#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 3.43 -3.61 0.00 3.14 -1.26 -4.92 118.33 115.11 1iy5 n VAL 4 Ca 0.00 -2.90 -0.16 0.00 -2.96 0.00 0.00 64.34 58.32 1iy5 n VAL 4 Cb 0.00 -1.03 -0.07 0.00 -1.06 0.00 0.00 33.84 31.68 1iy5 n VAL 4 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1iy5 s SER 5 N -1.95 -0.56 0.47 6.55 1.04 -1.26 -4.82 113.70 113.17 1iy5 s SER 5 Ca 0.62 0.73 0.08 0.00 0.48 0.00 0.00 55.95 57.86 1iy5 s SER 5 Cb 0.49 0.69 0.03 0.00 0.10 0.00 0.00 66.02 67.33 1iy5 s SER 5 CO 0.01 -0.47 0.62 0.54 0.98 0.00 0.00 173.24 174.93 1iy5 s VAL 6 N -0.80 2.69 -1.06 5.02 0.11 -1.26 -5.03 120.40 120.06 1iy5 s VAL 6 Ca -0.09 -1.03 -0.13 0.00 -2.93 0.00 0.00 61.98 57.80 1iy5 s VAL 6 Cb -0.02 -2.72 0.20 0.00 -1.53 0.00 0.00 36.38 32.31 1iy5 s VAL 6 CO 0.06 0.00 1.17 -0.62 -3.33 0.00 0.00 175.10 172.38 1iy5 s ASP 7 N -4.43 7.02 -0.02 3.54 2.15 -1.26 -4.87 116.67 118.79 1iy5 s ASP 7 Ca 0.56 -2.95 -0.00 0.00 0.43 0.00 0.00 52.55 50.59 1iy5 s ASP 7 Cb -0.08 -2.31 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1iy5 s ASP 7 CO 0.34 -0.64 2.07 0.00 -0.17 0.00 0.00 175.17 176.78 1iy5 n SER 9 N 1.46 0.23 -1.40 0.00 2.88 -1.26 -3.09 113.62 112.44 1iy5 n SER 9 Ca 0.04 -0.36 0.09 0.00 -1.33 0.00 0.00 58.87 57.31 1iy5 n SER 9 Cb 0.52 -0.17 0.31 0.00 -0.75 0.00 0.00 64.21 64.12 1iy5 n SER 9 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1iy5 n GLU 10 N -1.13 3.27 -3.91 -1.46 1.02 -1.26 -4.92 120.64 112.24 1iy5 n GLU 10 Ca 0.14 -2.48 -0.21 0.00 -0.02 0.00 0.00 57.16 54.59 1iy5 n GLU 10 Cb 0.26 -1.77 -0.04 0.00 -0.02 0.00 0.00 31.44 29.86 1iy5 n GLU 10 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1iy5 s TYR 11 N -1.71 2.94 0.72 -0.32 1.51 -1.18 -4.38 117.35 114.93 1iy5 s TYR 11 Ca 0.45 -0.26 -0.11 0.00 -1.01 0.00 0.00 57.07 56.14 1iy5 s TYR 11 Cb 0.28 -1.68 0.02 0.00 -0.11 0.00 0.00 41.96 40.47 1iy5 s TYR 11 CO 0.23 0.28 1.07 -1.25 -1.11 0.00 0.00 175.55 174.77 1iy5 s PRO 12 N -3.94 2.70 0.32 -1.71 0.04 -1.26 -5.09 135.00 126.06 1iy5 s PRO 12 Ca 0.39 0.74 0.08 0.00 0.04 0.00 0.00 61.00 62.25 1iy5 s PRO 12 Cb -0.06 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 1iy5 s PRO 12 CO 0.26 -1.21 0.20 0.15 0.04 0.00 0.00 177.00 176.44 1iy5 s LYS 13 N -5.15 2.58 0.00 4.56 -0.14 -1.26 -5.00 119.74 115.34 1iy5 s LYS 13 Ca 0.59 -1.37 0.00 0.00 -1.36 0.00 0.00 55.97 53.83 1iy5 s LYS 13 Cb -0.13 -2.35 0.00 0.00 -1.68 0.00 0.00 37.83 33.67 1iy5 s LYS 13 CO 