#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy5 s VAL 4 N 0.00 -0.43 -0.01 0.00 0.11 -1.26 -5.00 120.40 113.81 1iy5 s VAL 4 Ca 0.00 -0.08 0.20 0.00 -2.93 0.00 0.00 61.98 59.17 1iy5 s VAL 4 Cb 0.00 -0.72 0.34 0.00 -1.53 0.00 0.00 36.38 34.47 1iy5 s VAL 4 CO 0.00 -0.16 1.14 -1.54 -3.33 0.00 0.00 175.10 171.20 1iy5 n SER 5 N 5.34 0.81 -1.27 3.54 3.41 -1.26 -4.41 113.62 119.77 1iy5 n SER 5 Ca -0.05 -2.05 0.15 0.00 -0.26 0.00 0.00 58.87 56.66 1iy5 n SER 5 Cb 0.50 -0.28 -0.07 0.00 -0.26 0.00 0.00 64.21 64.10 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 0.35 -0.41 -2.13 -3.33 0.31 -1.26 -4.38 118.33 107.48 1iy5 n VAL 6 Ca 0.05 0.60 -0.41 0.00 -0.01 0.00 0.00 64.34 64.57 1iy5 n VAL 6 Cb 1.04 -0.99 -0.03 0.00 -0.91 0.00 0.00 33.84 32.95 1iy5 n VAL 6 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1iy5 s ASP 7 N -6.63 5.77 -0.89 4.52 -1.08 -1.26 -4.87 116.67 112.23 1iy5 s ASP 7 Ca 0.00 0.70 -0.01 0.00 -0.52 0.00 0.00 52.55 52.72 1iy5 s ASP 7 Cb 0.00 -2.53 0.34 0.00 -1.46 0.00 0.00 42.92 39.27 1iy5 s ASP 7 CO 0.00 -1.92 1.83 0.00 0.52 0.00 0.00 175.17 175.60 1iy5 n SER 9 N -0.31 0.75 0.00 0.00 7.64 -1.26 -3.76 113.62 116.68 1iy5 n SER 9 Ca 0.49 0.35 0.10 0.00 1.01 0.00 0.00 58.87 60.81 1iy5 n SER 9 Cb 0.28 0.15 0.50 0.00 -1.01 0.00 0.00 64.21 64.13 1iy5 n SER 9 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1iy5 n GLU 10 N -2.96 0.31 -3.13 1.43 4.07 -1.26 -4.77 120.64 114.33 1iy5 n GLU 10 Ca -0.17 0.09 -0.25 0.00 -0.06 0.00 0.00 57.16 56.77 1iy5 n GLU 10 Cb 1.01 -1.50 -0.01 0.00 -0.06 0.00 0.00 31.44 30.89 1iy5 n GLU 10 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 1iy5 s TYR 11 N -2.53 3.49 0.69 4.31 1.51 -1.25 -4.28 117.35 119.30 1iy5 s TYR 11 Ca 0.20 0.47 -0.11 0.00 -1.01 0.00 0.00 57.07 56.61 1iy5 s TYR 11 Cb 0.13 -2.06 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 1iy5 s TYR 11 CO 0.30 -0.05 1.06 -1.25 -1.11 0.00 0.00 175.55 174.50 1iy5 s PRO 12 N -4.46 2.93 0.20 -1.71 0.04 -1.26 -5.10 135.00 125.62 1iy5 s PRO 12 Ca 0.43 1.01 0.01 0.00 0.04 0.00 0.00 61.00 62.48 1iy5 s PRO 12 Cb -0.10 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1iy5 s PRO 12 CO 0.39 -1.11 0.36 0.15 0.04 0.00 0.00 177.00 176.83 1iy5 s LYS 13 N -4.91 3.49 0.00 4.56 1.02 -1.26 -4.97 119.74 117.66 1iy5 s LYS 13 Ca 0.59 -0.46 0.30 0.00 0.02 0.00 0.00 55.97 56.42 1iy5 s LYS 13 Cb -0.15 -2.87 1.78 0.00 -0.52 0.00 0.00 37.83 36.07 1iy5 s LYS 13 CO 0.53 0.42 2.12 -0.35 -0.92 0.00 0.00 175.35 177.15 1iy5 n PRO 14 N -0.76 0.95 0.00 -1.68 -0.04 -1.26 -4.85 135.00 127.35 1iy5 n PRO 14 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1iy5 n PRO 14 Cb 0.54 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.99 0.00 -2.77 0.55 0.00 -1.26 -5.16 120.51 110.87 1iy5 n ALA 15 Ca 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.40 1iy5 n ALA 15 Cb 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.52 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 -1.90 2.05 -1.95 0.00 -4.23 -1.26 -4.95 115.64 103.39 1iy5 s THR 17 Ca 