#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 -3.80 0.00 -4.51 0.00 2.03 -1.26 -4.53 116.55 104.47 1l3y n ASP 3 Ca 0.00 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.89 1l3y n ASP 3 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 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 4.25 0.37 5.18 -4.23 -1.26 -4.88 115.64 115.07 1l3y s THR 4 Ca 0.00 -1.04 -0.11 0.00 -1.18 0.00 0.00 61.69 59.36 1l3y s THR 4 Cb 0.00 -4.93 0.03 0.00 1.34 0.00 0.00 72.50 68.95 1l3y s THR 4 CO 0.00 -1.75 0.67 0.27 -0.54 0.00 0.00 174.62 173.28 1l3y s ILE 5 N 4.04 0.00 -0.24 2.99 -0.00 -1.26 -5.03 121.20 121.71 1l3y s ILE 5 Ca 0.39 -1.22 -0.17 0.00 -0.00 0.00 0.00 60.65 59.65 1l3y s ILE 5 Cb -0.03 -2.77 0.07 0.00 -0.00 0.00 0.00 42.46 39.73 1l3y s ILE 5 CO -0.08 0.00 0.60 0.54 -0.00 0.00 0.00 174.94 176.00 1l3y s ASN 6 N -3.13 -0.72 0.39 4.36 6.03 -1.26 -5.05 114.94 115.55 1l3y s ASN 6 Ca 0.21 1.27 -0.28 0.00 -1.03 0.00 0.00 52.86 53.03 1l3y s ASN 6 Cb -0.03 1.21 -0.10 0.00 -3.03 0.00 0.00 41.25 39.29 1l3y s ASN 6 CO 0.15 -0.22 1.47 0.00 -2.03 0.00 0.00 177.10 176.47 1l3y s GLU 8 N -2.15 4.42 -0.16 0.00 2.02 -1.26 -4.93 118.70 116.64 1l3y s GLU 8 Ca 0.54 1.15 -0.06 0.00 0.02 0.00 0.00 54.97 56.62 1l3y s GLU 8 Cb -0.46 -3.51 -0.04 0.00 0.10 0.00 0.00 34.13 30.23 1l3y s GLU 8 CO 0.62 -0.16 0.04 1.03 0.02 0.00 0.00 175.26 176.81 1l3y s ARG 9 N 1.52 3.77 0.00 1.61 0.52 -1.26 0.78 118.95 125.88 1l3y s ARG 9 Ca 0.43 -0.36 0.00 0.00 -0.52 0.00 0.00 55.73 55.28 1l3y s ARG 9 Cb -0.18 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.18 1l3y s ARG 9 CO 0.18 0.36 0.00 2.48 0.02 0.00 0.00 175.30 178.35 1l3y n TYR 10 N 3.24 0.00 -2.87 -0.53 4.11 -0.62 -4.81 117.16 115.68 1l3y n TYR 10 Ca -0.17 0.00 -0.44 0.00 -0.00 0.00 0.00 57.90 57.29 1l3y n TYR 10 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.87 1l3y n TYR 10 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 1l3y n ASN 11 N 0.00 5.29 0.00 9.48 6.94 -1.26 -4.25 115.26 131.45 1l3y n ASN 11 Ca 0.00 -3.03 0.00 0.00 -0.02 0.00 0.00 54.58 51.53 1l3y n ASN 11 Cb 0.00 -1.52 0.00 0.00 -2.36 0.00 0.00 39.78 35.90 1l3y n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1l3y n GLY 12 N 3.52 1.38 0.00 4.83 0.00 -1.26 -5.07 105.19 108.59 1l3y n GLY 12 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 1l3y n GLY 12 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1l3y n GLN 13 N 0.00 0.00 -3.62 1.61 1.13 -1.26 -5.00 117.38 110.24 1l3y n GLN 13 Ca 0.00 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.66 1l3y n GLN 13 Cb 0.00 0.00 -0.11 0.00 0.11 0.00 0.00 30.24 30.24 1l3y n GLN 13 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1l3y s VAL 14 N -2.33 4.32 0.00 5.09 -7.23 -1.26 -1.59 120.40 117.40 1l3y s VAL 14 Ca 0.00 -1.11 0.00 0.00 -1.81 0.00 0.00 61.98 59.06 1l3y s VAL 14 Cb 0.00 -3.51 0.00 0.00 0.56 0.00 0.00 36.38 33.43 1l3y s VAL 14 CO 0.00 -0.33 0.00 0.00 -0.31 0.00 0.00 175.10 174.46 1l3y n GLY 16 N -0.53 -0.50 0.37 0.00 0.00 -1.26 -3.86 105.19 99.40 1l3y n GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.02 -3.52 0.41 -0.02 0.00 -1.25 -4.32 105.19 95.47 1l3y n GLY 17 Ca -0.25 -0.96 0.21 0.00 0.00 0.00 0.00 46.02 45.02 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 0.50 0.31 -0.19 1.61 0.11 -1.74 -0.32 132.00 132.28 1l3y h PRO 18 Ca 0.00 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.15 1l3y h PRO 18 Cb 0.00 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.03 1l3y h PRO 18 CO 0.00 0.21 0.41 0.78 -0.21 0.00 0.00 178.00 179.18 1l3y h GLY 19 N 0.32 0.00 0.00 -0.55 0.00 -1.93 -2.45 103.07 98.46 1l3y h GLY 19 Ca 0.45 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.59 1l3y h GLY 19 CO -0.14 0.00 -1.72 0.54 0.00 0.00 0.00 176.54 175.22 1l3y n ARG 20 N -3.24 1.00 -3.64 4.80 1.74 -0.18 -5.05 116.66 112.08 1l3y n ARG 20 Ca 0.02 0.05 -0.07 0.00 -0.77 0.00 