0.54 0.16 0.86 -0.35 -0.76 0.00 0.00 175.35 175.79 1iy5 n PRO 14 N -1.23 0.96 -3.57 -1.68 -0.04 -1.26 -4.91 135.00 123.27 1iy5 n PRO 14 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 1iy5 n PRO 14 Cb 0.60 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 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 -0.39 0.00 -2.41 0.55 0.00 -1.26 -5.17 120.51 111.84 1iy5 n ALA 15 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1iy5 n ALA 15 Cb 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.40 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 -2.76 2.67 -0.74 0.00 -4.23 -1.26 -4.95 115.64 104.37 1iy5 s THR 17 Ca 0.07 0.22 0.12 0.00 -1.18 0.00 0.00 61.69 60.92 1iy5 s THR 17 Cb -0.01 -3.16 0.60 0.00 1.34 0.00 0.00 72.50 71.28 1iy5 s THR 17 CO -0.01 -0.28 1.44 0.23 -0.54 0.00 0.00 174.62 175.46 1iy5 n MET 18 N -3.27 3.64 -2.33 3.99 2.81 -1.26 -4.94 117.12 115.77 1iy5 n MET 18 Ca 0.07 -2.33 -0.40 0.00 -1.81 0.00 0.00 57.70 53.24 1iy5 n MET 18 Cb 0.59 -1.96 -0.03 0.00 -0.71 0.00 0.00 33.22 31.11 1iy5 n MET 18 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1iy5 s GLU 19 N -2.12 4.39 -0.35 0.03 2.12 -1.26 -4.98 118.70 116.53 1iy5 s GLU 19 Ca 0.41 1.92 -0.21 0.00 0.36 0.00 0.00 54.97 57.44 1iy5 s GLU 19 Cb 0.29 -2.99 0.00 0.00 0.26 0.00 0.00 34.13 31.69 1iy5 s GLU 19 CO 0.15 -0.05 0.68 -0.47 -0.54 0.00 0.00 175.26 175.02 1iy5 s TYR 20 N -1.24 3.15 -0.29 5.30 6.14 -1.26 -4.74 117.35 124.41 1iy5 s TYR 20 Ca 0.50 0.43 -0.00 0.00 0.64 0.00 0.00 57.07 58.64 1iy5 s TYR 20 Cb -0.33 -3.19 0.14 0.00 0.42 0.00 0.00 41.96 38.99 1iy5 s TYR 20 CO 0.43 -0.64 0.30 1.03 0.64 0.00 0.00 175.55 177.32 1iy5 s ARG 21 N 2.80 0.34 -0.58 4.97 1.81 -0.76 -5.01 118.95 122.51 1iy5 s ARG 21 Ca 0.26 -0.16 -0.28 0.00 -1.72 0.00 0.00 55.73 53.84 1iy5 s ARG 21 Cb -0.14 -0.64 0.01 0.00 -0.45 0.00 0.00 34.95 33.73 1iy5 s ARG 21 CO 0.15 -1.04 1.42 -1.25 -0.68 0.00 0.00 175.30 173.90 1iy5 s PRO 22 N 2.34 3.25 -0.22 3.54 0.04 -1.26 -1.35 135.00 141.34 1iy5 s PRO 22 Ca 0.10 0.38 -0.03 0.00 0.04 0.00 0.00 61.00 61.49 1iy5 s PRO 22 Cb -0.14 -4.14 -0.00 0.00 0.04 0.00 0.00 34.50 30.25 1iy5 s PRO 22 CO -0.32 -2.00 -0.06 -0.51 0.04 0.00 0.00 177.00 174.15 1iy5 s LEU 23 N 6.18 2.84 -0.79 -3.56 1.43 -1.16 0.16 118.68 123.79 1iy5 s LEU 23 Ca 0.51 -0.45 -0.21 0.00 -1.03 0.00 0.00 54.13 52.96 1iy5 s LEU 23 Cb -0.10 -1.71 0.10 0.00 0.03 0.00 0.00 46.19 44.51 1iy5 s LEU 23 CO 0.24 -0.03 1.04 0.00 