#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 -1.30 0.00 0.31 -1.26 -5.07 118.33 111.01 1iy5 n VAL 4 Ca 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 64.34 63.72 1iy5 n VAL 4 Cb 0.00 0.20 0.00 0.00 -0.91 0.00 0.00 33.84 33.13 1iy5 n VAL 4 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1iy5 n SER 5 N -1.74 -5.93 -2.83 4.52 3.41 -1.26 -5.10 113.62 104.70 1iy5 n SER 5 Ca -0.02 0.76 -0.12 0.00 -0.26 0.00 0.00 58.87 59.23 1iy5 n SER 5 Cb 0.16 -3.08 -0.00 0.00 -0.26 0.00 0.00 64.21 61.02 1iy5 n SER 5 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1iy5 n VAL 6 N 0.86 0.00 0.00 -3.33 0.31 -1.26 -5.10 118.33 109.80 1iy5 n VAL 6 Ca 0.00 -1.37 0.00 0.00 -0.01 0.00 0.00 64.34 62.96 1iy5 n VAL 6 Cb 0.00 1.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.94 1iy5 n VAL 6 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1iy5 n ASP 7 N -1.58 0.00 -1.47 4.52 2.03 -1.26 -4.79 116.55 114.01 1iy5 n ASP 7 Ca -0.03 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.16 1iy5 n ASP 7 Cb 0.57 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.97 1iy5 n ASP 7 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1iy5 h SER 9 N -0.33 -0.54 -2.03 0.00 0.02 -2.02 -3.37 113.55 105.28 1iy5 h SER 9 Ca -0.27 0.06 -0.56 0.00 -0.84 0.00 0.00 61.79 60.18 1iy5 h SER 9 Cb 1.20 0.20 -0.38 0.00 0.14 0.00 0.00 62.40 63.56 1iy5 h SER 9 CO 0.31 -0.29 -1.06 -1.84 -1.14 0.00 0.00 176.83 172.81 1iy5 n GLU 10 N -5.32 0.58 -4.00 3.45 0.28 -1.26 -5.11 120.64 109.26 1iy5 n GLU 10 Ca -0.07 -3.17 -0.27 0.00 -0.16 0.00 0.00 57.16 53.50 1iy5 n GLU 10 Cb 0.24 -1.33 -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 -0.83 3.35 0.58 -1.84 1.51 -1.26 -3.90 117.35 114.97 1iy5 s TYR 11 Ca 0.34 0.08 -0.16 0.00 -1.01 0.00 0.00 57.07 56.32 1iy5 s TYR 11 Cb 0.14 -1.62 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 1iy5 s TYR 11 CO -0.13 0.52 1.05 -1.25 -1.11 0.00 0.00 175.55 174.63 1iy5 s PRO 12 N -3.08 3.41 0.37 -1.71 0.04 -1.26 -5.09 135.00 127.68 1iy5 s PRO 12 Ca 0.33 1.19 -0.04 0.00 0.04 0.00 0.00 61.00 62.51 1iy5 s PRO 12 Cb -0.11 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1iy5 s PRO 12 CO 0.26 -0.73 0.64 0.15 0.04 0.00 0.00 177.00 177.36 1iy5 s LYS 13 N -4.03 3.59 0.00 4.56 1.02 -1.25 -4.96 119.74 118.66 1iy5 s LYS 13 Ca 0.63 0.03 0.01 0.00 0.02 0.00 0.00 55.97 56.66 1iy5 s LYS 13 Cb -0.15 -2.54 0.05 0.00 -0.52 0.00 0.00 37.83 34.67 1iy5 s LYS 13 CO 0.35 0.05 0.97 -0.35 -0.92 0.00 0.00 175.35 175.45 1iy5 n PRO 14 N -1.57 0.93 0.00 -1.68 -0.04 -1.26 -4.77 135.00 126.61 1iy5 n PRO 14 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1iy5 n PRO 14 Cb 0.55 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.99 1iy5 n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iy5 n ALA 15 N -0.52 0.00 -1.66 0.55 0.00 -1.26 -5.17 120.51 112.45 1iy5 n ALA 15 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1iy5 n ALA 15 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1iy5 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iy5 s THR 17 N 0.35 0.09 -1.30 0.00 -4.23 -1.26 -5.02 115.64 104.28 1iy5 s THR 17 Ca 0.00 