#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy6 n VAL 4 N 0.00 0.87 -3.35 0.00 0.24 -1.26 -4.93 118.33 109.90 1iy6 n VAL 4 Ca 0.00 -4.66 -0.45 0.00 -2.04 0.00 0.00 64.34 57.19 1iy6 n VAL 4 Cb 0.00 -1.89 -0.05 0.00 -1.47 0.00 0.00 33.84 30.43 1iy6 n VAL 4 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1iy6 s SER 5 N -1.94 6.19 -0.05 -1.34 1.04 -1.26 -5.02 113.70 111.31 1iy6 s SER 5 Ca 0.38 -1.93 -0.05 0.00 0.48 0.00 0.00 55.95 54.83 1iy6 s SER 5 Cb 0.18 -2.18 0.01 0.00 0.10 0.00 0.00 66.02 64.13 1iy6 s SER 5 CO -0.07 -0.80 0.14 0.54 0.98 0.00 0.00 173.24 174.04 1iy6 s VAL 6 N 1.36 0.01 -0.09 5.02 0.11 -1.26 -5.15 120.40 120.41 1iy6 s VAL 6 Ca 0.05 -0.06 -0.04 0.00 -2.93 0.00 0.00 61.98 59.01 1iy6 s VAL 6 Cb -0.27 -0.23 0.05 0.00 -1.53 0.00 0.00 36.38 34.40 1iy6 s VAL 6 CO 0.01 -0.03 0.18 1.51 -3.33 0.00 0.00 175.10 173.43 1iy6 s ASP 7 N -0.05 0.25 -0.22 3.54 1.47 -1.26 -5.02 116.67 115.38 1iy6 s ASP 7 Ca -0.01 0.38 0.17 0.00 1.18 0.00 0.00 52.55 54.26 1iy6 s ASP 7 Cb -0.02 0.31 0.47 0.00 -0.34 0.00 0.00 42.92 43.34 1iy6 s ASP 7 CO 0.00 -0.20 1.16 0.00 0.68 0.00 0.00 175.17 176.82 1iy6 n SER 9 N -0.53 -0.14 -2.76 0.00 2.88 -1.26 -1.63 113.62 110.18 1iy6 n SER 9 Ca 0.21 -0.99 -0.06 0.00 -1.33 0.00 0.00 58.87 56.70 1iy6 n SER 9 Cb 0.90 -1.01 0.03 0.00 -0.75 0.00 0.00 64.21 63.38 1iy6 n SER 9 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1iy6 n GLU 10 N 6.83 -1.35 -3.10 -1.46 1.02 -1.26 -5.00 120.64 116.33 1iy6 n GLU 10 Ca 0.57 0.97 -0.19 0.00 -0.02 0.00 0.00 57.16 58.49 1iy6 n GLU 10 Cb 0.27 -4.77 -0.03 0.00 -0.02 0.00 0.00 31.44 26.89 1iy6 n GLU 10 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1iy6 n TYR 11 N -2.18 -0.79 -2.50 -0.32 9.36 -0.64 -5.10 117.16 114.98 1iy6 n TYR 11 Ca -0.03 -3.29 -0.42 0.00 3.32 0.00 0.00 57.90 57.48 1iy6 n TYR 11 Cb 0.54 0.04 -0.03 0.00 -0.63 0.00 0.00 39.34 39.27 1iy6 n TYR 11 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1iy6 s PRO 12 N -1.21 4.39 -0.31 2.98 0.04 -1.26 -4.54 135.00 135.09 1iy6 s PRO 12 Ca 0.35 1.63 -0.05 0.00 0.04 0.00 0.00 61.00 62.97 1iy6 s PRO 12 Cb 0.24 -3.51 0.19 0.00 0.04 0.00 0.00 34.50 31.46 1iy6 s PRO 12 CO -0.11 -0.37 0.90 0.15 0.04 0.00 0.00 177.00 177.61 1iy6 s LYS 13 N 1.91 0.30 -0.56 4.56 1.02 -1.26 -5.04 119.74 120.68 1iy6 s LYS 13 Ca 0.55 0.20 0.02 0.00 0.02 0.00 0.00 55.97 56.76 1iy6 s LYS 13 Cb -0.24 0.11 0.42 0.00 -0.52 0.00 0.00 37.83 37.60 1iy6 s LYS 