#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 0.00 -2.57 0.00 0.24 -1.26 -5.05 118.33 109.69 1iy6 n VAL 4 Ca 0.00 -1.60 -0.41 0.00 -2.04 0.00 0.00 64.34 60.29 1iy6 n VAL 4 Cb 0.00 0.43 0.01 0.00 -1.47 0.00 0.00 33.84 32.81 1iy6 n VAL 4 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1iy6 n SER 5 N -1.41 7.34 -4.50 -1.34 2.88 -1.26 -4.97 113.62 110.37 1iy6 n SER 5 Ca -0.10 -3.57 -0.27 0.00 -1.33 0.00 0.00 58.87 53.60 1iy6 n SER 5 Cb 0.42 -1.22 -0.11 0.00 -0.75 0.00 0.00 64.21 62.56 1iy6 n SER 5 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1iy6 s VAL 6 N -3.60 2.79 -0.23 2.46 0.11 -1.26 -5.13 120.40 115.53 1iy6 s VAL 6 Ca 0.41 -1.78 -0.27 0.00 -2.93 0.00 0.00 61.98 57.41 1iy6 s VAL 6 Cb 0.17 -2.34 0.12 0.00 -1.53 0.00 0.00 36.38 32.80 1iy6 s VAL 6 CO -0.10 -0.07 0.99 -1.81 -3.33 0.00 0.00 175.10 170.78 1iy6 s ASP 7 N -2.63 -0.45 -0.38 3.54 1.11 -1.26 -5.06 116.67 111.55 1iy6 s ASP 7 Ca 0.22 0.74 0.08 0.00 0.18 0.00 0.00 52.55 53.76 1iy6 s ASP 7 Cb -0.09 0.71 0.44 0.00 1.07 0.00 0.00 42.92 45.05 1iy6 s ASP 7 CO 0.12 -0.24 1.12 0.00 1.18 0.00 0.00 175.17 177.35 1iy6 n SER 9 N -0.51 -0.03 -2.91 0.00 2.88 -1.26 -1.73 113.62 110.06 1iy6 n SER 9 Ca 0.36 -1.03 -0.09 0.00 -1.33 0.00 0.00 58.87 56.79 1iy6 n SER 9 Cb 0.77 -1.04 0.04 0.00 -0.75 0.00 0.00 64.21 63.23 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 6.94 -1.65 -2.56 -1.46 4.71 -1.26 -4.97 120.64 120.38 1iy6 n GLU 10 Ca 0.56 0.89 -0.18 0.00 -0.01 0.00 0.00 57.16 58.42 1iy6 n GLU 10 Cb 0.28 -5.09 0.01 0.00 -1.01 0.00 0.00 31.44 25.63 1iy6 n GLU 10 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 1iy6 n TYR 11 N -2.58 2.32 -2.50 -0.32 9.36 -0.70 -5.06 117.16 117.69 1iy6 n TYR 11 Ca -0.04 -2.95 -0.43 0.00 3.32 0.00 0.00 57.90 57.80 1iy6 n TYR 11 Cb 0.57 -0.23 -0.02 0.00 -0.63 0.00 0.00 39.34 39.03 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 -3.34 4.03 -0.32 2.98 0.04 -1.26 -4.44 135.00 132.69 1iy6 s PRO 12 Ca 0.38 1.27 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 1iy6 s PRO 12 Cb 0.43 -3.81 0.19 0.00 0.04 0.00 0.00 34.50 31.35 1iy6 s PRO 12 CO -0.08 -0.97 0.90 -1.59 0.04 0.00 0.00 177.00 175.31 1iy6 s LYS 13 N 3.86 0.32 -0.20 4.56 -2.85 -1.26 -5.00 119.74 119.17 1iy6 s LYS 13 Ca 0.52 0.11 0.06 0.00 -1.00 0.00 0.00 55.97 55.66 1iy6 s LYS 13 Cb -0.16 0.09 0.46 0.00 -2.06 0.00 0.00 37.83 36.16 1iy6 s LYS 13 CO 0.19 -0.54 1.39 0.00 0.10 0.00 0.00 175.35 176.49 1iy6 n ALA 15 N -0.01 3.04 -3.57 0.00 0.00 -1.26 -5.08 120.51 113.64 1iy6 n ALA 15 Ca 0.26 -3.60 -0.22 0.00 0.00 0.00 0.00 53.44 49.88 1iy6 n ALA 15 Cb 1.00 -0.84 0.02 0.00 0.00 0.00 0.00 19.45 19.63 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 -1.69 0.00 -2.71 0.00 -1.04 -1.26 -5.00 114.28 102.58 1iy6 n THR 17 Ca 0.03 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.96 1iy6 n THR 17 Cb 0.50 -0.04 0.11 0.00 -1.82 0.00 0.00 70.33 69.07 1iy6 n THR 17 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1iy6 