#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy5 n VAL 4 N 0.00 0.00 -1.28 0.00 0.31 -1.26 -4.96 118.33 111.15 1iy5 n VAL 4 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1iy5 n VAL 4 Cb 0.00 -0.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 1iy5 n VAL 4 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1iy5 n SER 5 N -1.48 0.00 -3.49 4.52 2.88 -1.26 -5.04 113.62 109.75 1iy5 n SER 5 Ca 0.00 -1.09 -0.11 0.00 -1.33 0.00 0.00 58.87 56.34 1iy5 n SER 5 Cb 0.00 -0.02 -0.02 0.00 -0.75 0.00 0.00 64.21 63.42 1iy5 n SER 5 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1iy5 s VAL 6 N 0.00 0.00 -0.15 2.46 -7.23 -1.26 -5.14 120.40 109.08 1iy5 s VAL 6 Ca 0.00 -0.11 -0.20 0.00 -1.81 0.00 0.00 61.98 59.86 1iy5 s VAL 6 Cb 0.00 -1.12 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 1iy5 s VAL 6 CO 0.00 0.00 0.59 -0.62 -0.31 0.00 0.00 175.10 174.76 1iy5 s ASP 7 N -2.71 6.72 -0.27 4.85 2.15 -1.26 -4.02 116.67 122.13 1iy5 s ASP 7 Ca 0.03 0.87 0.09 0.00 0.43 0.00 0.00 52.55 53.98 1iy5 s ASP 7 Cb -0.01 -2.34 0.47 0.00 -0.30 0.00 0.00 42.92 40.74 1iy5 s ASP 7 CO -0.10 -0.16 1.36 0.00 -0.17 0.00 0.00 175.17 176.10 1iy5 n SER 9 N -1.08 0.00 -2.11 0.00 3.41 -1.26 -3.36 113.62 109.22 1iy5 n SER 9 Ca 0.29 0.35 -0.25 0.00 -0.26 0.00 0.00 58.87 59.01 1iy5 n SER 9 Cb 0.89 -0.45 0.05 0.00 -0.26 0.00 0.00 64.21 64.44 1iy5 n SER 9 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1iy5 n GLU 10 N -1.45 2.19 -4.18 4.33 0.28 -1.26 -4.90 120.64 115.64 1iy5 n GLU 10 Ca 0.07 -2.30 -0.11 0.00 -0.16 0.00 0.00 57.16 54.67 1iy5 n GLU 10 Cb 0.26 -1.91 -0.10 0.00 1.43 0.00 0.00 31.44 31.13 1iy5 n GLU 10 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1iy5 s TYR 11 N -2.63 0.97 0.58 -1.84 1.51 -1.21 -4.38 117.35 110.35 1iy5 s TYR 11 Ca 0.46 -1.06 -0.13 0.00 -1.01 0.00 0.00 57.07 55.33 1iy5 s TYR 11 Cb 0.35 -0.56 -0.05 0.00 -0.11 0.00 0.00 41.96 41.59 1iy5 s TYR 11 CO -0.02 -0.30 1.01 -1.25 -1.11 0.00 0.00 175.55 173.87 1iy5 s PRO 12 N -3.93 3.72 0.40 -1.71 0.04 -1.26 -5.10 135.00 127.15 1iy5 s PRO 12 Ca 0.19 0.80 0.01 0.00 0.04 0.00 0.00 61.00 62.05 1iy5 s PRO 12 Cb 0.07 -2.11 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 1iy5 s PRO 12 CO -0.00 -0.45 0.60 0.15 0.04 0.00 0.00 177.00 177.33 1iy5 s LYS 13 N -4.78 3.22 0.18 4.56 1.02 -1.26 -4.98 119.74 117.70 1iy5 s LYS 13 Ca 0.56 -0.51 0.26 0.00 0.02 0.00 0.00 55.97 56.30 1iy5 s LYS 13 Cb -0.11 -2.63 0.89 0.00 -0.52 0.00 0.00 37.83 35.46 1iy5 s LYS 13 CO 0.46 -0.07 1.78 -0.35 -0.92 0.00 0.00 175.35 176.25 1iy5 n PRO 14 N -1.91 