13 CO 0.23 -0.53 1.58 0.00 -0.92 0.00 0.00 175.35 175.71 1iy6 n ALA 15 N -0.66 1.88 -2.40 0.00 0.00 -1.26 -5.06 120.51 113.02 1iy6 n ALA 15 Ca 0.50 -2.72 -0.29 0.00 0.00 0.00 0.00 53.44 50.94 1iy6 n ALA 15 Cb 0.64 -0.98 -0.13 0.00 0.00 0.00 0.00 19.45 18.98 1iy6 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iy6 n THR 17 N 0.80 0.00 -0.05 0.00 5.66 -1.26 -4.91 114.28 114.51 1iy6 n THR 17 Ca -0.17 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.75 1iy6 n THR 17 Cb 0.53 0.31 -0.03 0.00 -1.55 0.00 0.00 70.33 69.60 1iy6 n THR 17 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1iy6 n MET 18 N 0.00 0.38 -1.87 1.09 2.81 -1.26 -4.98 117.12 113.30 1iy6 n MET 18 Ca -0.17 0.15 -0.39 0.00 -1.81 0.00 0.00 57.70 55.48 1iy6 n MET 18 Cb 0.62 -1.17 0.02 0.00 -0.71 0.00 0.00 33.22 31.98 1iy6 n MET 18 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1iy6 s GLU 19 N -2.63 3.61 -0.29 0.03 2.56 -1.26 -4.98 118.70 115.74 1iy6 s GLU 19 Ca -0.21 2.29 -0.07 0.00 0.00 0.00 0.00 54.97 56.97 1iy6 s GLU 19 Cb 0.03 -2.56 0.01 0.00 2.00 0.00 0.00 34.13 33.61 1iy6 s GLU 19 CO 0.31 -0.83 0.08 -0.47 -0.56 0.00 0.00 175.26 173.79 1iy6 s TYR 20 N -1.26 3.14 -0.40 5.30 6.14 -1.26 -4.58 117.35 124.43 1iy6 s TYR 20 Ca 0.63 -0.92 0.03 0.00 0.64 0.00 0.00 57.07 57.45 1iy6 s TYR 20 Cb -0.41 -2.26 0.19 0.00 0.42 0.00 0.00 41.96 39.90 1iy6 s TYR 20 CO 0.51 -0.56 0.77 1.03 0.64 0.00 0.00 175.55 177.95 1iy6 s ARG 21 N 1.51 0.67 -0.87 4.97 0.52 -0.83 -4.98 118.95 119.95 1iy6 s ARG 21 Ca 0.03 -0.33 -0.25 0.00 -0.52 0.00 0.00 55.73 54.66 1iy6 s ARG 21 Cb -0.17 0.05 0.02 0.00 0.52 0.00 0.00 34.95 35.37 1iy6 s ARG 21 CO 0.03 -0.93 1.51 -1.25 0.02 0.00 0.00 175.30 174.68 1iy6 s PRO 22 N 1.67 3.20 -0.15 3.54 0.04 -1.25 -2.70 135.00 139.36 1iy6 s PRO 22 Ca 0.18 -0.52 -0.12 0.00 0.04 0.00 0.00 61.00 60.59 1iy6 s PRO 22 Cb -0.01 -4.82 -0.05 0.00 0.04 0.00 0.00 34.50 29.66 1iy6 s PRO 22 CO -0.09 -2.42 0.23 -0.51 0.04 0.00 0.00 177.00 174.25 1iy6 s LEU 23 N 6.44 4.28 -1.10 -3.56 1.43 -1.11 0.34 118.68 125.40 1iy6 s LEU 23 Ca 0.48 0.47 -0.16 0.00 -1.03 0.00 0.00 54.13 53.90 1iy6 s LEU 23 Cb -0.05 -2.27 0.15 0.00 0.03 0.00 0.00 46.19 44.06 1iy6 s LEU 23 CO 0.03 0.20 1.33 0.00 0.23 0.00 0.00 176.35 178.13 1iy6 n GLY 25 N 4.67 -2.15 0.27 0.00 0.00 0.14 -0.80 105.19 107.32 1iy6 n GLY 25 Ca 0.32 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1iy6 n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1iy6 