0.00 57.85 57.08 1l3y n ARG 20 Cb 0.51 -1.26 -0.07 0.00 -1.02 0.00 0.00 32.46 30.62 1l3y n ARG 20 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1l3y s GLY 21 N -4.91 0.01 0.73 -0.13 0.00 -0.88 -2.55 107.32 99.59 1l3y s GLY 21 Ca -0.13 2.95 -0.01 0.00 0.00 0.00 0.00 44.72 47.53 1l3y s GLY 21 CO 0.33 1.88 1.00 1.04 0.00 0.00 0.00 173.10 177.35 1l3y n LEU 22 N 2.04 0.00 -4.31 0.66 7.99 -0.54 -3.86 117.00 118.98 1l3y n LEU 22 Ca -0.12 -2.03 -0.29 0.00 -0.01 0.00 0.00 56.01 53.56 1l3y n LEU 22 Cb 0.56 -0.66 -0.15 0.00 -0.11 0.00 0.00 43.42 43.07 1l3y n LEU 22 CO 0.02 -1.01 -0.56 0.00 -1.51 0.00 0.00 177.39 174.34 1l3y s PHE 24 N -0.73 1.44 -0.76 0.00 0.08 0.96 -4.78 117.98 114.19 1l3y s PHE 24 Ca 0.10 -1.50 -0.30 0.00 0.12 0.00 0.00 56.93 55.35 1l3y s PHE 24 Cb -0.10 -0.41 -0.19 0.00 -0.57 0.00 0.00 43.02 41.76 1l3y s PHE 24 CO 0.01 -1.01 2.23 0.00 -0.10 0.00 0.00 175.22 176.35 1l3y n GLY 26 N 5.89 2.45 3.41 0.00 0.00 -1.26 -3.51 105.19 112.16 1l3y n GLY 26 Ca 0.55 -0.56 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 0.90 -2.32 1.61 5.02 0.17 -4.78 118.16 118.76 1l3y n LYS 27 Ca 0.00 -2.36 -0.29 0.00 -2.02 0.00 0.00 58.31 53.65 1l3y n LYS 27 Cb 0.00 2.61 0.01 0.00 -0.02 0.00 0.00 35.03 37.63 1l3y n LYS 27 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l3y s ARG 29 N -4.94 0.35 0.28 0.00 3.52 0.33 -4.68 118.95 113.81 1l3y s ARG 29 Ca 0.51 -0.87 0.06 0.00 -0.13 0.00 0.00 55.73 55.30 1l3y s ARG 29 Cb -0.11 -1.20 -0.02 0.00 -1.56 0.00 0.00 34.95 32.06 1l3y s ARG 29 CO 0.48 -1.10 0.39 0.00 -0.81 0.00 0.00 175.30 174.26 1l3y s HIS 31 N -2.06 2.07 -0.19 0.00 0.09 -1.06 -4.87 115.29 109.27 1l3y s HIS 31 Ca 0.38 1.66 -0.28 0.00 -0.00 0.00 0.00 55.06 56.81 1l3y s HIS 31 Cb -0.09 -3.30 -0.05 0.00 -0.00 0.00 0.00 32.58 29.14 1l3y s HIS 31 CO 0.30 -2.40 2.07 -2.14 -0.00 0.00 0.00 174.74 172.56 1l3y s PRO 32 N -4.42 3.38 0.00 8.40 0.02 -1.26 -2.87 135.00 138.24 1l3y s PRO 32 Ca 0.68 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.70 1l3y s PRO 32 Cb -0.23 -4.29 0.00 0.00 0.02 0.00 0.00 34.50 30.00 1l3y s PRO 32 CO 0.52 -1.82 0.00 0.41 -0.33 0.00 0.00 177.00 175.78 1l3y n GLY 33 N 5.42 1.72 3.28 0.52 0.00 -1.26 -5.14 105.19 109.74 1l3y n GLY 33 Ca 0.26 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.00 1.75 0.00 1.61 0.08 -1.14 -4.96 117.98 113.32 1l3y s PHE 34 Ca 0.00 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.62 1l3y s PHE 34 Cb 0.00 -0.95 0.00 0.00 -0.57 0.00 0.00 43.02 41.50 1l3y s PHE 34 CO 0.00 0.21 0.00 0.39 -0.10 0.00 0.00 175.22 175.72 1l3y n GLU 35 N 1.02 0.00 0.00 0.44 1.02 -1.25 -4.89 120.64 116.98 1l3y n GLU 35 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 1l3y n GLU 35 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.96 1l3y n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1l3y n GLY 36 N 0.00 -0.59 0.31 0.62 0.00 -1.26 0.32 105.19 104.59 1l3y n GLY 36 Ca 0.00 -2.17 0.19 0.00 0.00 0.00 0.00 46.02 44.05 1l3y n GLY 36 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1l3y h SER 37 N 0.00 0.00 0.00 1.61 0.02 -1.99 -3.41 113.55 109.79 1l3y h SER 37 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1l3y h SER 37 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1l3y h SER 37 CO 0.00 0.02 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 1l3y n ALA 38 N -2.15 1.78 -2.65 3.77 0.00 -1.26 -4.85 120.51 115.16 1l3y n ALA 38 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.40 1l3y n ALA 38 Cb 0.13 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.69 1l3y n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l3y h GLN 40 N 1.16 0.05 -0.01 0.00 3.07 0.48 -3.38 115.11 116.48 1l3y h GLN 40 Ca -0.41 -0.09 0.00 0.00 0.09 0.00 0.00 58.65 58.24 1l3y h GLN 40 Cb 1.31 0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.90 1l3y h GLN 40 CO -0.14 0.78 0.00 0.00 0.09 0.00 0.00 178.83 179.56