#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy6 s VAL 4 N 0.00 -0.61 0.37 0.00 0.11 -1.26 -5.16 120.40 113.85 1iy6 s VAL 4 Ca 0.00 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.12 1iy6 s VAL 4 Cb 0.00 -0.41 -0.00 0.00 -1.53 0.00 0.00 36.38 34.43 1iy6 s VAL 4 CO 0.00 0.00 0.48 -0.94 -3.33 0.00 0.00 175.10 171.31 1iy6 s SER 5 N 2.59 5.76 -0.11 3.54 1.04 -1.26 -5.01 113.70 120.24 1iy6 s SER 5 Ca 0.18 -0.32 -0.07 0.00 0.48 0.00 0.00 55.95 56.21 1iy6 s SER 5 Cb -0.04 -0.98 0.04 0.00 0.10 0.00 0.00 66.02 65.14 1iy6 s SER 5 CO -0.20 -0.55 0.28 0.54 0.98 0.00 0.00 173.24 174.29 1iy6 s VAL 6 N -2.26 -0.02 -0.19 5.02 0.11 -1.26 -5.14 120.40 116.66 1iy6 s VAL 6 Ca 0.48 0.09 0.01 0.00 -2.93 0.00 0.00 61.98 59.63 1iy6 s VAL 6 Cb -0.09 -0.42 0.02 0.00 -1.53 0.00 0.00 36.38 34.36 1iy6 s VAL 6 CO 0.31 0.04 -0.17 -0.62 -3.33 0.00 0.00 175.10 171.32 1iy6 s ASP 7 N 0.89 3.36 -0.10 3.54 -1.08 -1.26 -4.96 116.67 117.07 1iy6 s ASP 7 Ca -0.06 -0.68 0.16 0.00 -0.52 0.00 0.00 52.55 51.45 1iy6 s ASP 7 Cb -0.07 -1.51 0.34 0.00 -1.46 0.00 0.00 42.92 40.22 1iy6 s ASP 7 CO -0.06 -0.02 1.16 0.00 0.52 0.00 0.00 175.17 176.77 1iy6 s SER 9 N -2.46 3.77 0.00 0.00 0.01 -1.26 -3.10 113.70 110.66 1iy6 s SER 9 Ca 0.30 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.38 1iy6 s SER 9 Cb 0.31 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.98 1iy6 s SER 9 CO -0.08 -4.10 0.00 -0.62 0.41 0.00 0.00 173.24 168.85 1iy6 n GLU 10 N 8.67 0.00 -3.94 12.44 -0.58 -1.26 -5.06 120.64 130.92 1iy6 n GLU 10 Ca 0.46 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.89 1iy6 n GLU 10 Cb 0.44 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 31.17 1iy6 n GLU 10 CO 0.00 0.00 0.00 1.52 -0.48 0.00 0.00 177.13 178.17 1iy6 s TYR 11 N -0.52 3.17 -0.01 -0.32 1.13 -1.18 -4.95 117.35 114.67 1iy6 s TYR 11 Ca 0.00 -3.06 0.00 0.00 -1.41 0.00 0.00 57.07 52.60 1iy6 s TYR 11 Cb 0.00 -2.75 0.01 0.00 -1.10 0.00 0.00 41.96 38.12 1iy6 s TYR 11 CO 0.00 -0.79 1.66 -0.35 -2.51 0.00 0.00 175.55 173.57 1iy6 n PRO 12 N 3.38 1.03 -3.15 -3.49 -0.04 -1.26 -4.47 135.00 127.00 1iy6 n PRO 12 Ca 0.05 -0.07 0.05 0.00 -0.04 0.00 0.00 63.50 63.49 1iy6 n PRO 12 Cb 0.34 -1.03 -0.01 0.00 -0.04 0.00 0.00 33.50 32.77 1iy6 n PRO 12 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1iy6 s LYS 13 N -0.08 0.34 -0.44 0.54 2.20 -1.26 -5.03 119.74 116.01 1iy6 s LYS 13 Ca 0.01 0.54 0.07 0.00 -0.36 0.00 0.00 55.97 56.23 1iy6 s LYS 13 Cb 0.01 0.29 0.24 0.00 -1.51 0.00 0.00 37.83 36.87 1iy6 s LYS 13 CO 0.00 -0.44 0.70 0.00 -0.36 0.00 0.00 175.35 175.25 1iy6 n ALA 15 N 1.53 4.86 -1.96 0.00 0.00 -1.26 -3.81 120.51 119.87 1iy6 n ALA 15 Ca 0.15 -4.23 -0.31 0.00 0.00 0.00 0.00 53.44 49.04 1iy6 n ALA 15 Cb 0.58 -3.08 -0.03 0.00 0.00 0.00 0.00 19.45 16.92 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 -1.62 0.00 0.00 0.00 -1.04 -1.26 -4.86 114.28 105.50 1iy6 n THR 17 Ca 0.05 -1.46 0.00 0.00 -2.04 0.00 0.00 64.05 60.60 1iy6 n THR 17 Cb 0.54 1.48 0.00 0.00 -1.82 0.00 0.00 70.33 70.53 1iy6 n THR 17 