h SER 26 N -0.18 0.00 -0.24 1.61 0.87 -1.43 0.25 113.55 114.44 1iy6 h SER 26 Ca -0.44 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.06 1iy6 h SER 26 Cb 1.38 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.31 1iy6 h SER 26 CO 0.42 0.00 0.07 -0.90 -0.53 0.00 0.00 176.83 175.89 1iy6 n ASP 27 N -2.53 2.81 -3.14 6.23 5.68 -1.26 -4.82 116.55 119.52 1iy6 n ASP 27 Ca -0.01 -2.39 -0.23 0.00 -0.50 0.00 0.00 54.79 51.66 1iy6 n ASP 27 Cb 0.42 -0.58 0.03 0.00 -1.14 0.00 0.00 41.12 39.85 1iy6 n ASP 27 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1iy6 n ASN 28 N 0.13 -5.66 -4.51 -1.12 2.85 0.88 -4.97 115.26 102.85 1iy6 n ASN 28 Ca 0.13 -0.33 -0.28 0.00 -0.11 0.00 0.00 54.58 53.99 1iy6 n ASN 28 Cb 0.68 -4.57 -0.11 0.00 1.24 0.00 0.00 39.78 37.02 1iy6 n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1iy6 s LYS 29 N -5.82 1.86 -0.28 1.20 2.20 -1.17 -4.92 119.74 112.82 1iy6 s LYS 29 Ca 0.35 -1.24 -0.02 0.00 -0.36 0.00 0.00 55.97 54.69 1iy6 s LYS 29 Cb -0.16 -2.11 0.04 0.00 -1.51 0.00 0.00 37.83 34.09 1iy6 s LYS 29 CO 0.43 0.46 -0.02 0.99 -0.36 0.00 0.00 175.35 176.84 1iy6 s THR 30 N -1.41 2.96 0.09 3.43 2.01 -1.26 0.25 115.64 121.71 1iy6 s THR 30 Ca 0.21 -1.25 -0.19 0.00 0.31 0.00 0.00 61.69 60.77 1iy6 s THR 30 Cb -0.10 -2.63 -0.07 0.00 0.01 0.00 0.00 72.50 69.72 1iy6 s THR 30 CO 0.12 0.00 0.58 -0.31 -0.69 0.00 0.00 174.62 174.32 1iy6 s TYR 31 N 1.28 3.78 0.51 4.92 2.02 -0.65 -4.87 117.35 124.34 1iy6 s TYR 31 Ca -0.03 1.27 0.22 0.00 -0.37 0.00 0.00 57.07 58.15 1iy6 s TYR 31 Cb -0.19 -2.50 1.41 0.00 -0.40 0.00 0.00 41.96 40.29 1iy6 s TYR 31 CO -0.02 0.56 2.13 0.78 -1.57 0.00 0.00 175.55 177.43 1iy6 h GLY 32 N 4.37 0.00 -2.19 0.71 0.00 -1.91 -2.94 103.07 101.11 1iy6 h GLY 32 Ca -0.49 0.00 0.19 0.00 0.00 0.00 0.00 47.33 47.03 1iy6 h GLY 32 CO 0.64 0.00 0.54 0.54 0.00 0.00 0.00 176.54 178.26 1iy6 s ASN 33 N -6.63 -0.12 0.11 0.19 2.20 -1.10 -1.96 114.94 107.64 1iy6 s ASN 33 Ca -0.04 -0.44 0.09 0.00 -0.94 0.00 0.00 52.86 51.52 1iy6 s ASN 33 Cb 0.15 0.46 0.45 0.00 -2.00 0.00 0.00 41.25 40.31 1iy6 s ASN 33 CO 0.62 -0.86 1.27 1.17 -2.94 0.00 0.00 177.10 176.36 1iy6 n LYS 34 N -0.53 0.05 0.08 3.55 0.00 -1.26 -0.95 118.16 119.10 1iy6 n LYS 34 Ca -0.06 0.52 -0.11 0.00 0.00 0.00 0.00 58.31 58.67 1iy6 n LYS 34 Cb 0.61 -1.66 -0.03 0.00 0.00 0.00 0.00 35.03 33.95 1iy6 n LYS 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1iy6 h ASN 36 N 0.15 