#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 -0.28 0.00 3.14 -1.26 -5.11 118.33 114.82 1iy5 n VAL 4 Ca 0.00 0.00 0.03 0.00 -2.96 0.00 0.00 64.34 61.41 1iy5 n VAL 4 Cb 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 32.76 1iy5 n VAL 4 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1iy5 n SER 5 N 0.00 -1.58 -4.90 6.55 3.41 -1.26 -4.92 113.62 110.92 1iy5 n SER 5 Ca 0.00 0.26 -0.29 0.00 -0.26 0.00 0.00 58.87 58.58 1iy5 n SER 5 Cb 0.00 -0.95 0.01 0.00 -0.26 0.00 0.00 64.21 63.01 1iy5 n SER 5 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1iy5 s VAL 6 N -2.93 4.49 0.06 -3.33 1.01 -1.26 -5.02 120.40 113.42 1iy5 s VAL 6 Ca 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 1iy5 s VAL 6 Cb 0.00 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 1iy5 s VAL 6 CO 0.00 -0.85 1.06 -0.62 0.00 0.00 0.00 175.10 174.69 1iy5 s ASP 7 N -4.19 7.29 -0.56 3.32 2.15 -1.26 -4.96 116.67 118.45 1iy5 s ASP 7 Ca 0.52 1.84 0.06 0.00 0.43 0.00 0.00 52.55 55.40 1iy5 s ASP 7 Cb -0.11 -2.58 0.33 0.00 -0.30 0.00 0.00 42.92 40.26 1iy5 s ASP 7 CO 0.48 -0.29 0.89 0.00 -0.17 0.00 0.00 175.17 176.08 1iy5 n SER 9 N -0.01 -1.07 -3.36 0.00 2.88 -1.26 -3.41 113.62 107.39 1iy5 n SER 9 Ca 0.30 -1.20 -0.20 0.00 -1.33 0.00 0.00 58.87 56.44 1iy5 n SER 9 Cb 0.42 -0.80 0.02 0.00 -0.75 0.00 0.00 64.21 63.10 1iy5 n SER 9 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1iy5 n GLU 10 N 5.70 -1.12 -2.68 -1.46 0.28 -1.26 -4.91 120.64 115.17 1iy5 n GLU 10 Ca 0.35 1.11 -0.21 0.00 -0.16 0.00 0.00 57.16 58.25 1iy5 n GLU 10 Cb 0.35 -1.52 0.04 0.00 1.43 0.00 0.00 31.44 31.74 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 -1.24 2.68 0.69 -1.84 1.51 -1.22 -4.62 117.35 113.31 1iy5 s TYR 11 Ca 0.20 -0.10 -0.11 0.00 -1.01 0.00 0.00 57.07 56.04 1iy5 s TYR 11 Cb -0.02 -2.72 0.00 0.00 -0.11 0.00 0.00 41.96 39.11 1iy5 s TYR 11 CO 0.45 -0.92 1.08 -1.25 -1.11 0.00 0.00 175.55 173.80 1iy5 s PRO 12 N -4.75 3.03 -0.05 -1.71 0.04 -1.26 -5.01 135.00 125.28 1iy5 s PRO 12 Ca 0.58 0.56 -0.02 0.00 0.04 0.00 0.00 61.00 62.17 1iy5 s PRO 12 Cb -0.10 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1iy5 s PRO 12 CO 0.38 -0.94 0.04 0.15 0.04 0.00 0.00 177.00 176.68 1iy5 s LYS 13 N -5.29 0.15 0.00 4.56 -0.14 -1.26 -5.00 119.74 112.75 1iy5 s LYS 13 Ca 0.57 0.28 0.01 0.00 -1.36 0.00 0.00 55.97 55.47 1iy5 s LYS 13 Cb -0.11 -0.65 0.04 0.00 -1.68 0.00 0.00 37.83 35.43 1iy5 s LYS 13 CO 0.53 -0.31 1.01 -0.35 -0.76 0.00 0.00 175.35 175.47 1iy5 n PRO 14 N 5.19 0.99 -3.41 -1.68 -0.04 -1.26 -4.53 135.00 130.26 1iy5 n PRO 14 Ca -0.05 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.96 1iy5 n PRO 14 Cb 0.50 -1.01 -0.03 0.00 -0.04 0.00 0.00 33.50 32.92 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 -2.00 4.21 0.16 0.55 0.00 -1.26 -5.00 121.76 118.42 1iy5 s ALA 15 Ca 0.01 -3.50 -0.10 0.00 0.00 0.00 0.00 51.96 48.37 1iy5 s ALA 15 Cb 0.00 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 19.75 1iy5 s ALA 15 CO 0.01 -2.23 0.29 0.00 0.00 0.00 0.00 175.76 173.83 1iy5 n THR 17 N -0.21 0.00 0.28 0.00 -2.24 -1.26 -4.97 114.28 105.88 1iy5 n THR 17 Ca -0.08 -1.91 0.00 0.00 -2.27 0.00 0.00 64.05 59.79 1iy5 