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 1iy6 n MET 18 N 0.49 0.00 -2.07 -2.82 0.00 -1.26 -5.09 117.12 106.37 1iy6 n MET 18 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 57.70 57.40 1iy6 n MET 18 Cb 0.70 0.00 0.02 0.00 0.00 0.00 0.00 33.22 33.94 1iy6 n MET 18 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1iy6 s GLU 19 N -0.67 3.12 -0.31 2.12 2.12 -1.26 -4.97 118.70 118.86 1iy6 s GLU 19 Ca 0.00 1.80 -0.19 0.00 0.36 0.00 0.00 54.97 56.94 1iy6 s GLU 19 Cb 0.00 -2.00 -0.01 0.00 0.26 0.00 0.00 34.13 32.38 1iy6 s GLU 19 CO 0.00 -1.08 0.56 -0.47 -0.54 0.00 0.00 175.26 173.73 1iy6 s TYR 20 N -1.61 3.21 -0.48 5.30 5.04 -1.26 -4.75 117.35 122.80 1iy6 s TYR 20 Ca 0.75 0.46 0.06 0.00 -2.44 0.00 0.00 57.07 55.90 1iy6 s TYR 20 Cb -0.29 -2.91 0.18 0.00 0.35 0.00 0.00 41.96 39.29 1iy6 s TYR 20 CO 0.33 -0.45 0.61 1.03 -1.34 0.00 0.00 175.55 175.72 1iy6 s ARG 21 N 2.47 0.99 -0.82 4.97 0.52 -0.77 -5.02 118.95 121.30 1iy6 s ARG 21 Ca 0.22 -1.25 -0.25 0.00 -0.52 0.00 0.00 55.73 53.93 1iy6 s ARG 21 Cb -0.15 -0.40 0.02 0.00 0.52 0.00 0.00 34.95 34.93 1iy6 s ARG 21 CO 0.12 -1.33 1.52 -1.25 0.02 0.00 0.00 175.30 174.39 1iy6 s PRO 22 N 0.78 3.12 -0.21 3.54 0.04 -1.24 -2.17 135.00 138.85 1iy6 s PRO 22 Ca 0.29 -0.35 -0.14 0.00 0.04 0.00 0.00 61.00 60.84 1iy6 s PRO 22 Cb -0.00 -4.68 -0.04 0.00 0.04 0.00 0.00 34.50 29.81 1iy6 s PRO 22 CO -0.09 -2.44 0.31 -0.51 0.04 0.00 0.00 177.00 174.32 1iy6 s LEU 23 N 6.70 4.15 -1.10 -3.56 1.43 -1.11 0.61 118.68 125.80 1iy6 s LEU 23 Ca 0.49 0.38 -0.16 0.00 -1.03 0.00 0.00 54.13 53.80 1iy6 s LEU 23 Cb -0.06 -2.37 0.14 0.00 0.03 0.00 0.00 46.19 43.93 1iy6 s LEU 23 CO 0.07 -0.02 1.34 0.00 0.23 0.00 0.00 176.35 177.97 1iy6 n GLY 25 N 4.86 -1.64 0.23 0.00 0.00 0.05 0.87 105.19 109.56 1iy6 n GLY 25 Ca 0.33 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.37 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 0.47 0.00 -0.16 1.61 0.87 -1.13 0.23 113.55 115.44 1iy6 h SER 26 Ca -0.43 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.11 1iy6 h SER 26 Cb 1.40 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.35 1iy6 h SER 26 CO 0.48 0.00 0.02 -0.90 -0.53 0.00 0.00 176.83 175.91 1iy6 n ASP 27 N -2.38 2.34 -3.51 6.23 5.75 -1.26 -4.83 116.55 118.89 1iy6 n ASP 27 Ca -0.01 -2.26 -0.24 0.00 -0.01 0.00 0.00 54.79 52.26 1iy6 n ASP 27 Cb 0.33 -0.55 0.07 0.00 -1.03 0.00 0.00 41.12 39.93 1iy6 n ASP 27 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1iy6 n ASN 28 N 0.15 -6.18 -4.19 -1.12 4.05 0.81 -4.98 115.26 103.81 1iy6 n ASN 28 Ca 0.08 -0.51 -0.32 0.00 0.45 0.00 0.00 54.58 54.28 1iy6 n ASN 28 Cb 0.53 -4.89 -0.17 0.00 1.23 0.00 0.00 39.78 36.49 1iy6 n ASN 28 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1iy6 s LYS 29 N -6.23 2.99 -0.18 1.20 2.36 -1.17 -4.93 119.74 113.78 1iy6 s LYS 29 Ca 0.54 -0.85 -0.24 0.00 -2.55 0.00 0.00 55.97 52.87 1iy6 s LYS 29 Cb -0.24 -2.34 -0.02 0.00 -1.05 0.00 0.00 37.83 34.18 1iy6 s LYS 29 CO 0.67 0.08 0.75 0.99 1.55 0.00 0.00 175.35 179.39 1iy6 s THR 30 N 0.59 4.93 0.12 3.43 2.01 -1.26 -0.77 115.64 124.69 1iy6 s THR 30 Ca -0.13 1.46 0.03 0.00 0.31 0.00 0.00 61.69 63.36 1iy6 s THR 30 Cb -0.17 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 1iy6 s THR 30 CO 0.03 0.06 0.17 -0.31 -0.69 0.00 0.00 174.62 173.88 1iy6 s TYR 31 N 2.06 3.31 0.02 4.92 2.02 -0.46 -4.89 117.35 124.33 1iy6 s TYR 31 Ca 0.35 0.09 0.22 0.00 -0.37 0.00 0.00 57.07 57.36 1iy6 s TYR 31 Cb -0.16 -1.63 0.69 0.00 -0.40 0.00 0.00 41.96 40.46 1iy6 s TYR 31 CO 0.12 0.53 1.73 0.78 -1.57 0.00 0.00 175.55 177.14 1iy6 h GLY 32 N 2.72 0.00 -3.18 0.71 0.00 -1.90 -2.94 103.07 98.48 1iy6 h GLY 32 Ca -0.47 0.00 0.38 0.00 0.00 0.00 0.00 47.33 47.24 1iy6 h GLY 32 CO 0.68 0.00 0.98 0.54 0.00 0.00 0.00 176.54 178.74 1iy6 s ASN 33 N -6.24 -0.01 0.24 0.19 2.20 -0.92 -1.85 114.94 108.55 1iy6 s ASN 33 Ca 0.02 -0.01 0.15 0.00 -0.94 0.00 0.00 52.86 52.08 1iy6 s ASN 33 Cb 0.09 0.02 0.84 0.00 -2.00 0.00 0.00 41.25 40.20 1iy6 s ASN 33 CO 0.66 -0.03 1.46 0.29 -2.94 0.00 0.00 177.10 176.55 1iy6 n LYS 34 N -0.40 0.10 0.02 3.55 5.02 -1.26 -0.69 118.16 124.50 1iy6 n LYS 34 Ca -0.07 0.59 -0.14 0.00 -2.02 0.00 0.00 58.31 56.67 1iy6 n LYS 34 Cb 0.62 -1.85 -0.04 0.00 -0.02 0.00 0.00 35.03 33.75 1iy6 n LYS 34 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1iy6 h ASN 36 N 0.40 0.00 0.77 0.00 -0.73 -1.00 -2.97 115.58 112.04 1iy6 h ASN 36 Ca -0.06 0.00 -0.25 0.00 1.87 0.00 0.00 56.30 57.86 1iy6 h ASN 36 Cb 1.42 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 40.00 1iy6 h ASN 36 CO 0.15 0.49 -1.16 0.15 -0.37 0.00 0.00 177.43 176.69 1iy6 h PHE 37 N 0.00 0.31 0.00 0.67 3.04 -1.25 -2.08 116.94 117.63 1iy6 h PHE 37 Ca -0.02 -0.23 -0.10 0.00 3.98 0.00 0.00 57.97 61.61 1iy6 h PHE 37 Cb 1.39 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.87 1iy6 h PHE 37 CO 0.00 1.18 -0.47 0.00 -2.02 0.00 0.00 178.31 177.00 1iy6 h ALA 40 N 0.17 1.02 0.07 0.00 0.00 -1.34 -2.04 119.26 117.15 1iy6 h ALA 40 Ca -0.29 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 1iy6 h ALA 40 Cb 2.13 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.94 1iy6 h ALA 40 CO 0.23 0.01 -0.76 0.28 0.00 0.00 0.00 179.25 179.01 1iy6 h VAL 41 N 0.00 1.44 -0.03 0.00 2.07 -1.36 -1.70 116.25 116.68 1iy6 h VAL 41 Ca -0.00 -2.30 0.01 0.00 0.82 0.00 0.00 66.70 65.23 1iy6 h VAL 41 Cb 0.23 2.85 -0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1iy6 h VAL 41 CO 0.00 0.67 0.02 0.58 0.02 0.00 0.00 177.57 178.86 1iy6 h VAL 42 N -0.16 0.80 0.00 2.57 2.07 -1.14 0.50 116.25 120.89 1iy6 h VAL 42 Ca -0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1iy6 h VAL 42 Cb 1.51 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1iy6 h VAL 42 CO 0.15 0.00 -0.90 -0.33 0.02 0.00 0.00 177.57 176.51 1iy6 h GLU 43 N 0.00 0.00 -0.30 1.57 4.39 -1.47 -3.28 114.58 115.49 1iy6 h GLU 43 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1iy6 h GLU 43 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1iy6 h GLU 43 CO -0.00 0.00 0.00 0.43 -1.16 0.00 0.00 179.01 178.28 1iy6 n SER 44 N -2.58 2.04 -3.21 1.42 7.64 0.09 -4.90 113.62 