#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3y n ASP 3 N -2.36 0.00 -4.62 0.00 2.03 -1.26 -4.75 116.55 105.59 1l3y n ASP 3 Ca -0.01 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.88 1l3y n ASP 3 Cb 0.02 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.38 1l3y n ASP 3 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1l3y s THR 4 N 0.00 4.71 -0.48 5.18 -4.23 -1.26 -4.77 115.64 114.79 1l3y s THR 4 Ca 0.00 1.39 0.06 0.00 -1.18 0.00 0.00 61.69 61.96 1l3y s THR 4 Cb 0.00 -4.23 0.22 0.00 1.34 0.00 0.00 72.50 69.83 1l3y s THR 4 CO 0.00 -0.31 0.73 2.30 -0.54 0.00 0.00 174.62 176.80 1l3y n ILE 5 N 5.61 -0.22 -3.03 2.99 -0.00 -1.26 -5.04 119.36 118.41 1l3y n ILE 5 Ca 0.06 -1.86 -0.39 0.00 -0.00 0.00 0.00 62.75 60.56 1l3y n ILE 5 Cb 0.48 0.55 -0.06 0.00 -0.00 0.00 0.00 39.64 40.61 1l3y n ILE 5 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1l3y s ASN 6 N -0.60 7.31 0.48 7.28 2.20 -1.26 -4.44 114.94 125.91 1l3y s ASN 6 Ca 0.32 1.57 0.08 0.00 -0.94 0.00 0.00 52.86 53.89 1l3y s ASN 6 Cb 0.13 -2.47 0.08 0.00 -2.00 0.00 0.00 41.25 36.98 1l3y s ASN 6 CO -0.16 0.19 0.66 0.00 -2.94 0.00 0.00 177.10 174.85 1l3y s GLU 8 N -4.17 3.81 0.26 0.00 8.01 -1.26 -4.52 118.70 120.83 1l3y s GLU 8 Ca 0.50 1.94 0.07 0.00 0.01 0.00 0.00 54.97 57.49 1l3y s GLU 8 Cb -0.04 -2.54 -0.03 0.00 -4.31 0.00 0.00 34.13 27.21 1l3y s GLU 8 CO 0.32 -0.56 0.23 -0.98 0.01 0.00 0.00 175.26 174.28 1l3y s ARG 9 N -2.51 2.96 0.00 1.61 3.03 -1.26 0.15 118.95 122.94 1l3y s ARG 9 Ca 0.61 -1.05 0.00 0.00 2.03 0.00 0.00 55.73 57.32 1l3y s ARG 9 Cb -0.33 -2.59 0.00 0.00 -1.03 0.00 0.00 34.95 31.00 1l3y s ARG 9 CO 0.41 0.36 0.00 2.48 -1.13 0.00 0.00 175.30 177.42 1l3y n TYR 10 N -1.24 0.00 -2.83 5.89 0.18 -0.76 -4.60 117.16 113.80 1l3y n TYR 10 Ca -0.07 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.60 1l3y n TYR 10 Cb 0.58 0.00 0.05 0.00 -0.38 0.00 0.00 39.34 39.59 1l3y n TYR 10 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 1l3y n ASN 11 N -0.82 -1.80 -2.10 9.48 2.85 -1.26 -4.79 115.26 116.82 1l3y n ASN 11 Ca 0.00 -3.47 -0.19 0.00 -0.11 0.00 0.00 54.58 50.82 1l3y n ASN 11 Cb 0.00 1.36 -0.03 0.00 1.24 0.00 0.00 39.78 42.35 1l3y n ASN 11 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1l3y n GLY 12 N 0.65 0.32 3.42 8.20 0.00 -1.26 -4.79 105.19 111.74 1l3y n GLY 12 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 1l3y n GLY 12 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1l3y s GLN 13 N -4.52 0.50 -0.22 1.61 -0.21 -1.26 -4.97 119.66 110.59 1l3y s GLN 13 Ca 0.00 1.03 -0.37 0.00 0.02 0.00 0.00 55.36 56.04 1l3y s GLN 13 Cb 0.00 0.17 -0.14 0.00 1.00 0.00 0.00 33.01 34.05 1l3y s GLN 13 CO 0.00 -0.17 1.86 1.33 -2.12 0.00 0.00 175.29 176.19 1l3y n VAL 14 N 4.58 0.40 -3.11 1.09 0.24 -1.26 0.17 118.33 120.45 1l3y n VAL 14 Ca -0.19 -0.10 -0.13 0.00 -2.04 0.00 0.00 64.34 61.88 1l3y n VAL 14 Cb 0.55 -1.54 0.07 0.00 -1.47 0.00 0.00 33.84 31.45 1l3y n VAL 14 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l3y n GLY 16 N -1.10 0.00 0.00 0.00 0.00 0.46 -3.95 105.19 100.60 1l3y n GLY 16 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1l3y n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3y n GLY 17 N -0.82 1.41 0.19 -0.02 0.00 -1.22 -4.72 105.19 100.02 1l3y n GLY 17 Ca 0.00 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.51 1l3y n GLY 17 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1l3y h PRO 18 N 0.00 0.00 -0.82 1.61 0.11 -1.71 -2.86 132.00 128.33 1l3y h PRO 18 Ca 0.00 0.00 0.20 0.00 0.11 0.00 0.00 66.00 66.31 1l3y h PRO 18 Cb 0.00 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 30.98 1l3y h PRO 18 CO 0.00 0.00 0.16 0.78 -0.21 0.00 0.00 178.00 178.73 1l3y h GLY 19 N 0.37 1.14 0.00 -0.55 0.00 -1.85 -3.11 103.07 99.07 1l3y h GLY 19 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 1l3y h GLY 19 CO 0.00 -0.31 -2.29 0.54 0.00 0.00 0.00 176.54 174.48 1l3y n ARG 20 N -5.24 0.53 -3.61 4.80 3.00 -1.16 -4.97 116.66 110.01 1l3y n ARG 20 Ca 0.18 0.17 -0.15 0.00 -0.01 0.00 0.00 57.85 58.03 1l3y n ARG 20 Cb 0.57 -1.40 -0.07 0.00 0.00 0.00 0.00 32.46 31.56 1l3y n ARG 20 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1l3y s GLY 21 N -5.85 -0.49 -0.02 -0.13 0.00 -1.09 -1.77 107.32 97.96 1l3y s GLY 21 Ca -0.31 1.48 0.02 0.00 0.00 0.00 0.00 44.72 45.91 1l3y s GLY 21 CO 0.47 1.19 -0.09 0.48 0.00 0.00 0.00 173.10 175.16 1l3y s LEU 22 N -0.41 1.78 -0.19 0.66 2.34 -1.10 -3.04 118.68 118.72 1l3y s LEU 22 Ca -0.06 -0.18 -0.13 0.00 0.06 0.00 0.00 54.13 53.83 1l3y s LEU 22 Cb -0.03 -0.52 -0.05 0.00 -0.56 0.00 0.00 46.19 45.03 1l3y s LEU 22 CO 0.05 0.06 0.24 0.00 -1.06 0.00 0.00 176.35 175.64 1l3y n PHE 24 N 3.77 0.00 -0.37 0.00 1.16 0.37 -4.84 117.46 117.55 1l3y n PHE 24 Ca -0.13 0.00 -0.07 0.00 -1.87 0.00 0.00 57.45 55.38 1l3y n PHE 24 Cb 0.52 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.34 1l3y n PHE 24 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1l3y n GLY 26 N 1.44 1.99 0.00 0.00 0.00 -1.26 -4.97 105.19 102.39 1l3y n GLY 26 Ca 0.16 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1l3y n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l3y n LYS 27 N 0.00 0.00 -3.16 1.61 4.01 0.69 -4.82 118.16 116.49 1l3y n LYS 27 Ca 0.00 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.38 1l3y n LYS 27 Cb 0.00 0.00 -0.07 0.00 -0.51 0.00 0.00 35.03 34.45 1l3y n LYS 27 