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.56 1iy5 s THR 17 Cb 0.00 -2.52 0.22 0.00 1.34 0.00 0.00 72.50 71.54 1iy5 s THR 17 CO 0.00 0.00 0.99 0.23 -0.54 0.00 0.00 174.62 175.30 1iy5 n MET 18 N -0.33 1.88 -0.90 3.99 2.81 -1.26 -4.92 117.12 118.39 1iy5 n MET 18 Ca 0.02 -0.87 -0.33 0.00 -1.81 0.00 0.00 57.70 54.70 1iy5 n MET 18 Cb 0.66 -1.49 0.11 0.00 -0.71 0.00 0.00 33.22 31.79 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 -0.15 -3.97 0.03 2.13 -1.26 -4.96 120.64 112.62 1iy5 n GLU 19 Ca 0.08 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.56 1iy5 n GLU 19 Cb 0.38 -1.91 -0.14 0.00 0.27 0.00 0.00 31.44 30.04 1iy5 n GLU 19 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1iy5 s TYR 20 N -2.30 3.11 -0.30 4.31 5.04 -1.26 -4.76 117.35 121.20 1iy5 s TYR 20 Ca 0.60 -1.72 0.02 0.00 -2.44 0.00 0.00 57.07 53.54 1iy5 s TYR 20 Cb -0.24 -2.04 0.16 0.00 0.35 0.00 0.00 41.96 40.19 1iy5 s TYR 20 CO 0.64 -0.77 0.42 1.03 -1.34 0.00 0.00 175.55 175.54 1iy5 s ARG 21 N 1.28 0.44 -0.43 4.97 0.52 -0.86 -5.00 118.95 119.88 1iy5 s ARG 21 Ca -0.02 0.09 -0.29 0.00 -0.52 0.00 0.00 55.73 55.00 1iy5 s ARG 21 Cb -0.17 -0.29 0.01 0.00 0.52 0.00 0.00 34.95 35.02 1iy5 s ARG 21 CO -0.04 -1.05 1.39 -1.25 0.02 0.00 0.00 175.30 174.36 1iy5 s PRO 22 N 2.49 3.57 -0.16 3.54 0.04 -1.25 -2.00 135.00 141.23 1iy5 s PRO 22 Ca 0.10 0.88 -0.01 0.00 0.04 0.00 0.00 61.00 62.00 1iy5 s PRO 22 Cb -0.12 -4.02 -0.01 0.00 0.04 0.00 0.00 34.50 30.39 1iy5 s PRO 22 CO -0.28 -1.57 -0.10 -0.51 0.04 0.00 0.00 177.00 174.57 1iy5 s LEU 23 N 5.38 2.78 -1.12 -3.56 1.43 -1.15 0.10 118.68 122.55 1iy5 s LEU 23 Ca 0.60 -0.34 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 1iy5 s LEU 23 Cb -0.13 -1.65 0.16 0.00 0.03 0.00 0.00 46.19 44.59 1iy5 s LEU 23 CO 0.32 0.11 1.33 0.00 0.23 0.00 0.00 176.35 178.35 1iy5 n GLY 25 N 4.59 -2.92 0.26 0.00 0.00 0.17 0.48 105.19 107.76 1iy5 n GLY 25 Ca 0.33 -0.37 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1iy5 n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1iy5 h SER 26 N -0.32 0.00 -0.15 1.61 0.87 -1.03 0.26 113.55 114.80 1iy5 h SER 26 Ca -0.43 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.11 1iy5 h SER 26 Cb 1.38 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.33 1iy5 h SER 26 CO 0.38 0.00 0.03 -0.90 -0.53 0.00 0.00 176.83 175.81 1iy5 n ASP 27 N -2.43 2.27 -3.61 6.23 5.75 -1.26 -4.82 116.55 118.67 1iy5 n ASP 27 Ca -0.01 -2.24 -0.26 0.00 -0.01 0.00 0.00 54.79 52.27 1iy5 n ASP 27 Cb 0.47 -0.55 0.05 0.00 -1.03 0.00 0.00 41.12 40.07 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 0.14 -5.70 -4.21 -1.12 2.85 0.92 -4.98 115.26 103.16 1iy5 n ASN 28 Ca 0.08 -0.58 -0.25 0.00 -0.11 0.00 0.00 54.58 53.72 1iy5 n ASN 28 Cb 0.52 -4.53 -0.15 0.00 1.24 0.00 0.00 39.78 36.86 1iy5 n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1iy5 s LYS 29 N -6.32 1.46 0.40 1.20 2.20 -1.18 -4.89 119.74 112.61 1iy5 s LYS 29 Ca 0.57 -0.77 -0.16 0.00 -0.36 0.00 0.00 55.97 55.24 1iy5 s LYS 29 Cb -0.26 -1.46 -0.09 0.00 -1.51 0.00 0.00 37.83 34.50 1iy5 s LYS 29 CO 0.70 0.39 0.85 0.99 -0.36 0.00 0.00 175.35 177.92 1iy5 s THR 30 N -0.59 4.59 0.22 3.43 2.01 -1.25 0.41 115.64 124.46 1iy5 s THR 30 Ca 0.07 1.10 0.12 0.00 0.31 0.00 0.00 61.69 63.28 1iy5 s THR 30 Cb -0.08 -3.