0.38 -0.53 0.03 0.00 -1.18 0.00 0.00 61.69 60.40 1iy5 s THR 17 Cb -0.11 -2.52 0.10 0.00 1.34 0.00 0.00 72.50 71.31 1iy5 s THR 17 CO 0.29 0.00 1.07 0.23 -0.54 0.00 0.00 174.62 175.67 1iy5 n MET 18 N -3.00 1.27 -1.61 3.99 2.81 -1.26 -4.90 117.12 114.43 1iy5 n MET 18 Ca 0.16 -0.40 -0.59 0.00 -1.81 0.00 0.00 57.70 55.06 1iy5 n MET 18 Cb 0.61 -1.11 -0.08 0.00 -0.71 0.00 0.00 33.22 31.93 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 -0.16 0.50 -1.56 0.03 4.07 -1.26 -4.80 120.64 117.45 1iy5 n GLU 19 Ca 0.04 0.18 -0.34 0.00 -0.06 0.00 0.00 57.16 56.98 1iy5 n GLU 19 Cb 0.11 -1.75 0.04 0.00 -0.06 0.00 0.00 31.44 29.78 1iy5 n GLU 19 CO 0.00 0.00 0.00 0.98 -0.06 0.00 0.00 177.13 178.05 1iy5 n TYR 20 N 2.88 2.73 -2.89 4.31 4.19 -1.26 -4.43 117.16 122.69 1iy5 n TYR 20 Ca 0.23 -2.47 -0.42 0.00 3.31 0.00 0.00 57.90 58.54 1iy5 n TYR 20 Cb 0.09 -1.28 -0.05 0.00 0.49 0.00 0.00 39.34 38.59 1iy5 n TYR 20 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 1iy5 s ARG 21 N -3.44 3.72 -0.27 2.98 1.81 0.10 -4.92 118.95 118.93 1iy5 s ARG 21 Ca 0.55 0.34 -0.28 0.00 -1.72 0.00 0.00 55.73 54.62 1iy5 s ARG 21 Cb 0.44 -3.83 0.01 0.00 -0.45 0.00 0.00 34.95 31.11 1iy5 s ARG 21 CO -0.22 -0.96 1.03 -1.25 -0.68 0.00 0.00 175.30 173.23 1iy5 s PRO 22 N 3.33 4.16 -0.17 3.54 0.04 -1.26 -0.08 135.00 144.58 1iy5 s PRO 22 Ca 0.34 1.18 0.01 0.00 0.04 0.00 0.00 61.00 62.57 1iy5 s PRO 22 Cb -0.12 -3.69 0.01 0.00 0.04 0.00 0.00 34.50 30.74 1iy5 s PRO 22 CO 0.19 -0.74 -0.18 -0.51 0.04 0.00 0.00 177.00 175.80 1iy5 s LEU 23 N 3.36 2.29 -0.77 -3.56 1.43 -1.10 0.15 118.68 120.49 1iy5 s LEU 23 Ca 0.44 -0.56 -0.21 0.00 -1.03 0.00 0.00 54.13 52.76 1iy5 s LEU 23 Cb -0.14 -1.52 0.09 0.00 0.03 0.00 0.00 46.19 44.66 1iy5 s LEU 23 CO 0.10 0.04 1.02 0.00 0.23 0.00 0.00 176.35 177.75 1iy5 n GLY 25 N 5.43 0.08 0.05 0.00 0.00 0.37 -0.25 105.19 110.87 1iy5 n GLY 25 Ca 0.07 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.64 0.16 -0.79 1.61 2.88 -0.67 -0.95 113.62 114.22 1iy5 n SER 26 Ca 0.15 0.55 0.02 0.00 -1.33 0.00 0.00 58.87 58.26 1iy5 n SER 26 Cb 0.48 -0.56 0.11 0.00 -0.75 0.00 0.00 64.21 63.49 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 -1.69 2.10 -2.54 -3.46 5.75 -1.26 -4.84 116.55 110.60 1iy5 n ASP 27 Ca -0.00 -2.21 -0.17 0.00 -0.01 0.00 0.00 54.79 52.40 1iy5 n ASP 27 Cb 0.04 -0.45 0.05 0.00 -1.03 0.00 0.00 41.12 39.73 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 0.17 -5.06 -4.40 -1.12 5.15 -0.12 -5.01 115.26 104.87 1iy5 n ASN 28 Ca 0.08 -0.32 -0.21 0.00 -0.60 0.00 0.00 54.58 53.54 1iy5 n ASN 28 Cb 0.44 -3.76 -0.10 0.00 -0.53 0.00 0.00 39.78 35.84 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 -5.72 1.48 0.04 1.20 2.36 -1.18 -4.96 119.74 112.96 1iy5 s LYS 29 Ca 0.34 -1.67 0.02 0.00 -2.55 0.00 0.00 55.97 52.11 1iy5 s LYS 29 Cb -0.15 -1.37 -0.04 0.00 -1.05 0.00 0.00 37.83 35.22 1iy5 s LYS 29 CO 0.42 0.23 0.04 0.99 1.55 0.00 0.00 175.35 178.58 1iy5 s THR 30 N -2.80 4.36 0.29 3.43 2.01 -1.26 -0.48 115.64 121.19 1iy5 s THR 30 Ca 0.26 -0.67 0.07 0.00 0.31 