n MET 18 N 0.00 1.11 -2.50 -2.82 2.81 -1.26 -5.13 117.12 109.33 1iy6 n MET 18 Ca 0.00 -1.83 -0.35 0.00 -1.81 0.00 0.00 57.70 53.72 1iy6 n MET 18 Cb 0.00 -0.36 -0.03 0.00 -0.71 0.00 0.00 33.22 32.12 1iy6 n MET 18 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1iy6 s GLU 19 N 0.22 3.80 -0.57 0.03 8.01 -1.26 -4.98 118.70 123.94 1iy6 s GLU 19 Ca 0.22 1.43 -0.17 0.00 0.01 0.00 0.00 54.97 56.46 1iy6 s GLU 19 Cb 0.36 -2.16 0.13 0.00 -4.31 0.00 0.00 34.13 28.15 1iy6 s GLU 19 CO -0.08 -0.44 0.58 -0.47 0.01 0.00 0.00 175.26 174.86 1iy6 s TYR 20 N -1.89 3.20 -0.32 1.61 6.14 -1.26 -4.65 117.35 120.17 1iy6 s TYR 20 Ca 0.67 -1.23 -0.02 0.00 0.64 0.00 0.00 57.07 57.13 1iy6 s TYR 20 Cb -0.18 -3.87 0.12 0.00 0.42 0.00 0.00 41.96 38.45 1iy6 s TYR 20 CO 0.22 -1.10 0.19 1.03 0.64 0.00 0.00 175.55 176.53 1iy6 s ARG 21 N 1.85 0.37 -0.42 4.97 1.81 -0.90 -5.04 118.95 121.60 1iy6 s ARG 21 Ca 0.06 -0.83 -0.29 0.00 -1.72 0.00 0.00 55.73 52.95 1iy6 s ARG 21 Cb -0.27 -1.15 0.01 0.00 -0.45 0.00 0.00 34.95 33.10 1iy6 s ARG 21 CO 0.03 -1.11 1.34 -1.25 -0.68 0.00 0.00 175.30 173.63 1iy6 s PRO 22 N 1.68 3.64 -0.13 3.54 0.04 -1.26 -2.43 135.00 140.08 1iy6 s PRO 22 Ca 0.13 0.89 0.01 0.00 0.04 0.00 0.00 61.00 62.07 1iy6 s PRO 22 Cb -0.19 -3.98 -0.01 0.00 0.04 0.00 0.00 34.50 30.36 1iy6 s PRO 22 CO -0.20 -1.48 -0.17 -0.51 0.04 0.00 0.00 177.00 174.69 1iy6 s LEU 23 N 5.11 2.47 -0.30 -3.56 1.02 -1.16 -0.41 118.68 121.84 1iy6 s LEU 23 Ca 0.58 -0.43 -0.22 0.00 0.02 0.00 0.00 54.13 54.08 1iy6 s LEU 23 Cb -0.12 -1.54 -0.00 0.00 0.02 0.00 0.00 46.19 44.54 1iy6 s LEU 23 CO 0.31 0.14 0.70 0.00 0.02 0.00 0.00 176.35 177.53 1iy6 s GLY 25 N 1.62 2.75 0.49 0.00 0.00 -0.48 -0.70 107.32 111.00 1iy6 s GLY 25 Ca 0.29 0.67 0.20 0.00 0.00 0.00 0.00 44.72 45.87 1iy6 s GLY 25 CO 0.12 1.10 1.55 1.76 0.00 0.00 0.00 173.10 177.63 1iy6 h SER 26 N 2.66 0.00 -0.14 1.64 0.02 -1.49 0.19 113.55 116.44 1iy6 h SER 26 Ca -0.48 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1iy6 h SER 26 Cb 1.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.75 1iy6 h SER 26 CO 0.63 0.00 0.01 -0.90 -1.14 0.00 0.00 176.83 175.43 1iy6 n ASP 27 N -2.43 2.17 -3.24 3.07 5.75 -1.26 -4.80 116.55 115.80 1iy6 n ASP 27 Ca -0.01 -2.23 -0.22 0.00 -0.01 0.00 0.00 54.79 52.32 1iy6 n ASP 27 Cb 0.38 -0.55 0.06 0.00 -1.03 0.00 0.00 41.12 39.99 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 0.14 -6.07 -4.57 -1.12 2.85 0.67 -5.00 115.26 102.17 1iy6 n ASN 28 Ca 0.07 -0.43 -0.26 0.00 -0.11 0.00 0.00 54.58 53.84 1iy6 n ASN 28 Cb 0.49 -4.75 -0.10 0.00 1.24 0.00 0.00 39.78 36.66 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 -6.05 1.88 -0.14 1.20 2.36 -1.18 -4.94 119.74 112.87 1iy6 s LYS 29 Ca 0.47 -1.93 -0.02 0.00 -2.55 0.00 0.00 55.97 51.94 1iy6 s LYS 29 Cb -0.21 -1.74 -0.02 0.00 -1.05 0.00 0.00 37.83 34.81 1iy6 s LYS 29 CO 0.58 0.11 -0.07 0.99 1.55 0.00 0.00 175.35 178.52 1iy6 s THR 30 N -2.61 3.62 0.02 3.43 2.01 -1.26 -1.39 115.64 119.46 1iy6 s THR 30 Ca 0.33 -0.46 0.02 0.00 0.31 0.00 0.00 61.69 61.89 1iy6 s THR 30 Cb 0.03 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 1iy6 s THR 30 CO 0.17 0.52 0.01 -0.31 -0.69 0.00 0.00 174.62 174.32 1iy6 s TYR 31 N 0.20 3.07 0.19 4.92 1.51 -0.36 -4.96 117.35 121.92 1iy6 s TYR 31 Ca -0.04 0.06 0.05 0.00 -1.01 0.00 0.00 57.07 56.13 1iy6 s TYR 31 Cb -0.14 -1.64 0.07 0.00 -0.11 0.00 0.00 41.96 40.13 1iy6 s TYR 31 CO 0.04 0.47 1.43 0.78 -1.11 0.00 0.00 175.55 177.16 1iy6 h GLY 32 N 4.08 0.14 -3.03 0.71 0.00 -1.88 -3.07 103.07 100.01 1iy6 h GLY 32 Ca -0.48 -0.24 0.14 0.00 0.00 0.00 0.00 47.33 46.75 1iy6 h GLY 32 CO 0.59 0.21 0.50 0.54 0.00 0.00 0.00 176.54 178.37 1iy6 s ASN 33 N -6.87 -0.30 0.24 0.19 2.20 -1.02 -2.11 114.94 107.27 1iy6 s ASN 33 Ca -0.02 -0.13 0.17 0.00 -0.94 0.00 0.00 52.86 51.94 1iy6 s ASN 33 Cb 0.11 0.41 0.89 0.00 -2.00 0.00 0.00 41.25 40.66 1iy6 s ASN 33 CO 0.81 -0.70 1.51 1.17 -2.94 0.00 0.00 177.10 176.95 1iy6 n LYS 34 N -0.32 0.11 0.01 3.55 4.81 -1.26 -0.90 118.16 124.16 1iy6 n LYS 34 Ca -0.08 0.59 -0.09 0.00 -0.87 0.00 0.00 58.31 57.86 1iy6 n LYS 34 Cb 0.61 -1.84 0.07 0.00 0.02 0.00 0.00 35.03 33.89 1iy6 n LYS 34 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1iy6 h ASN 36 N 0.41 0.00 0.22 0.00 -0.00 -1.31 -2.84 115.58 112.06 1iy6 h ASN 36 Ca 0.01 -0.00 -0.28 0.00 -0.00 0.00 0.00 56.30 56.03 1iy6 h ASN 36 Cb 1.07 0.00 0.02 0.00 -0.00 0.00 0.00 38.32 39.41 1iy6 h ASN 36 CO 0.10 0.00 -1.17 0.15 -0.00 0.00 0.00 177.43 176.51 1iy6 h PHE 37 N 0.00 0.88 0.00 0.67 3.57 -1.10 -2.13 116.94 118.83 1iy6 h PHE 37 Ca 0.00 -0.54 -0.03 0.00 3.53 0.00 0.00 57.97 60.92 1iy6 h PHE 37 Cb 0.98 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.64 1iy6 h PHE 37 CO 0.00 1.39 -0.16 0.00 -2.23 0.00 0.00 178.31 177.31 1iy6 h ALA 40 N 0.57 0.85 0.18 0.00 0.00 -1.31 -2.64 119.26 116.91 1iy6 h ALA 40 Ca -0.14 -0.27 -0.32 0.00 0.00 0.00 0.00 54.91 54.19 1iy6 h ALA 40 Cb 1.98 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.73 1iy6 h ALA 40 CO 0.21 0.36 -1.48 0.28 0.00 0.00 0.00 179.25 178.62 1iy6 h VAL 41 N 0.00 1.25 0.00 0.00 2.07 -1.36 -2.57 116.25 115.64 1iy6 h VAL 41 Ca -0.00 -2.78 -0.01 0.00 0.82 0.00 0.00 66.70 64.72 1iy6 h VAL 41 Cb 1.11 2.91 -0.00 0.00 -1.52 0.00 0.00 31.29 33.78 1iy6 h VAL 41 CO 0.04 0.84 -0.07 0.58 0.02 0.00 0.00 177.57 178.98 1iy6 h VAL 42 N 0.10 0.15 0.00 2.57 2.07 -1.36 0.30 116.25 120.09 1iy6 h VAL 42 Ca -0.24 -0.85 -0.27 0.00 0.82 0.00 0.00 66.70 66.17 1iy6 h VAL 42 Cb 2.08 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 33.54 1iy6 h VAL 42 CO 0.22 0.07 -1.51 1.05 0.02 0.00 0.00 177.57 177.41 1iy6 h GLU 43 N 0.00 0.01 -0.01 1.57 4.11 -1.50 -3.29 114.58 115.46 1iy6 h GLU 43 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1iy6 h GLU 43 Cb 0.73 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1iy6 h GLU 43 CO 0.01 0.66 -0.03 0.43 0.07 0.00 0.00 179.01 180.15 1iy6 n SER 44 N -3.14 