0.23 0.00 0.00 176.35 177.83 1iy5 n GLY 25 N 5.45 -0.67 0.21 0.00 0.00 0.53 0.34 105.19 111.06 1iy5 n GLY 25 Ca 0.10 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.05 0.00 0.00 1.61 0.87 -1.34 0.14 113.55 114.78 1iy5 h SER 26 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1iy5 h SER 26 Cb 1.35 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1iy5 h SER 26 CO 0.47 0.00 0.00 -0.90 -0.53 0.00 0.00 176.83 175.87 1iy5 n ASP 27 N -2.27 0.59 -3.11 6.23 5.75 -1.26 -4.82 116.55 117.67 1iy5 n ASP 27 Ca -0.01 -1.96 -0.20 0.00 -0.01 0.00 0.00 54.79 52.61 1iy5 n ASP 27 Cb 0.38 -0.30 0.07 0.00 -1.03 0.00 0.00 41.12 40.24 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 -0.19 -5.66 -4.12 -1.12 4.05 0.47 -5.00 115.26 103.69 1iy5 n ASN 28 Ca 0.00 -0.46 -0.22 0.00 0.45 0.00 0.00 54.58 54.36 1iy5 n ASN 28 Cb 0.15 -4.32 -0.15 0.00 1.23 0.00 0.00 39.78 36.69 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 -6.10 1.11 0.23 1.20 2.20 -1.18 -4.96 119.74 112.23 1iy5 s LYS 29 Ca 0.49 -0.55 -0.20 0.00 -0.36 0.00 0.00 55.97 55.34 1iy5 s LYS 29 Cb -0.22 -1.08 -0.08 0.00 -1.51 0.00 0.00 37.83 34.94 1iy5 s LYS 29 CO 0.61 0.29 0.74 0.99 -0.36 0.00 0.00 175.35 177.63 1iy5 s THR 30 N -0.42 4.53 0.31 3.43 2.01 -1.26 -0.34 115.64 123.90 1iy5 s THR 30 Ca 0.05 1.35 0.10 0.00 0.31 0.00 0.00 61.69 63.50 1iy5 s THR 30 Cb -0.06 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.51 1iy5 s THR 30 CO -0.00 0.22 -0.07 -0.31 -0.69 0.00 0.00 174.62 173.77 1iy5 s TYR 31 N -1.51 2.47 -0.08 4.92 2.02 0.15 -4.89 117.35 120.44 1iy5 s TYR 31 Ca 0.43 -0.38 0.13 0.00 -0.37 0.00 0.00 57.07 56.89 1iy5 s TYR 31 Cb -0.17 -1.27 0.04 0.00 -0.40 0.00 0.00 41.96 40.16 1iy5 s TYR 31 CO 0.21 0.59 1.43 0.78 -1.57 0.00 0.00 175.55 176.99 1iy5 h GLY 32 N 1.99 0.00 0.00 0.71 0.00 -1.87 -3.06 103.07 100.84 1iy5 h GLY 32 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1iy5 h GLY 32 CO 0.64 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.34 1iy5 n ASN 33 N -3.27 0.00 0.29 0.19 0.23 -0.46 -1.84 115.26 110.41 1iy5 n ASN 33 Ca 0.01 0.00 0.19 0.00 -0.53 0.00 0.00 54.58 54.25 1iy5 n ASN 33 Cb 0.77 0.00 0.86 0.00 -2.08 0.00 0.00 39.78 39.33 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 0.00 -0.09 -3.83 3.64 -1.93 -2.21 116.57 112.16 1iy5 h LYS 34 Ca 0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 1iy5 h LYS 34 Cb 0.00 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1iy5 h LYS 34 CO 0.00 