0.21 -3.57 -1.68 -0.04 -1.26 -4.85 135.00 121.90 1iy5 n PRO 14 Ca -0.01 0.22 -0.13 0.00 -0.04 0.00 0.00 63.50 63.54 1iy5 n PRO 14 Cb 0.57 -1.77 -0.06 0.00 -0.04 0.00 0.00 33.50 32.21 1iy5 n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iy5 s ALA 15 N -3.12 -1.87 0.01 0.55 0.00 -1.26 -5.14 121.76 110.93 1iy5 s ALA 15 Ca 0.10 1.60 -0.26 0.00 0.00 0.00 0.00 51.96 53.40 1iy5 s ALA 15 Cb 0.13 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1iy5 s ALA 15 CO 0.54 -0.32 0.81 0.00 0.00 0.00 0.00 175.76 176.79 1iy5 s THR 17 N 0.42 3.40 -0.63 0.00 -4.23 -1.26 -4.94 115.64 108.40 1iy5 s THR 17 Ca 0.42 0.46 0.09 0.00 -1.18 0.00 0.00 61.69 61.47 1iy5 s THR 17 Cb -0.20 -3.37 0.50 0.00 1.34 0.00 0.00 72.50 70.77 1iy5 s THR 17 CO 0.23 -0.60 1.27 0.23 -0.54 0.00 0.00 174.62 175.22 1iy5 n MET 18 N -3.14 3.32 -1.20 3.99 2.81 -1.26 -4.95 117.12 116.69 1iy5 n MET 18 Ca 0.07 -1.92 -0.34 0.00 -1.81 0.00 0.00 57.70 53.70 1iy5 n MET 18 Cb 0.57 -1.93 0.12 0.00 -0.71 0.00 0.00 33.22 31.26 1iy5 n MET 18 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1iy5 n GLU 19 N 0.41 0.32 -3.78 0.03 0.28 -1.26 -4.97 120.64 111.67 1iy5 n GLU 19 Ca 0.17 0.18 -0.36 0.00 -0.16 0.00 0.00 57.16 56.99 1iy5 n GLU 19 Cb 0.80 -2.40 -0.12 0.00 1.43 0.00 0.00 31.44 31.15 1iy5 n GLU 19 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1iy5 s TYR 20 N -2.00 3.10 -0.29 -1.84 6.14 -1.26 -4.70 117.35 116.49 1iy5 s TYR 20 Ca 0.74 -0.36 0.02 0.00 0.64 0.00 0.00 57.07 58.12 1iy5 s TYR 20 Cb -0.31 -2.23 0.19 0.00 0.42 0.00 0.00 41.96 40.04 1iy5 s TYR 20 CO 0.50 -0.31 0.59 1.03 0.64 0.00 0.00 175.55 178.00 1iy5 s ARG 21 N 1.51 0.56 -0.48 4.97 1.81 -0.81 -4.98 118.95 121.52 1iy5 s ARG 21 Ca 0.06 0.77 -0.28 0.00 -1.72 0.00 0.00 55.73 54.55 1iy5 s ARG 21 Cb -0.15 0.37 0.02 0.00 -0.45 0.00 0.00 34.95 34.74 1iy5 s ARG 21 CO 0.04 -0.83 1.35 -1.25 -0.68 0.00 0.00 175.30 173.93 1iy5 s PRO 22 N 2.83 3.51 -0.25 3.54 0.04 -1.26 -1.66 135.00 141.75 1iy5 s PRO 22 Ca 0.15 0.68 0.01 0.00 0.04 0.00 0.00 61.00 61.89 1iy5 s PRO 22 Cb -0.13 -4.04 0.05 0.00 0.04 0.00 0.00 34.50 30.43 1iy5 s PRO 22 CO -0.23 -1.66 -0.10 -0.51 0.04 0.00 0.00 177.00 174.53 1iy5 s LEU 23 N 5.44 3.27 -0.71 -3.56 1.43 -1.18 0.22 118.68 123.59 1iy5 s LEU 23 Ca 0.55 -1.19 -0.22 0.00 -1.03 0.00 0.00 54.13 52.25 1iy5 s LEU 23 Cb -0.11 -1.58 0.08 0.00 0.03 0.00 0.00 46.19 44.61 1iy5 s LEU 23 CO 0.30 -0.16 0.99 0.00 0.23 0.00 0.00 176.35 177.71 1iy5 n GLY 25 N 5.39 -2.01 0.03 0.00 0.00 0.17 -0.35 105.19 108.41 1iy5 n GLY 25 Ca 0.02 -0.26 0.03 0.00 0.00 0.00 0.00 