0.00 -0.02 0.00 -0.73 -1.25 -2.72 115.58 111.02 1iy6 h ASN 36 Ca -0.06 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 57.89 1iy6 h ASN 36 Cb 1.55 0.00 0.02 0.00 0.27 0.00 0.00 38.32 40.16 1iy6 h ASN 36 CO 0.15 0.42 -0.85 0.15 -0.37 0.00 0.00 177.43 176.93 1iy6 h PHE 37 N 0.00 0.89 0.00 0.67 3.57 -1.31 -1.97 116.94 118.78 1iy6 h PHE 37 Ca -0.04 -0.47 -0.04 0.00 3.53 0.00 0.00 57.97 60.95 1iy6 h PHE 37 Cb 1.35 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 1iy6 h PHE 37 CO 0.00 1.30 -0.19 0.00 -2.23 0.00 0.00 178.31 177.19 1iy6 h ALA 40 N 0.33 1.33 -0.06 0.00 0.00 -1.23 -2.42 119.26 117.20 1iy6 h ALA 40 Ca -0.06 -0.35 -0.22 0.00 0.00 0.00 0.00 54.91 54.29 1iy6 h ALA 40 Cb 1.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1iy6 h ALA 40 CO 0.10 0.48 -0.85 0.28 0.00 0.00 0.00 179.25 179.26 1iy6 h VAL 41 N 0.00 1.34 -0.08 0.00 2.07 -1.20 -2.92 116.25 115.46 1iy6 h VAL 41 Ca -0.00 -2.20 -0.04 0.00 0.82 0.00 0.00 66.70 65.28 1iy6 h VAL 41 Cb 0.69 2.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1iy6 h VAL 41 CO 0.05 0.67 -0.13 0.58 0.02 0.00 0.00 177.57 178.76 1iy6 h VAL 42 N 0.35 1.14 -0.57 2.57 2.07 -0.77 0.89 116.25 121.92 1iy6 h VAL 42 Ca -0.06 -0.65 -0.10 0.00 0.82 0.00 0.00 66.70 66.71 1iy6 h VAL 42 Cb 1.46 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1iy6 h VAL 42 CO 0.16 0.20 -0.03 -0.33 0.02 0.00 0.00 177.57 177.58 1iy6 h GLU 43 N 0.12 1.02 -0.02 1.57 4.39 -1.26 -2.24 114.58 118.17 1iy6 h GLU 43 Ca 0.03 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1iy6 h GLU 43 Cb 0.31 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1iy6 h GLU 43 CO 0.02 1.02 -0.10 0.43 -1.16 0.00 0.00 179.01 179.21 1iy6 n SER 44 N -4.17 1.62 -0.24 1.42 7.64 -0.60 -4.91 113.62 114.38 1iy6 n SER 44 Ca 0.03 -1.41 -0.03 0.00 1.01 0.00 0.00 58.87 58.47 1iy6 n SER 44 Cb 0.36 0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.61 1iy6 n SER 44 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1iy6 n ASN 45 N 0.10 -4.46 0.00 6.43 2.85 0.28 -2.45 115.26 118.02 1iy6 n ASN 45 Ca 0.16 0.08 0.00 0.00 -0.11 0.00 0.00 54.58 54.71 1iy6 n ASN 45 Cb 0.39 -2.23 0.00 0.00 1.24 0.00 0.00 39.78 39.18 1iy6 n ASN 45 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1iy6 n GLY 46 N -1.17 1.23 0.16 8.20 0.00 0.14 -4.94 105.19 108.80 1iy6 n GLY 46 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 1iy6 n GLY 46 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1iy6 