n THR 17 Cb 0.63 -0.49 0.13 0.00 -2.10 0.00 0.00 70.33 68.51 1iy5 n THR 17 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1iy5 n MET 18 N -2.20 2.25 -1.51 -0.78 2.81 -1.26 -4.94 117.12 111.49 1iy5 n MET 18 Ca 0.15 -1.15 -0.57 0.00 -1.81 0.00 0.00 57.70 54.32 1iy5 n MET 18 Cb 0.59 -1.72 -0.07 0.00 -0.71 0.00 0.00 33.22 31.31 1iy5 n MET 18 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1iy5 n GLU 19 N 0.17 0.22 -1.20 0.03 2.13 -1.26 -4.78 120.64 115.94 1iy5 n GLU 19 Ca 0.12 0.08 -0.23 0.00 0.66 0.00 0.00 57.16 57.79 1iy5 n GLU 19 Cb 0.66 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.81 1iy5 n GLU 19 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1iy5 n TYR 20 N 1.56 1.73 -2.59 4.31 9.36 -1.25 -4.27 117.16 126.01 1iy5 n TYR 20 Ca 0.19 -2.05 -0.43 0.00 3.32 0.00 0.00 57.90 58.93 1iy5 n TYR 20 Cb 0.11 -1.18 -0.02 0.00 -0.63 0.00 0.00 39.34 37.62 1iy5 n TYR 20 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 1iy5 s ARG 21 N -1.98 3.92 -0.21 2.98 3.52 0.34 -4.93 118.95 122.60 1iy5 s ARG 21 Ca 0.46 0.93 -0.29 0.00 -0.13 0.00 0.00 55.73 56.70 1iy5 s ARG 21 Cb 0.33 -3.82 -0.00 0.00 -1.56 0.00 0.00 34.95 29.89 1iy5 s ARG 21 CO -0.11 -1.11 1.19 -1.25 -0.81 0.00 0.00 175.30 173.22 1iy5 s PRO 22 N 4.02 4.20 -0.20 5.12 0.04 -1.25 -1.47 135.00 145.47 1iy5 s PRO 22 Ca 0.48 1.49 0.01 0.00 0.04 0.00 0.00 61.00 63.03 1iy5 s PRO 22 Cb -0.11 -3.74 0.04 0.00 0.04 0.00 0.00 34.50 30.73 1iy5 s PRO 22 CO 0.22 -0.74 -0.14 -0.51 0.04 0.00 0.00 177.00 175.88 1iy5 s LEU 23 N 3.51 2.35 -1.01 -3.56 1.43 -0.99 0.20 118.68 120.61 1iy5 s LEU 23 Ca 0.51 -0.85 -0.18 0.00 -1.03 0.00 0.00 54.13 52.58 1iy5 s LEU 23 Cb -0.19 -1.35 0.13 0.00 0.03 0.00 0.00 46.19 44.82 1iy5 s LEU 23 CO 0.13 -0.10 1.23 0.00 0.23 0.00 0.00 176.35 177.84 1iy5 n GLY 25 N 5.26 -1.39 0.15 0.00 0.00 0.40 -0.16 105.19 109.45 1iy5 n GLY 25 Ca 0.28 -0.36 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1iy5 n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1iy5 n SER 26 N -0.39 0.41 -0.72 1.61 3.41 -0.59 -0.51 113.62 116.84 1iy5 n SER 26 Ca 0.11 0.63 0.02 0.00 -0.26 0.00 0.00 58.87 59.36 1iy5 n SER 26 Cb 0.50 -0.63 0.08 0.00 -0.26 0.00 0.00 64.21 63.89 1iy5 n SER 26 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1iy5 n ASP 27 N -2.10 1.83 -3.48 4.04 5.75 -1.26 -4.83 116.55 116.50 1iy5 n ASP 27 Ca -0.01 -2.17 -0.22 0.00 -0.01 0.00 0.00 54.79 52.38 1iy5 n ASP 27 Cb 0.19 -0.48 0.08 0.00 -1.03 0.00 0.00 41.12 39.88 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 0.11 -5.39 -4.27 -1.12 5.15 0.33 -5.00 115.26 105.07 1iy5 n ASN 28 Ca 0.06 -0.54 -0.23 0.00 -0.60 0.00 0.00 54.58 53.27 1iy5 n ASN 28 Cb 0.40 -4.93 -0.12 0.00 -0.53 0.00 0.00 39.78 34.60 1iy5 n ASN 28 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1iy5 s LYS 29 N -6.08 1.08 0.03 1.20 2.20 -1.19 -4.94 119.74 112.03 1iy5 s LYS 29 Ca 0.45 -1.13 -0.06 0.00 -0.36 0.00 0.00 55.97 54.87 1iy5 s LYS 29 Cb -0.20 -1.30 -0.05 0.00 -1.51 0.00 0.00 37.83 34.78 1iy5 s LYS 29 CO 0.71 0.30 0.27 0.99 -0.36 0.00 0.00 175.35 177.26 1iy5 s THR 30 N -1.19 5.30 0.09 3.43 2.01 -1.26 -0.45 115.64 123.56 1iy5 s THR 30 Ca 0.05 0.09 0.05 