46.02 45.81 1iy5 n GLY 25 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iy5 n SER 26 N 0.84 0.11 -0.78 1.61 2.88 -0.66 -1.05 113.62 116.56 1iy5 n SER 26 Ca 0.10 0.55 0.03 0.00 -1.33 0.00 0.00 58.87 58.21 1iy5 n SER 26 Cb 0.48 -0.56 0.12 0.00 -0.75 0.00 0.00 64.21 63.51 1iy5 n SER 26 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1iy5 n ASP 27 N -1.64 2.11 -1.88 -3.46 5.75 -1.26 -4.71 116.55 111.46 1iy5 n ASP 27 Ca 0.00 -2.20 -0.13 0.00 -0.01 0.00 0.00 54.79 52.45 1iy5 n ASP 27 Cb 0.03 -0.43 0.02 0.00 -1.03 0.00 0.00 41.12 39.71 1iy5 n ASP 27 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1iy5 n ASN 28 N 0.20 -4.20 -4.44 -1.12 4.05 -0.22 -5.02 115.26 104.51 1iy5 n ASN 28 Ca 0.09 -0.19 -0.23 0.00 0.45 0.00 0.00 54.58 54.70 1iy5 n ASN 28 Cb 0.44 -3.02 -0.10 0.00 1.23 0.00 0.00 39.78 38.33 1iy5 n ASN 28 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1iy5 s LYS 29 N -5.29 1.59 0.03 1.20 2.20 -1.17 -4.95 119.74 113.35 1iy5 s LYS 29 Ca 0.20 -1.74 0.03 0.00 -0.36 0.00 0.00 55.97 54.10 1iy5 s LYS 29 Cb -0.09 -1.56 -0.04 0.00 -1.51 0.00 0.00 37.83 34.64 1iy5 s LYS 29 CO 0.25 0.26 -0.03 0.99 -0.36 0.00 0.00 175.35 176.46 1iy5 s THR 30 N -2.67 3.93 0.21 3.43 2.01 -1.26 0.41 115.64 121.70 1iy5 s THR 30 Ca 0.28 -0.77 0.11 0.00 0.31 0.00 0.00 61.69 61.62 1iy5 s THR 30 Cb -0.03 -2.77 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 1iy5 s THR 30 CO 0.13 0.31 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.85 1iy5 s TYR 31 N -1.11 2.17 -0.15 4.92 2.02 0.11 -4.86 117.35 120.44 1iy5 s TYR 31 Ca 0.20 -0.39 0.15 0.00 -0.37 0.00 0.00 57.07 56.67 1iy5 s TYR 31 Cb -0.11 -1.04 0.05 0.00 -0.40 0.00 0.00 41.96 40.46 1iy5 s TYR 31 CO 0.11 0.51 1.43 0.78 -1.57 0.00 0.00 175.55 176.81 1iy5 h GLY 32 N 2.97 0.00 0.00 0.71 0.00 -1.87 -3.12 103.07 101.76 1iy5 h GLY 32 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1iy5 h GLY 32 CO 0.52 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.22 1iy5 n ASN 33 N -3.22 0.00 0.13 0.19 0.23 -0.66 -1.92 115.26 110.00 1iy5 n ASN 33 Ca 0.02 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.14 1iy5 n ASN 33 Cb 0.74 0.00 0.39 0.00 -2.08 0.00 0.00 39.78 38.83 1iy5 n ASN 33 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1iy5 n LYS 34 N -0.07 0.09 -0.04 -3.83 5.02 -1.26 -1.28 118.16 116.79 1iy5 n LYS 34 Ca 0.00 0.57 -0.13 0.00 -2.02 0.00 0.00 58.31 56.73 1iy5 n LYS 34 Cb 0.00 -1.93 -0.11 0.00 -0.02 0.00 0.00 35.03 32.97 1iy5 n LYS 34 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1iy5 n ASN 36 N -4.75 0.43 -0.05 0.00 