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1l3y s ARG 29 N 2.63 3.41 0.30 0.00 0.52 0.56 -4.75 118.95 121.62 1l3y s ARG 29 Ca 0.21 -1.09 -0.02 0.00 -0.52 0.00 0.00 55.73 54.31 1l3y s ARG 29 Cb -0.15 -4.75 -0.04 0.00 0.52 0.00 0.00 34.95 30.53 1l3y s ARG 29 CO 0.16 -1.98 0.53 0.00 0.02 0.00 0.00 175.30 174.04 1l3y s HIS 31 N -2.16 3.53 0.03 0.00 0.09 -0.73 -4.98 115.29 111.08 1l3y s HIS 31 Ca 0.42 1.18 -0.32 0.00 -0.00 0.00 0.00 55.06 56.34 1l3y s HIS 31 Cb -0.10 -2.59 -0.11 0.00 -0.00 0.00 0.00 32.58 29.78 1l3y s HIS 31 CO 0.33 -0.37 1.86 -2.30 -0.00 0.00 0.00 174.74 174.25 1l3y n PRO 32 N -1.97 2.53 -0.66 8.40 -0.02 -1.26 -3.36 135.00 138.67 1l3y n PRO 32 Ca 0.04 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1l3y n PRO 32 Cb 0.54 -2.81 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 1l3y n PRO 32 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l3y n GLY 33 N 4.29 0.52 2.98 -1.23 0.00 -1.26 -5.12 105.19 105.37 1l3y n GLY 33 Ca 0.20 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1l3y n GLY 33 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l3y s PHE 34 N -1.70 0.26 0.00 1.61 0.08 -1.21 -4.77 117.98 112.25 1l3y s PHE 34 Ca 0.00 -0.53 0.00 0.00 0.12 0.00 0.00 56.93 56.52 1l3y s PHE 34 Cb 0.00 -0.19 0.00 0.00 -0.57 0.00 0.00 43.02 42.26 1l3y s PHE 34 CO 0.00 -0.19 0.00 0.39 -0.10 0.00 0.00 175.22 175.32 1l3y n GLU 35 N 1.59 0.00 0.00 0.44 -0.58 -1.24 -4.76 120.64 116.08 1l3y n GLU 35 Ca -0.24 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.50 1l3y n GLU 35 Cb 0.55 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.42 1l3y n GLU 35 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l3y n GLY 36 N 0.00 1.88 0.45 0.62 0.00 -1.26 0.10 105.19 106.98 1l3y n GLY 36 Ca 0.00 -0.49 0.13 0.00 0.00 0.00 0.00 46.02 45.66 1l3y n GLY 36 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1l3y n SER 37 N -1.31 1.51 0.00 1.61 7.64 -1.26 -4.72 113.62 117.09 1l3y n SER 37 Ca 0.00 -1.36 0.00 0.00 1.01 0.00 0.00 58.87 58.52 1l3y n SER 37 Cb 0.00 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 1l3y n SER 37 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1l3y n ALA 38 N 0.02 1.15 -2.70 -0.43 0.00 -0.76 -4.59 120.51 113.20 1l3y n ALA 38 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.56 1l3y n ALA 38 Cb 0.38 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.94 1l3y n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l3y n GLN 40 N -0.94 0.68 0.00 0.00 10.64 -0.84 -4.12 117.38 122.80 1l3y n GLN 40 Ca -0.07 0.13 0.15 0.00 -1.83 0.00 0.00 57.00 55.38 1l3y n GLN 40 Cb 0.86 -1.57 0.75 0.00 -0.86 0.00 0.00 30.24 29.41 1l3y n GLN 40 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23