0.00 0.00 61.69 61.66 1iy5 s THR 30 Cb -0.02 -3.02 -0.06 0.00 0.01 0.00 0.00 72.50 69.41 1iy5 s THR 30 CO 0.10 0.26 -0.06 -0.31 -0.69 0.00 0.00 174.62 173.92 1iy5 s TYR 31 N -1.23 2.03 -0.20 4.92 2.02 0.49 -4.90 117.35 120.49 1iy5 s TYR 31 Ca 0.24 -0.66 0.20 0.00 -0.37 0.00 0.00 57.07 56.47 1iy5 s TYR 31 Cb -0.12 -1.16 -0.02 0.00 -0.40 0.00 0.00 41.96 40.26 1iy5 s TYR 31 CO 0.16 0.33 1.05 0.78 -1.57 0.00 0.00 175.55 176.30 1iy5 h GLY 32 N 2.23 0.00 0.00 0.71 0.00 -1.88 -2.93 103.07 101.20 1iy5 h GLY 32 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1iy5 h GLY 32 CO 0.68 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.38 1iy5 n ASN 33 N -2.85 0.00 0.00 0.19 0.23 0.89 0.01 115.26 113.74 1iy5 n ASN 33 Ca -0.03 0.00 0.02 0.00 -0.53 0.00 0.00 54.58 54.04 1iy5 n ASN 33 Cb 0.67 0.00 0.10 0.00 -2.08 0.00 0.00 39.78 38.47 1iy5 n ASN 33 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 1iy5 n LYS 34 N -0.11 0.00 0.07 -3.83 2.85 -1.26 -1.14 118.16 114.73 1iy5 n LYS 34 Ca 0.00 0.41 -0.13 0.00 -1.05 0.00 0.00 58.31 57.55 1iy5 n LYS 34 Cb 0.00 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 32.84 1iy5 n LYS 34 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1iy5 n ASN 36 N -3.73 0.60 -0.06 0.00 2.85 -0.29 -2.80 115.26 111.84 1iy5 n ASN 36 Ca -0.06 0.19 -0.20 0.00 -0.11 0.00 0.00 54.58 54.39 1iy5 n ASN 36 Cb 0.83 -0.09 -0.13 0.00 1.24 0.00 0.00 39.78 41.63 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 0.17 -0.07 1.20 3.57 -1.31 -2.26 116.94 118.24 1iy5 h PHE 37 Ca 0.00 -0.12 -0.12 0.00 3.53 0.00 0.00 57.97 61.26 1iy5 h PHE 37 Cb 0.67 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 1iy5 h PHE 37 CO 0.00 1.46 -0.49 0.00 -2.23 0.00 0.00 178.31 177.04 1iy5 h ASN 39 N 0.15 0.21 0.00 0.00 4.21 -1.67 -0.66 115.58 117.82 1iy5 h ASN 39 Ca 0.01 -0.81 0.00 0.00 1.21 0.00 0.00 56.30 56.70 1iy5 h ASN 39 Cb 0.93 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 38.06 1iy5 h ASN 39 CO 0.07 1.00 0.00 0.00 -1.29 0.00 0.00 177.43 177.21 1iy5 h ALA 40 N 0.22 1.00 0.08 -0.83 0.00 -1.36 0.15 119.26 118.51 1iy5 h ALA 40 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 1iy5 h ALA 40 Cb 1.04 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1iy5 h ALA 40 CO 0.05 -0.00 -1.62 0.28 0.00 0.00 0.00 179.25 177.95 1iy5 h VAL 41 N 0.00 1.01 0.00 0.00 2.07 -1.00 -2.69 116.25 115.65 1iy5 h VAL 41 Ca 0.00 -2.73 0.00 0.00 0.82 0.00 0.00 66.70 64.79 1iy5 h VAL 41 Cb 0.01 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 1iy5 h VAL 41 CO 0.00 0.75 0.00 0.58 0.02 0.00 0.00 177.57 178.92 1iy5 h VAL 42 N 0.04 0.00 0.10 2.57 2.07 0.77 -2.45 116.25 119.36 1iy5 h VAL 42 Ca -0.27 -0.62 -0.36 0.00 0.82 0.00 0.00 66.70 66.27 1iy5 h VAL 42 Cb 2.00 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 33.36 1iy5 h VAL 42 CO 0.12 0.00 -2.03 -1.84 0.02 0.00 0.00 177.57 173.84 1iy5 n GLU 43 N -2.49 0.74 0.00 1.57 0.28 0.05 -3.89 120.64 116.90 1iy5 n GLU 43 Ca 0.05 0.26 0.11 0.00 -0.16 0.00 0.00 57.16 57.42 1iy5 n GLU 43 Cb 0.46 -1.69 0.50 