1.22 0.00 3.06 7.64 -0.97 -4.89 113.62 116.54 1iy6 n SER 44 Ca -0.12 -1.34 0.00 0.00 1.01 0.00 0.00 58.87 58.42 1iy6 n SER 44 Cb 1.02 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 64.23 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 -3.01 0.00 6.43 2.85 -0.91 -2.83 115.26 117.69 1iy6 n ASN 45 Ca 0.19 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.66 1iy6 n ASN 45 Cb 0.32 -0.81 0.00 0.00 1.24 0.00 0.00 39.78 40.53 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 -2.45 1.10 0.17 8.20 0.00 0.05 -4.96 105.19 107.28 1iy6 n GLY 46 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 -3.54 2.61 2.02 -1.75 -3.45 112.91 108.79 1iy6 h THR 47 Ca 0.00 -0.79 -0.50 0.00 0.77 0.00 0.00 66.41 65.89 1iy6 h THR 47 Cb 0.00 1.74 0.01 0.00 -1.74 0.00 0.00 68.15 68.15 1iy6 h THR 47 CO 0.00 0.00 0.05 -0.22 0.37 0.00 0.00 175.52 175.72 1iy6 s LEU 48 N -5.46 3.86 0.00 2.58 2.96 -1.26 -5.08 118.68 116.27 1iy6 s LEU 48 Ca 0.08 0.99 0.00 0.00 -0.22 0.00 0.00 54.13 54.98 1iy6 s LEU 48 Cb 0.08 -3.87 0.00 0.00 0.50 0.00 0.00 46.19 42.91 1iy6 s LEU 48 CO 0.65 -0.37 0.00 0.35 -1.32 0.00 0.00 176.35 175.66 1iy6 n THR 49 N -1.34 0.00 -4.60 3.68 -2.24 -1.26 -4.92 114.28 103.60 1iy6 n THR 49 Ca 0.01 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.56 1iy6 n THR 49 Cb 0.54 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.61 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 1.82 -0.05 3.22 2.96 -1.26 -1.62 118.68 123.76 1iy6 s LEU 50 Ca 0.00 -0.27 0.09 0.00 -0.22 0.00 0.00 54.13 53.72 1iy6 s LEU 50 Cb 0.00 -0.76 -0.24 0.00 0.50 0.00 0.00 46.19 45.69 1iy6 s LEU 50 CO 0.00 0.10 0.64 -1.28 -1.32 0.00 0.00 176.35 174.49 1iy6 h SER 51 N 6.39 0.09 0.00 3.68 0.87 -1.05 -3.38 113.55 120.15 1iy6 h SER 51 Ca -0.33 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1iy6 h SER 51 Cb 1.17 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1iy6 h SER 51 CO 0.48 1.17 0.00 0.00 -0.53 0.00 0.00 176.83 177.95 1iy6 n HIS 52 N -3.14 0.00 -1.44 2.24 1.44 -1.16 -4.96 115.22 108.19 1iy6 n HIS 52 Ca -0.19 0.00 -0.59 0.00 -2.01 0.00 0.00 57.72 54.93 1iy6 n HIS 52 Cb 1.05 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 31.06 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 1.49 0.00 -1.40 3.72 -1.26 -2.98 117.46 117.02 1iy6 n PHE 53 Ca 0.00 0.69 0.00 0.00 -0.05 0.00 0.00 57.45 58.09 1iy6 n PHE 53 Cb 0.00 -2.36 0.00 0.00 -0.94 0.00 0.00 39.48 36.18 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 6.24 4.12 3.42 1.37 0.00 0.45 -4.79 105.19 116.00 1iy6 n GLY 54 Ca 0.44 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 1iy6 n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1iy6 n LYS 55 N -1.35 0.35 0.00 1.61 4.81 -1.24 -2.10 118.16 120.24 1iy6 n LYS 55 Ca 0.00 0.15 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 1iy6 n LYS 55 Cb 0.00 -1.63 0.00 0.00 0.02 0.00 0.00 35.03 33.42 1iy6 n LYS 55 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57