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.74 1iy5 s THR 30 CO 0.00 -0.38 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.01 1iy5 s TYR 31 N -2.23 2.30 0.26 4.92 2.02 0.25 -4.83 117.35 120.04 1iy5 s TYR 31 Ca 0.57 -0.35 0.13 0.00 -0.37 0.00 0.00 57.07 57.04 1iy5 s TYR 31 Cb -0.10 -1.10 0.47 0.00 -0.40 0.00 0.00 41.96 40.83 1iy5 s TYR 31 CO 0.21 0.57 1.66 0.78 -1.57 0.00 0.00 175.55 177.20 1iy5 h GLY 32 N 2.93 0.00 0.00 0.71 0.00 -1.89 -3.04 103.07 101.78 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 0.51 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.21 1iy5 n ASN 33 N -3.77 0.00 0.29 0.19 6.94 -0.85 -2.02 115.26 116.04 1iy5 n ASN 33 Ca -0.01 0.00 0.19 0.00 -0.02 0.00 0.00 54.58 54.74 1iy5 n ASN 33 Cb 0.57 0.00 0.81 0.00 -2.36 0.00 0.00 39.78 38.80 1iy5 n ASN 33 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 1iy5 h LYS 34 N 0.00 0.00 0.00 -3.83 2.10 -1.94 -1.44 116.57 111.47 1iy5 h LYS 34 Ca 0.00 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.45 1iy5 h LYS 34 Cb 0.00 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.30 1iy5 h LYS 34 CO 0.00 0.00 -0.93 0.00 -2.00 0.00 0.00 179.45 176.52 1iy5 h ASN 36 N 0.01 0.00 0.01 0.00 -0.73 -1.80 -2.81 115.58 110.26 1iy5 h ASN 36 Ca -0.01 -0.12 -0.10 0.00 1.87 0.00 0.00 56.30 57.94 1iy5 h ASN 36 Cb 1.64 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 40.22 1iy5 h ASN 36 CO 0.12 0.06 -0.55 0.15 -0.37 0.00 0.00 177.43 176.84 1iy5 h PHE 37 N 0.00 0.06 -0.17 0.67 3.57 -1.12 -1.03 116.94 118.91 1iy5 h PHE 37 Ca 0.00 -0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.32 1iy5 h PHE 37 Cb 0.79 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1iy5 h PHE 37 CO 0.00 1.21 -0.47 0.00 -2.23 0.00 0.00 178.31 176.82 1iy5 h ASN 39 N 0.35 0.62 -0.05 0.00 4.21 -1.63 -2.65 115.58 116.43 1iy5 h ASN 39 Ca 0.02 -0.77 0.01 0.00 1.21 0.00 0.00 56.30 56.77 1iy5 h ASN 39 Cb 0.96 -0.19 -0.00 0.00 -1.12 0.00 0.00 38.32 37.97 1iy5 h ASN 39 CO 0.08 1.31 0.09 0.00 -1.29 0.00 0.00 177.43 177.63 1iy5 h ALA 40 N 0.32 1.39 -0.12 -0.83 0.00 -1.11 0.35 119.26 119.26 1iy5 h ALA 40 Ca -0.10 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.61 1iy5 h ALA 40 Cb 1.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1iy5 h ALA 40 CO 0.14 -0.12 -0.76 0.28 0.00 0.00 0.00 179.25 178.80 1iy5 h VAL 41 N 0.00 1.33 -0.00 0.00 2.07 -0.98 -1.67 116.25 117.00 1iy5 h VAL 41 Ca 0.02 -2.06 0.00 0.00 0.82 0.00 0.00 66.70 65.48 1iy5 h VAL 41 Cb 0.21 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1iy5 h VAL 41 CO -0.00 0.64 -0.24 0.52 0.02 0.00 0.00 177.57 178.50 1iy5 n VAL 42 N -3.89 0.00 1.01 2.57 0.31 0.92 -0.07 118.33 119.19 1iy5 n VAL 42 Ca -0.06 -0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.37 1iy5 n VAL 42 Cb 0.73 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 1iy5 n VAL 42 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1iy5 n GLU 43 N -1.47 0.19 -0.55 5.55 1.02 0.51 -4.06 120.64 121.82 1iy5 n GLU 43 Ca 0.07 -0.15 0.05 0.00 -0.02 0.00 0.00 57.16 57.11 1iy5 n GLU 43 Cb 0.33 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 30.51 1iy5 n GLU 43 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1iy5 n SER 44 N -1.28 3.70 -0.01 1.62 2.88 -0.64 -4.91 113.62 114.98 1iy5 n SER 44 Ca 0.05 -3.18 -0.00 0.00 -1.33 0.00 0.00 58.87 54.42 1iy5 n SER 44 Cb 0.35 -0.58 -0.00 0.00 -0.75 0.00 0.00 64.21 63.23 1iy5 n SER 44 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1iy5 n ASN 45 N -0.61 -3.75 0.00 -3.46 4.13 -1.25 -2.62 115.26 107.71 1iy5 n ASN 45 Ca 0.25 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.51 1iy5 n ASN 45 Cb 0.96 -1.26 0.00 0.00 -1.54 0.00 0.00 39.78 37.94 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 -2.00 0.80 0.12 7.41 0.00 0.90 -4.86 105.19 107.56 1iy5 n GLY 46 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.35 0.00 -3.25 2.61 -2.24 -1.08 -4.83 114.28 103.15 1iy5 n THR 47 Ca 0.00 -0.06 -0.39 0.00 -2.27 0.00 0.00 64.05 61.33 1iy5 n THR 47 Cb 0.00 0.34 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 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 -2.76 4.25 0.00 3.22 0.20 -1.26 -5.04 118.68 117.29 1iy5 s LEU 48 Ca 0.17 0.85 0.00 0.00 0.69 0.00 0.00 54.13 55.84 1iy5 s LEU 48 Cb 0.18 -2.77 0.00 0.00 -0.43 0.00 0.00 46.19 43.17 1iy5 s LEU 48 CO 0.62 -0.07 0.00 0.35 -0.29 0.00 0.00 176.35 176.96 1iy5 n THR 49 N 3.92 0.00 -4.14 3.68 -2.24 -1.26 -4.64 114.28 109.60 1iy5 n THR 49 Ca -0.05 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.49 1iy5 n THR 49 Cb 0.51 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.68 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 3.22 0.00 3.22 2.96 -1.26 -1.34 118.68 125.47 1iy5 s LEU 50 Ca 0.00 -0.81 0.00 0.00 -0.22 0.00 0.00 54.13 53.10 1iy5 s LEU 50 Cb 0.00 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 45.02 1iy5 s LEU 50 CO 0.00 -0.29 0.00 -1.54 -1.32 0.00 0.00 176.35 173.20 1iy5 n SER 51 N -1.12 2.20 0.00 3.68 3.41 0.18 -2.79 113.62 119.18 1iy5 n SER 51 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1iy5 n SER 51 Cb 0.61 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.75 1iy5 n SER 51 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1iy5 n HIS 52 N -1.32 0.00 -1.42 7.33 -0.00 -1.05 -4.94 115.22 113.82 1iy5 n HIS 52 Ca 0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 57.72 57.12 1iy5 n HIS 52 Cb 0.23 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.11 1iy5 n HIS 52 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1iy5 n PHE 53 N 0.00 1.43 0.00 1.57 3.01 -1.26 -2.81 117.46 119.40 1iy5 n PHE 53 Ca 0.00 0.75 0.00 0.00 1.01 0.00 0.00 57.45 59.21 1iy5 n PHE 53 Cb 0.00 -2.33 0.00 0.00 -0.01 0.00 0.00 39.48 37.14 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 6.36 3.41 3.75 1.37 0.00 0.28 -4.83 105.19 115.54 1iy5 n GLY 54 Ca 0.46 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.43 4.74 0.00 1.61 2.20 -1.24 -1.16 119.74 123.46 1iy5 s LYS 55 Ca 0.00 1.63 0.28 0.00 -0.36 0.00 0.00 55.97 57.52 1iy5 s LYS 55 Cb 0.00 -3.25 1.05 0.00 -1.51 0.00 0.00 37.83 34.12 1iy5 s LYS 55 CO 0.00 0.33 1.74 0.00 -0.36 0.00 0.00 175.35 177.07