2.85 -0.41 -2.12 115.26 111.22 1iy5 n ASN 36 Ca -0.09 0.57 -0.22 0.00 -0.11 0.00 0.00 54.58 54.74 1iy5 n ASN 36 Cb 0.35 -0.68 -0.13 0.00 1.24 0.00 0.00 39.78 40.57 1iy5 n ASN 36 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 1iy5 h PHE 37 N 0.00 0.24 -0.06 1.20 3.57 -1.28 -2.96 116.94 117.65 1iy5 h PHE 37 Ca 0.00 -0.18 -0.15 0.00 3.53 0.00 0.00 57.97 61.17 1iy5 h PHE 37 Cb 0.47 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1iy5 h PHE 37 CO 0.00 1.59 -0.65 0.00 -2.23 0.00 0.00 178.31 177.02 1iy5 h ASN 39 N 0.16 0.49 0.07 0.00 2.35 -1.60 0.19 115.58 117.24 1iy5 h ASN 39 Ca -0.01 -0.65 -0.00 0.00 -0.55 0.00 0.00 56.30 55.08 1iy5 h ASN 39 Cb 1.18 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.40 1iy5 h ASN 39 CO 0.10 1.06 -0.02 0.00 -1.65 0.00 0.00 177.43 176.91 1iy5 h ALA 40 N 0.44 1.48 0.05 -0.83 0.00 -1.50 0.11 119.26 119.01 1iy5 h ALA 40 Ca -0.03 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 1iy5 h ALA 40 Cb 1.05 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1iy5 h ALA 40 CO 0.08 0.03 -1.08 0.28 0.00 0.00 0.00 179.25 178.56 1iy5 h VAL 41 N 0.00 1.62 0.00 0.00 2.07 -0.90 -2.77 116.25 116.27 1iy5 h VAL 41 Ca -0.00 -3.23 -0.07 0.00 0.82 0.00 0.00 66.70 64.22 1iy5 h VAL 41 Cb 0.06 2.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 1iy5 h VAL 41 CO 0.00 0.93 -0.34 0.58 0.02 0.00 0.00 177.57 178.76 1iy5 h VAL 42 N 0.04 1.13 0.00 2.57 2.07 0.13 0.20 116.25 122.38 1iy5 h VAL 42 Ca -0.06 -1.21 -0.15 0.00 0.82 0.00 0.00 66.70 66.09 1iy5 h VAL 42 Cb 1.83 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 33.25 1iy5 h VAL 42 CO 0.16 0.33 -0.75 1.05 0.02 0.00 0.00 177.57 178.38 1iy5 h GLU 43 N 0.00 0.00 -0.01 1.57 4.11 -1.35 -3.13 114.58 115.77 1iy5 h GLU 43 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1iy5 h GLU 43 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1iy5 h GLU 43 CO 0.04 0.71 -0.20 0.43 0.07 0.00 0.00 179.01 180.06 1iy5 n SER 44 N -3.27 1.25 -0.93 3.06 7.64 -0.86 -4.91 113.62 115.61 1iy5 n SER 44 Ca 0.01 -1.11 -0.12 0.00 1.01 0.00 0.00 58.87 58.66 1iy5 n SER 44 Cb 0.83 0.12 -0.05 0.00 -1.01 0.00 0.00 64.21 64.09 1iy5 n SER 44 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1iy5 n ASN 45 N -0.35 -5.13 0.00 6.43 4.13 -0.00 -1.41 115.26 118.92 1iy5 n ASN 45 Ca 0.14 0.30 0.00 0.00 1.68 0.00 0.00 54.58 56.70 1iy5 n ASN 45 Cb 0.36 -3.69 0.00 0.00 -1.54 0.00 0.00 39.78 34.91 1iy5 n ASN 45 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1iy5 n GLY 46 N -0.60 1.01 0.15 7.41 0.00 -0.82 -4.96 105.19 107.38 1iy5 n GLY 46 