0.00 -0.63 0.00 -2.27 0.00 0.00 179.45 176.55 1iy5 h ASN 36 N 0.20 0.00 0.22 0.00 -0.73 -1.87 -2.48 115.58 110.92 1iy5 h ASN 36 Ca -0.05 0.00 -0.33 0.00 1.87 0.00 0.00 56.30 57.79 1iy5 h ASN 36 Cb 1.28 0.00 0.03 0.00 0.27 0.00 0.00 38.32 39.90 1iy5 h ASN 36 CO 0.13 0.00 -1.51 0.15 -0.37 0.00 0.00 177.43 175.83 1iy5 h PHE 37 N 0.00 0.85 -0.06 0.67 3.57 -1.24 -1.82 116.94 118.91 1iy5 h PHE 37 Ca 0.00 -0.62 -0.20 0.00 3.53 0.00 0.00 57.97 60.68 1iy5 h PHE 37 Cb 0.67 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 1iy5 h PHE 37 CO 0.00 1.58 -0.80 0.00 -2.23 0.00 0.00 178.31 176.86 1iy5 h ASN 39 N 0.27 0.52 0.06 0.00 2.35 -1.56 -1.68 115.58 115.54 1iy5 h ASN 39 Ca -0.05 -0.76 -0.00 0.00 -0.55 0.00 0.00 56.30 54.94 1iy5 h ASN 39 Cb 1.40 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 39.61 1iy5 h ASN 39 CO 0.14 1.21 -0.00 0.00 -1.65 0.00 0.00 177.43 177.13 1iy5 h ALA 40 N 0.32 1.08 0.06 -0.83 0.00 -1.37 0.86 119.26 119.39 1iy5 h ALA 40 Ca -0.07 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.56 1iy5 h ALA 40 Cb 1.30 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1iy5 h ALA 40 CO 0.12 0.00 -1.36 0.28 0.00 0.00 0.00 179.25 178.29 1iy5 h VAL 41 N 0.00 1.32 0.00 0.00 2.07 -1.11 -2.54 116.25 115.99 1iy5 h VAL 41 Ca -0.00 -3.01 -0.10 0.00 0.82 0.00 0.00 66.70 64.41 1iy5 h VAL 41 Cb 0.03 2.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 1iy5 h VAL 41 CO 0.00 0.82 -0.50 0.58 0.02 0.00 0.00 177.57 178.49 1iy5 h VAL 42 N 0.04 1.01 0.22 2.57 2.07 0.07 -2.34 116.25 119.89 1iy5 h VAL 42 Ca -0.16 -1.97 -0.33 0.00 0.82 0.00 0.00 66.70 65.05 1iy5 h VAL 42 Cb 1.93 2.19 0.02 0.00 -1.52 0.00 0.00 31.29 33.92 1iy5 h VAL 42 CO 0.14 0.49 -1.55 -0.33 0.02 0.00 0.00 177.57 176.34 1iy5 h GLU 43 N 0.00 0.46 0.00 1.57 5.08 -1.29 -3.23 114.58 117.17 1iy5 h GLU 43 Ca -0.00 -0.79 0.00 0.00 -1.00 0.00 0.00 59.36 57.57 1iy5 h GLU 43 Cb 1.15 0.29 0.00 0.00 0.50 0.00 0.00 28.75 30.69 1iy5 h GLU 43 CO 0.06 1.38 0.00 0.45 -1.00 0.00 0.00 179.01 179.90 1iy5 n SER 44 N -3.70 0.00 -2.12 1.42 2.88 -0.96 -4.87 113.62 106.27 1iy5 n SER 44 Ca -0.20 0.48 -0.18 0.00 -1.33 0.00 0.00 58.87 57.64 1iy5 n SER 44 Cb 1.07 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 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 -1.49 -5.17 0.00 -3.46 4.13 -0.91 -1.63 115.26 106.73 1iy5 n ASN 45 Ca 0.05 -0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.24 1iy5 n ASN 45 Cb 0.23 -4.20 0.00 