01 0.00 0.00 54.79 52.08 1iy6 n ASP 27 Cb 0.50 -0.58 0.02 0.00 -1.03 0.00 0.00 41.12 40.03 1iy6 n ASP 27 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1iy6 n ASN 28 N 0.10 -3.79 -4.46 -1.12 5.15 0.14 -4.96 115.26 106.32 1iy6 n ASN 28 Ca 0.14 -0.82 -0.26 0.00 -0.60 0.00 0.00 54.58 53.04 1iy6 n ASN 28 Cb 0.70 -3.78 -0.11 0.00 -0.53 0.00 0.00 39.78 36.07 1iy6 n ASN 28 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1iy6 s LYS 29 N -6.53 1.63 -0.30 1.20 2.20 -1.18 -4.92 119.74 111.84 1iy6 s LYS 29 Ca 0.52 -1.61 -0.05 0.00 -0.36 0.00 0.00 55.97 54.47 1iy6 s LYS 29 Cb -0.26 -1.84 0.03 0.00 -1.51 0.00 0.00 37.83 34.25 1iy6 s LYS 29 CO 0.84 0.37 0.04 0.99 -0.36 0.00 0.00 175.35 177.23 1iy6 s THR 30 N -2.03 3.48 0.31 3.43 2.01 -1.24 -0.96 115.64 120.64 1iy6 s THR 30 Ca 0.25 -1.05 -0.04 0.00 0.31 0.00 0.00 61.69 61.15 1iy6 s THR 30 Cb -0.07 -2.89 -0.05 0.00 0.01 0.00 0.00 72.50 69.50 1iy6 s THR 30 CO 0.12 -0.02 0.57 -0.31 -0.69 0.00 0.00 174.62 174.29 1iy6 s TYR 31 N 1.38 3.48 -0.18 4.92 2.02 -0.68 -4.78 117.35 123.51 1iy6 s TYR 31 Ca -0.01 0.62 0.18 0.00 -0.37 0.00 0.00 57.07 57.49 1iy6 s TYR 31 Cb -0.18 -2.09 0.27 0.00 -0.40 0.00 0.00 41.96 39.55 1iy6 s TYR 31 CO 0.00 0.14 1.55 0.78 -1.57 0.00 0.00 175.55 176.45 1iy6 h GLY 32 N 1.48 0.00 -3.25 0.71 0.00 -1.89 -2.80 103.07 97.31 1iy6 h GLY 32 Ca -0.48 0.00 0.28 0.00 0.00 0.00 0.00 47.33 47.13 1iy6 h GLY 32 CO 0.65 0.00 0.80 0.54 0.00 0.00 0.00 176.54 178.53 1iy6 s ASN 33 N -6.35 -0.11 0.28 0.19 2.20 -1.04 -0.23 114.94 109.88 1iy6 s ASN 33 Ca 0.04 -0.08 0.19 0.00 -0.94 0.00 0.00 52.86 52.08 1iy6 s ASN 33 Cb 0.07 0.17 1.03 0.00 -2.00 0.00 0.00 41.25 40.52 1iy6 s ASN 33 CO 0.71 -0.30 1.59 2.29 -2.94 0.00 0.00 177.10 178.45 1iy6 n LYS 34 N -0.29 0.13 0.06 3.55 2.85 -1.26 -0.74 118.16 122.45 1iy6 n LYS 34 Ca -0.04 0.61 -0.13 0.00 -1.05 0.00 0.00 58.31 57.70 1iy6 n LYS 34 Cb 0.60 -1.90 -0.03 0.00 -0.65 0.00 0.00 35.03 33.05 1iy6 n LYS 34 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1iy6 h ASN 36 N 0.24 0.00 0.61 0.00 -0.73 -1.14 -3.02 115.58 111.54 1iy6 h ASN 36 Ca -0.07 -0.01 -0.28 0.00 1.87 0.00 0.00 56.30 57.82 1iy6 h ASN 36 Cb 1.52 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 40.11 1iy6 h ASN 36 CO 0.15 0.00 -1.33 0.15 -0.37 0.00 0.00 177.43 176.04 1iy6 h PHE 37 N 0.00 0.39 0.00 0.67 3.57 -1.09 -2.75 116.94 117.73 1iy6 h PHE 37 Ca 0.00 -0.28 -0.09 0.00 3.53 0.00 0.00 57.97 61.12 1iy6 h PHE 37 Cb 0.93 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 1iy6 h PHE 37 CO 0.00 1.27 -0.43 0.00 -2.23 0.00 0.00 178.31 176.91 1iy6 h ALA 40 N 0.39 0.99 0.04 0.00 0.00 -1.35 -2.57 119.26 116.76 1iy6 h ALA 40 Ca -0.15 -0.12 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 1iy6 h ALA 40 Cb 1.77 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1iy6 h ALA 40 CO 0.21 0.16 -1.01 0.28 0.00 0.00 0.00 179.25 178.90 1iy6 h VAL 41 N 0.00 1.53 0.00 0.00 2.07 -1.15 -2.86 116.25 115.85 1iy6 h VAL 41 Ca -0.00 -2.89 0.00 0.00 0.82 0.00 0.00 66.70 64.63 1iy6 h VAL 41 Cb 0.73 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 33.17 1iy6 h VAL 41 CO 0.02 0.84 -0.19 0.58 0.02 0.00 0.00 177.57 178.83 1iy6 h VAL 42 N 0.08 0.00 0.00 2.57 2.07 -1.27 0.44 116.25 120.15 1iy6 h VAL 42 Ca -0.07 -0.53 -0.18 0.00 0.82 0.00 0.00 66.70 66.74 1iy6 h VAL 42 Cb 1.69 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 32.84 1iy6 h VAL 42 CO 0.16 0.00 -1.34 1.05 0.02 0.00 0.00 177.57 177.45 1iy6 h GLU 43 N 0.00 0.00 -0.48 1.57 4.11 -1.43 -3.29 114.58 115.06 1iy6 h GLU 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1iy6 h GLU 43 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1iy6 h GLU 43 CO 0.00 0.37 0.00 0.45 0.07 0.00 0.00 179.01 179.90 1iy6 n SER 44 N -2.96 1.79 -0.63 3.06 2.88 -1.08 -4.83 113.62 111.84 1iy6 n SER 44 Ca -0.09 -2.12 -0.06 0.00 -1.33 0.00 0.00 58.87 55.27 1iy6 n SER 44 Cb 0.86 -0.31 -0.01 0.00 -0.75 0.00 0.00 64.21 64.00 1iy6 n SER 44 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1iy6 n ASN 45 N 0.21 -2.95 -1.20 -3.46 2.85 -1.24 -2.60 115.26 106.87 1iy6 n ASN 45 Ca 0.09 0.05 -0.12 0.00 -0.11 0.00 0.00 54.58 54.49 1iy6 n ASN 45 Cb 0.34 -1.83 -0.02 0.00 1.24 0.00 0.00 39.78 39.51 1iy6 n ASN 45 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1iy6 n GLY 46 N -1.45 0.36 0.63 8.20 0.00 0.14 -4.87 105.19 108.20 1iy6 n GLY 46 Ca -0.07 -0.42 0.07 0.00 0.00 0.00 0.00 46.02 45.60 1iy6 n GLY 46 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iy6 n THR 47 N -3.55 0.22 -3.44 2.61 -2.24 -1.07 -4.98 114.28 101.84 1iy6 n THR 47 Ca -0.13 -0.61 -0.29 0.00 -2.27 0.00 0.00 64.05 60.75 1iy6 n THR 47 Cb 0.53 1.12 -0.03 0.00 -2.10 0.00 0.00 70.33 69.85 1iy6 n THR 47 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1iy6 s LEU 48 N -1.15 4.11 0.00 3.22 2.96 -1.26 -5.09 118.68 121.47 1iy6 s LEU 48 Ca 0.20 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.77 1iy6 s LEU 48 Cb 0.13 -3.46 0.00 0.00 0.50 0.00 0.00 46.19 43.36 1iy6 s LEU 48 CO 0.19 -0.14 0.00 0.35 -1.32 0.00 0.00 176.35 175.43 1iy6 n THR 49 N -0.73 0.00 -4.28 3.68 -2.24 -1.26 -4.94 114.28 104.50 1iy6 n THR 49 Ca -0.02 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.52 1iy6 n THR 49 Cb 0.54 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.69 1iy6 n THR 49 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1iy6 s LEU 50 N 0.00 3.09 0.00 3.22 2.96 -1.26 -1.50 118.68 125.19 1iy6 s LEU 50 Ca 0.00 -0.80 0.00 0.00 -0.22 0.00 0.00 54.13 53.11 1iy6 s LEU 50 Cb 0.00 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.13 1iy6 s LEU 50 CO 0.00 -0.12 0.00 -1.54 -1.32 0.00 0.00 176.35 173.37 1iy6 n SER 51 N -0.94 2.44 0.00 3.68 3.41 0.13 -3.12 113.62 119.23 1iy6 n SER 51 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 1iy6 n SER 51 Cb 0.60 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.74 1iy6 n SER 51 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1iy6 n HIS 52 N -1.49 0.00 -1.50 7.33 -0.00 -0.83 -4.94 115.22 113.79 1iy6 n HIS 52 Ca 0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 57.72 57.12 1iy6 n HIS 52 Cb 0.26 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.15 1iy6 n HIS 52 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1iy6 n PHE 53 N 0.00 1.57 0.00 1.57 3.01 -1.26 -2.50 117.46 119.86 1iy6 n PHE 53 Ca 0.00 0.72 0.00 0.00 1.01 0.00 0.00 57.45 59.18 1iy6 n PHE 53 Cb 0.00 -2.35 0.00 0.00 -0.01 0.00 0.00 39.48 37.12 1iy6 n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iy6 n GLY 54 N 5.79 1.78 3.75 1.37 0.00 -0.56 -4.81 105.19 112.51 1iy6 n GLY 54 Ca 0.41 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.09 1iy6 n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iy6 s LYS 55 N -1.37 4.50 0.00 1.61 1.02 -1.26 -1.31 119.74 122.94 1iy6 s LYS 55 Ca 0.00 1.91 0.11 0.00 0.02 0.00 0.00 55.97 58.01 1iy6 s LYS 55 Cb 0.00 -3.20 0.65 0.00 -0.52 0.00 0.00 37.83 34.75 1iy6 s LYS 55 CO 0.00 -0.04 1.08 0.00 -0.92 0.00 0.00 175.35 175.47