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1iy5 n GLY 46 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1iy5 h THR 47 N 0.00 0.00 -3.54 2.61 1.35 -1.49 -3.42 112.91 108.42 1iy5 h THR 47 Ca 0.00 -0.92 -0.68 0.00 -0.55 0.00 0.00 66.41 64.25 1iy5 h THR 47 Cb 0.00 1.67 -0.18 0.00 -1.73 0.00 0.00 68.15 67.91 1iy5 h THR 47 CO 0.00 0.00 -0.12 -0.22 -0.25 0.00 0.00 175.52 174.93 1iy5 s LEU 48 N -5.56 4.79 0.00 3.87 2.96 -1.26 -5.04 118.68 118.44 1iy5 s LEU 48 Ca 0.04 -0.61 0.00 0.00 -0.22 0.00 0.00 54.13 53.34 1iy5 s LEU 48 Cb 0.08 -2.47 0.00 0.00 0.50 0.00 0.00 46.19 44.30 1iy5 s LEU 48 CO 0.72 -0.64 0.00 0.35 -1.32 0.00 0.00 176.35 175.46 1iy5 n THR 49 N 5.54 0.00 -3.94 3.68 -2.24 -1.26 -4.75 114.28 111.31 1iy5 n THR 49 Ca -0.06 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.56 1iy5 n THR 49 Cb 0.47 -0.28 -0.16 0.00 -2.10 0.00 0.00 70.33 68.27 1iy5 n THR 49 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1iy5 s LEU 50 N 0.00 1.39 0.12 3.22 0.20 -1.26 -1.65 118.68 120.70 1iy5 s LEU 50 Ca 0.00 -0.03 0.03 0.00 0.69 0.00 0.00 54.13 54.82 1iy5 s LEU 50 Cb 0.00 -0.19 -0.19 0.00 -0.43 0.00 0.00 46.19 45.38 1iy5 s LEU 50 CO 0.00 -0.07 1.26 -1.28 -0.29 0.00 0.00 176.35 175.98 1iy5 h SER 51 N 6.94 0.16 0.00 3.68 0.87 -0.73 -3.38 113.55 121.09 1iy5 h SER 51 Ca -0.39 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 1iy5 h SER 51 Cb 1.15 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1iy5 h SER 51 CO 0.49 1.10 0.00 0.00 -0.53 0.00 0.00 176.83 177.88 1iy5 n HIS 52 N -3.46 0.00 -1.51 2.24 1.44 -1.16 -4.97 115.22 107.80 1iy5 n HIS 52 Ca -0.03 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.43 1iy5 n HIS 52 Cb 0.94 0.00 -0.18 0.00 0.12 0.00 0.00 29.99 30.87 1iy5 n HIS 52 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1iy5 n PHE 53 N 0.00 0.39 0.00 -1.40 3.01 -1.26 -3.00 117.46 115.20 1iy5 n PHE 53 Ca 0.00 0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.54 1iy5 n PHE 53 Cb 0.00 -1.36 0.00 0.00 -0.01 0.00 0.00 39.48 38.11 1iy5 n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iy5 n GLY 54 N 5.95 2.59 3.72 1.37 0.00 0.61 -4.85 105.19 114.58 1iy5 n GLY 54 Ca 0.62 -0.95 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 1iy5 n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iy5 s LYS 55 N -2.00 0.90 0.00 1.61 2.20 -1.26 -0.73 119.74 120.46 1iy5 s LYS 55 Ca 0.00 0.57 0.18 0.00 -0.36 0.00 0.00 55.97 56.36 1iy5 s LYS 55 Cb 0.00 -1.79 0.15 0.00 -1.51 0.00 0.00 37.83 34.68 1iy5 s LYS 55 CO 0.00 -2.43 1.09 0.00 -0.36 0.00 0.00 175.35 173.65