0.00 -1.54 0.00 0.00 39.78 34.27 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 -1.11 0.47 0.03 7.41 0.00 -1.06 -4.90 105.19 106.03 1iy5 n GLY 46 Ca -0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.00 0.00 -4.00 2.61 -2.24 -0.65 -4.49 114.28 103.52 1iy5 n THR 47 Ca 0.00 -0.01 -0.31 0.00 -2.27 0.00 0.00 64.05 61.45 1iy5 n THR 47 Cb 0.00 -0.42 -0.15 0.00 -2.10 0.00 0.00 70.33 67.67 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 -2.37 4.78 0.00 3.22 0.20 -1.26 -4.90 118.68 118.34 1iy5 s LEU 48 Ca 0.35 -2.21 0.00 0.00 0.69 0.00 0.00 54.13 52.96 1iy5 s LEU 48 Cb 0.21 -1.65 0.00 0.00 -0.43 0.00 0.00 46.19 44.32 1iy5 s LEU 48 CO 0.43 -0.38 0.00 0.35 -0.29 0.00 0.00 176.35 176.46 1iy5 n THR 49 N 4.19 0.00 -4.19 3.68 -2.24 -1.26 -4.61 114.28 109.85 1iy5 n THR 49 Ca 0.04 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.52 1iy5 n THR 49 Cb 0.41 -0.29 -0.09 0.00 -2.10 0.00 0.00 70.33 68.26 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 3.19 -0.09 3.22 0.20 -1.26 -1.56 118.68 122.38 1iy5 s LEU 50 Ca 0.00 -0.32 0.01 0.00 0.69 0.00 0.00 54.13 54.52 1iy5 s LEU 50 Cb 0.00 -1.96 -0.06 0.00 -0.43 0.00 0.00 46.19 43.74 1iy5 s LEU 50 CO 0.00 0.18 -0.06 -0.24 -0.29 0.00 0.00 176.35 175.93 1iy5 n SER 51 N 0.65 3.29 0.00 3.68 2.88 0.15 -3.57 113.62 120.71 1iy5 n SER 51 Ca -0.12 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1iy5 n SER 51 Cb 0.52 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1iy5 n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iy5 n HIS 52 N -2.69 0.00 -1.51 0.66 1.44 -1.09 -4.93 115.22 107.10 1iy5 n HIS 52 Ca -0.15 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.28 1iy5 n HIS 52 Cb 0.68 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.61 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 3.72 -1.26 -3.10 117.46 115.81 1iy5 n PHE 53 Ca 0.00 0.13 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 1iy5 n PHE 53 Cb 0.00 -1.46 0.00 0.00 -0.94 0.00 0.00 39.48 37.08 1iy5 n PHE 53 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iy5 n GLY 54 N 5.99 3.90 3.75 1.37 0.00 0.43 -4.90 105.19 115.73 1iy5 n GLY 54 Ca 0.63 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.66 2.58 0.00 1.61 -2.85 -1.12 -1.49 119.74 115.81 1iy5 s LYS 55 Ca 0.00 1.57 0.26 0.00 -1.00 0.00 0.00 55.97 56.80 1iy5 s LYS 55 Cb 0.00 -1.91 0.61 0.00 -2.06 0.00 0.00 37.83 34.48 1iy5 s LYS 55 CO 0.00 -1.45 1.50 0.00 0.10 0.00 0.00 175.35 175.50