h THR 47 N 0.00 1.28 -3.87 2.61 2.02 -1.69 -3.45 112.91 109.81 1iy6 h THR 47 Ca 0.00 -2.61 -0.56 0.00 0.77 0.00 0.00 66.41 64.01 1iy6 h THR 47 Cb 0.00 2.92 0.17 0.00 -1.74 0.00 0.00 68.15 69.49 1iy6 h THR 47 CO 0.00 0.79 0.27 -0.11 0.37 0.00 0.00 175.52 176.84 1iy6 n LEU 48 N -3.75 4.56 0.00 2.58 7.94 -1.26 -5.01 117.00 122.06 1iy6 n LEU 48 Ca -0.16 0.76 0.00 0.00 -1.11 0.00 0.00 56.01 55.50 1iy6 n LEU 48 Cb 1.06 -1.46 0.00 0.00 0.53 0.00 0.00 43.42 43.55 1iy6 n LEU 48 CO 0.60 -1.60 0.00 0.35 -1.11 0.00 0.00 177.39 175.63 1iy6 n THR 49 N -2.15 0.00 -4.39 1.96 -2.24 -1.26 -4.98 114.28 101.23 1iy6 n THR 49 Ca 0.14 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.71 1iy6 n THR 49 Cb 0.48 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.58 1iy6 n THR 49 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1iy6 s LEU 50 N 0.00 2.19 -0.22 3.22 2.96 -1.26 -1.53 118.68 124.04 1iy6 s LEU 50 Ca 0.00 -0.51 -0.04 0.00 -0.22 0.00 0.00 54.13 53.36 1iy6 s LEU 50 Cb 0.00 -0.70 -0.12 0.00 0.50 0.00 0.00 46.19 45.87 1iy6 s LEU 50 CO 0.00 0.05 -0.23 -1.20 -1.32 0.00 0.00 176.35 173.65 1iy6 n SER 51 N 1.74 2.03 0.00 3.68 7.64 0.02 -4.09 113.62 124.65 1iy6 n SER 51 Ca -0.18 0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1iy6 n SER 51 Cb 0.54 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1iy6 n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1iy6 n HIS 52 N -3.50 0.00 -1.46 1.43 1.44 -1.15 -4.98 115.22 107.01 1iy6 n HIS 52 Ca -0.40 0.00 -0.44 0.00 -2.01 0.00 0.00 57.72 54.87 1iy6 n HIS 52 Cb 0.86 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.85 1iy6 n HIS 52 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1iy6 n PHE 53 N 0.00 0.84 0.00 -1.40 3.72 -1.26 -3.05 117.46 116.31 1iy6 n PHE 53 Ca 0.00 0.40 0.00 0.00 -0.05 0.00 0.00 57.45 57.80 1iy6 n PHE 53 Cb 0.00 -2.41 0.00 0.00 -0.94 0.00 0.00 39.48 36.13 1iy6 n PHE 53 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iy6 n GLY 54 N 6.60 1.50 3.70 1.37 0.00 0.15 -4.83 105.19 113.69 1iy6 n GLY 54 Ca 0.59 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1iy6 n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iy6 s LYS 55 N -2.00 4.33 0.00 1.61 -2.85 -1.24 -2.95 119.74 116.64 1iy6 s LYS 55 Ca 0.00 1.93 0.10 0.00 -1.00 0.00 0.00 55.97 56.99 1iy6 s LYS 55 Cb 0.00 -3.42 0.57 0.00 -2.06 0.00 0.00 37.83 32.92 1iy6 s LYS 55 CO 0.00 -0.45 1.02 0.00 0.10 0.00 0.00 175.35 176.02