0.00 0.31 0.00 0.00 61.69 62.19 1iy5 s THR 30 Cb -0.10 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 1iy5 s THR 30 CO 0.04 0.31 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.83 1iy5 s TYR 31 N -1.36 1.22 0.39 4.92 2.02 -0.32 -4.89 117.35 119.34 1iy5 s TYR 31 Ca 0.30 -0.52 0.11 0.00 -0.37 0.00 0.00 57.07 56.59 1iy5 s TYR 31 Cb -0.13 -0.67 0.78 0.00 -0.40 0.00 0.00 41.96 41.54 1iy5 s TYR 31 CO 0.18 0.07 1.89 0.78 -1.57 0.00 0.00 175.55 176.89 1iy5 h GLY 32 N 3.98 0.14 0.00 0.71 0.00 -1.87 -2.63 103.07 103.39 1iy5 h GLY 32 Ca -0.40 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1iy5 h GLY 32 CO 0.45 0.09 0.00 1.16 0.00 0.00 0.00 176.54 178.24 1iy5 n ASN 33 N -4.21 0.00 0.02 0.19 0.23 -0.54 0.13 115.26 111.08 1iy5 n ASN 33 Ca -0.01 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.04 1iy5 n ASN 33 Cb 0.32 0.00 0.32 0.00 -2.08 0.00 0.00 39.78 38.34 1iy5 n ASN 33 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1iy5 h LYS 34 N 0.00 0.47 -0.04 -3.83 3.11 -1.92 -0.07 116.57 114.29 1iy5 h LYS 34 Ca 0.00 -0.10 -0.21 0.00 -2.81 0.00 0.00 60.65 57.53 1iy5 h LYS 34 Cb 0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.16 1iy5 h LYS 34 CO 0.00 0.51 -0.86 0.00 -2.81 0.00 0.00 179.45 176.29 1iy5 n ASN 36 N -3.81 0.48 -0.07 0.00 2.85 -1.09 -2.67 115.26 110.95 1iy5 n ASN 36 Ca -0.06 0.55 -0.14 0.00 -0.11 0.00 0.00 54.58 54.82 1iy5 n ASN 36 Cb 0.79 -0.67 -0.12 0.00 1.24 0.00 0.00 39.78 41.01 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 0.00 0.00 1.20 3.57 -0.76 -2.63 116.94 118.32 1iy5 h PHE 37 Ca 0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1iy5 h PHE 37 Cb 0.63 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 1iy5 h PHE 37 CO 0.00 0.98 -0.13 0.00 -2.23 0.00 0.00 178.31 176.93 1iy5 h ASN 39 N 0.00 0.32 0.08 0.00 4.21 -1.58 -0.84 115.58 117.77 1iy5 h ASN 39 Ca -0.00 -0.71 -0.01 0.00 1.21 0.00 0.00 56.30 56.78 1iy5 h ASN 39 Cb 0.47 -0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 37.57 1iy5 h ASN 39 CO 0.02 0.99 -0.06 0.00 -1.29 0.00 0.00 177.43 177.09 1iy5 h ALA 40 N 0.34 1.75 -0.08 -0.83 0.00 -1.16 0.26 119.26 119.53 1iy5 h ALA 40 Ca -0.03 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1iy5 h ALA 40 Cb 1.01 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1iy5 h ALA 40 CO 0.06 0.07 -0.54 0.28 0.00 0.00 0.00 179.25 179.12 1iy5 h VAL 41 N 0.00 1.36 0.00 0.00 2.07 -0.97 -2.13 116.25 116.59 1iy5 h VAL 41 Ca -0.00 -1.84 -0.02 0.00 0.82 0.00 0.00 66.70 65.66 1iy5 h VAL 41 Cb 0.11 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1iy5 h VAL 41 CO 0.01 0.54 -0.12 0.58 0.02 0.00 0.00 177.57 178.60 1iy5 h VAL 42 N 0.19 0.76 -0.28 2.57 2.07 0.98 0.10 116.25 122.64 1iy5 h VAL 42 Ca 0.00 -0.46 -0.18 0.00 0.82 0.00 0.00 66.70 66.88 1iy5 h VAL 42 Cb 1.02 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1iy5 h VAL 42 CO 0.08 0.11 -0.53 -0.33 0.02 0.00 0.00 177.57 176.93 1iy5 h GLU 43 N 0.00 0.82 -0.00 1.57 4.39 -1.03 -2.37 114.58 117.95 1iy5 h GLU 43 Ca -0.00 -0.51 0.00 0.00 0.34 0.00 0.00 59.36 59.19 1iy5 h GLU 43 Cb 0.26 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1iy5 h GLU 43 CO 0.02 1.14 0.00 -1.13 -1.16 0.00 0.00 179.01 177.87 1iy5 n SER 44 N -4.00 0.01 0.00 1.42 3.41 -0.51 -4.82 113.62 109.13 1iy5 n SER 44 Ca -0.04 -1.58 0.00 0.00 -0.26 0.00 0.00 58.87 56.99 1iy5 n SER 44 Cb 0.62 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1iy5 n SER 44 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1iy5 n ASN 45 N -0.71 0.00 0.00 4.04 2.85 -0.85 -2.98 115.26 117.61 1iy5 n ASN 45 Ca 0.10 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.57 1iy5 n ASN 45 Cb 0.05 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.07 1iy5 n ASN 45 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1iy5 n GLY 46 N -2.00 1.20 1.78 8.20 0.00 0.24 -4.92 105.19 109.70 1iy5 n GLY 46 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1iy5 n GLY 46 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iy5 n THR 47 N -0.76 2.41 -4.39 2.61 -2.24 -1.16 -4.89 114.28 105.86 1iy5 n THR 47 Ca 0.00 -1.24 -0.30 0.00 -2.27 0.00 0.00 64.05 60.23 1iy5 n THR 47 Cb 0.00 -0.61 -0.11 0.00 -2.10 0.00 0.00 70.33 67.51 1iy5 n THR 47 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1iy5 s LEU 48 N -2.17 2.87 0.00 3.22 2.96 -1.26 -5.03 118.68 119.27 1iy5 s LEU 48 Ca 0.38 -0.41 0.00 0.00 -0.22 0.00 0.00 54.13 53.88 1iy5 s LEU 48 Cb 0.32 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 45.32 1iy5 s LEU 48 CO 0.08 0.21 0.00 0.35 -1.32 0.00 0.00 176.35 175.67 1iy5 n THR 49 N 1.05 0.00 -4.43 3.68 -2.24 -1.26 -4.98 114.28 106.11 1iy5 n THR 49 Ca -0.15 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.37 1iy5 n THR 49 Cb 0.52 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.64 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 2.45 0.00 3.22 2.96 -1.26 -1.54 118.68 124.51 1iy5 s LEU 50 Ca 0.00 -0.88 0.00 0.00 -0.22 0.00 0.00 54.13 53.03 1iy5 s LEU 50 Cb 0.00 -1.15 0.00 0.00 0.50 0.00 0.00 46.19 45.54 1iy5 s LEU 50 CO 0.00 0.11 0.00 -1.54 -1.32 0.00 0.00 176.35 173.60 1iy5 n SER 51 N 0.19 4.32 0.00 3.68 3.41 0.77 -3.85 113.62 122.14 1iy5 n SER 51 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 1iy5 n SER 51 Cb 0.56 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.74 1iy5 n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iy5 n HIS 52 N -2.22 0.00 -1.51 7.33 1.44 -1.15 -4.99 115.22 114.12 1iy5 n HIS 52 Ca 0.00 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.40 1iy5 n HIS 52 Cb 0.48 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.42 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 0.42 0.00 -1.40 3.01 -1.26 -2.88 117.46 115.35 1iy5 n PHE 53 Ca 0.00 0.18 0.00 0.00 1.01 0.00 0.00 57.45 58.64 1iy5 n PHE 53 Cb 0.00 -1.62 0.00 0.00 -0.01 0.00 0.00 39.48 37.85 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 6.06 0.42 3.84 1.37 0.00 0.52 -4.84 105.19 112.56 1iy5 n GLY 54 Ca 0.64 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 1iy5 n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iy5 s LYS 55 N -2.00 3.98 0.00 1.61 -2.85 -1.26 0.62 119.74 119.83 1iy5 s LYS 55 Ca 0.00 0.96 0.28 0.00 -1.00 0.00 0.00 55.97 56.20 1iy5 s LYS 55 Cb 0.00 -2.15 0.95 0.00 -2.06 0.00 0.00 37.83 34.57 1iy5 s LYS 55 CO 0.00 -0.23 1.69 0.00 0.10 0.00 0.00 175.35 176.91