0.00 1.43 0.00 0.00 31.44 32.14 1iy5 n GLU 43 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1iy5 n SER 44 N -3.51 0.00 -0.46 -1.84 7.64 -1.01 -4.85 113.62 109.58 1iy5 n SER 44 Ca -0.34 0.37 -0.06 0.00 1.01 0.00 0.00 58.87 59.85 1iy5 n SER 44 Cb 1.02 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 63.75 1iy5 n SER 44 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1iy5 n ASN 45 N -1.45 -4.22 0.00 6.43 5.15 -1.01 -2.84 115.26 117.32 1iy5 n ASN 45 Ca 0.07 0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 1iy5 n ASN 45 Cb 0.24 -2.25 0.00 0.00 -0.53 0.00 0.00 39.78 37.24 1iy5 n ASN 45 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1iy5 n GLY 46 N -1.60 1.10 0.46 8.20 0.00 -0.96 -4.97 105.19 107.42 1iy5 n GLY 46 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.73 0.34 -4.88 2.61 -2.24 -1.13 -4.75 114.28 103.50 1iy5 n THR 47 Ca 0.00 -0.24 -0.28 0.00 -2.27 0.00 0.00 64.05 61.26 1iy5 n THR 47 Cb 0.00 -0.08 -0.17 0.00 -2.10 0.00 0.00 70.33 67.99 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 -0.87 1.87 0.00 3.22 2.96 -1.26 -4.99 118.68 119.62 1iy5 s LEU 48 Ca 0.11 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.62 1iy5 s LEU 48 Cb 0.07 -1.07 0.00 0.00 0.50 0.00 0.00 46.19 45.69 1iy5 s LEU 48 CO 0.06 0.11 0.00 0.35 -1.32 0.00 0.00 176.35 175.55 1iy5 n THR 49 N 3.51 0.00 -4.53 3.68 -2.24 -1.26 -4.90 114.28 108.54 1iy5 n THR 49 Ca -0.20 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.31 1iy5 n THR 49 Cb 0.52 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.62 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 2.24 -0.06 3.22 2.96 -1.26 -1.67 118.68 124.11 1iy5 s LEU 50 Ca 0.00 -0.63 0.02 0.00 -0.22 0.00 0.00 54.13 53.30 1iy5 s LEU 50 Cb 0.00 -1.05 -0.05 0.00 0.50 0.00 0.00 46.19 45.60 1iy5 s LEU 50 CO 0.00 0.15 -0.03 -0.24 -1.32 0.00 0.00 176.35 174.91 1iy5 n SER 51 N 1.41 3.62 0.00 3.68 2.88 0.65 -4.05 113.62 121.82 1iy5 n SER 51 Ca -0.18 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.34 1iy5 n SER 51 Cb 0.53 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 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 -2.52 0.00 -1.51 0.66 1.44 -1.16 -5.00 115.22 107.12 1iy5 n HIS 52 Ca -0.10 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.36 1iy5 n HIS 52 Cb 0.63 0.00 -0.18 0.00 0.12 0.00 0.00 29.99 30.55 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 0.34 0.00 -1.40 3.01 -1.26 -2.97 117.46 115.18 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 -1.27 0.00 0.00 -0.01 0.00 0.00 39.48 38.20 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 5.91 -0.36 3.79 1.37 0.00 0.41 -4.87 105.19 111.43 1iy5 n GLY 54 Ca 0.63 -1.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 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 4.20 0.00 1.61 2.20 -1.21 0.10 119.74 124.65 1iy5 s LYS 55 Ca 0.00 0.62 0.27 0.00 -0.36 0.00 0.00 55.97 56.50 1iy5 s LYS 55 Cb 0.00 -3.30 0.87 0.00 -1.51 0.00 0.00 37.83 33.89 1iy5 s LYS 55 CO 0.00 0.49 1.65 0.00 -0.36 0.00 0.00 175.35 177.12