114.11 1iy6 n SER 44 Ca 0.01 -1.87 -0.21 0.00 1.01 0.00 0.00 58.87 57.81 1iy6 n SER 44 Cb 0.53 -0.20 0.07 0.00 -1.01 0.00 0.00 64.21 63.60 1iy6 n SER 44 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1iy6 n ASN 45 N 0.59 -5.77 -2.08 6.43 4.13 -0.79 -1.43 115.26 116.34 1iy6 n ASN 45 Ca 0.15 -0.47 -0.19 0.00 1.68 0.00 0.00 54.58 55.75 1iy6 n ASN 45 Cb 0.36 -4.48 -0.04 0.00 -1.54 0.00 0.00 39.78 34.08 1iy6 n ASN 45 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1iy6 n GLY 46 N -1.81 0.36 0.00 7.41 0.00 -0.71 -4.81 105.19 105.63 1iy6 n GLY 46 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1iy6 n GLY 46 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1iy6 n THR 47 N -3.24 0.00 -2.50 2.61 5.66 -0.51 -4.97 114.28 111.33 1iy6 n THR 47 Ca -0.21 -0.15 -0.35 0.00 -3.05 0.00 0.00 64.05 60.30 1iy6 n THR 47 Cb 0.65 0.92 -0.03 0.00 -1.55 0.00 0.00 70.33 70.31 1iy6 n THR 47 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1iy6 s LEU 48 N -2.89 3.90 0.00 1.09 2.96 -1.26 -5.05 118.68 117.43 1iy6 s LEU 48 Ca 0.05 1.99 0.00 0.00 -0.22 0.00 0.00 54.13 55.95 1iy6 s LEU 48 Cb 0.12 -4.48 0.00 0.00 0.50 0.00 0.00 46.19 42.33 1iy6 s LEU 48 CO 0.66 -0.78 0.00 0.35 -1.32 0.00 0.00 176.35 175.26 1iy6 n THR 49 N -0.81 0.00 -4.40 3.68 -2.24 -1.26 -5.02 114.28 104.23 1iy6 n THR 49 Ca 0.09 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.60 1iy6 n THR 49 Cb 0.52 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.65 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 2.97 0.00 3.22 2.96 -1.26 -1.55 118.68 125.02 1iy6 s LEU 50 Ca 0.00 -1.20 0.00 0.00 -0.22 0.00 0.00 54.13 52.71 1iy6 s LEU 50 Cb 0.00 -1.17 0.00 0.00 0.50 0.00 0.00 46.19 45.52 1iy6 s LEU 50 CO 0.00 -0.44 0.00 -0.24 -1.32 0.00 0.00 176.35 174.35 1iy6 n SER 51 N -1.05 1.55 0.00 3.68 2.88 0.25 -2.85 113.62 118.09 1iy6 n SER 51 Ca -0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 1iy6 n SER 51 Cb 0.65 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1iy6 n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iy6 n HIS 52 N -2.21 0.00 -1.51 0.66 1.44 -1.08 -4.96 115.22 107.57 1iy6 n HIS 52 Ca 0.00 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 1iy6 n HIS 52 Cb 0.26 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.26 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 0.83 0.00 -1.40 3.01 -1.26 -2.91 117.46 115.73 1iy6 n PHE 53 Ca 0.00 0.32 0.00 0.00 1.01 0.00 0.00 57.45 58.78 1iy6 n PHE 53 Cb 0.00 -2.45 0.00 0.00 -0.01 0.00 0.00 39.48 37.02 1iy6 n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iy6 n GLY 54 N 6.39 1.40 3.69 1.37 0.00 0.20 -4.88 105.19 113.37 1iy6 n GLY 54 Ca 0.57 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 1iy6 n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iy6 s LYS 55 N -2.00 4.36 0.00 1.61 2.20 -1.26 -3.24 119.74 121.41 1iy6 s LYS 55 Ca 0.00 1.62 0.07 0.00 -0.36 0.00 0.00 55.97 57.31 1iy6 s LYS 55 Cb 0.00 -3.56 0.44 0.00 -1.51 0.00 0.00 37.83 33.20 1iy6 s LYS 55 CO 0.00 -0.44 0.90 0.00 -0.36 0.00 0.00 175.35 175.45