#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t1k n VAL 2 N 0.00 0.00 -2.63 -2.13 0.24 -1.26 -4.81 118.33 107.75 1t1k n VAL 2 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 1t1k n VAL 2 Cb 0.00 -0.56 0.00 0.00 -1.47 0.00 0.00 33.84 31.81 1t1k n VAL 2 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1t1k n ASN 3 N -4.51 4.98 -4.41 -1.34 4.13 -1.26 -4.96 115.26 107.89 1t1k n ASN 3 Ca 0.08 -2.96 -0.16 0.00 1.68 0.00 0.00 54.58 53.22 1t1k n ASN 3 Cb 0.34 -1.63 0.05 0.00 -1.54 0.00 0.00 39.78 37.00 1t1k n ASN 3 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1t1k n GLN 4 N 6.48 0.69 -3.34 3.52 6.02 -1.26 -5.08 117.38 124.40 1t1k n GLN 4 Ca 0.43 -2.59 -0.39 0.00 -0.01 0.00 0.00 57.00 54.44 1t1k n GLN 4 Cb 0.43 -0.16 -0.08 0.00 1.02 0.00 0.00 30.24 31.45 1t1k n GLN 4 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1t1k s HIS 5 N -1.98 3.33 -0.62 1.08 3.76 -1.26 -5.03 115.29 114.57 1t1k s HIS 5 Ca 0.48 0.61 -0.14 0.00 -0.15 0.00 0.00 55.06 55.86 1t1k s HIS 5 Cb -0.04 -2.59 0.16 0.00 1.11 0.00 0.00 32.58 31.22 1t1k s HIS 5 CO 0.31 -0.10 0.56 -0.51 -0.85 0.00 0.00 174.74 174.14 1t1k s LEU 6 N 1.65 6.27 -0.10 0.89 1.43 -1.26 -4.73 118.68 122.83 1t1k s LEU 6 Ca 0.19 -2.12 0.03 0.00 -1.03 0.00 0.00 54.13 51.20 1t1k s LEU 6 Cb -0.15 -2.17 0.01 0.00 0.03 0.00 0.00 46.19 43.90 1t1k s LEU 6 CO 0.09 -0.74 -0.18 0.00 0.23 0.00 0.00 176.35 175.75 1t1k n GLY 8 N 3.89 1.31 0.00 0.00 0.00 -1.26 -1.56 105.19 107.57 1t1k n GLY 8 Ca -0.20 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1t1k n GLY 8 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t1k n SER 9 N 3.14 0.00 -0.24 1.61 7.64 -1.26 -0.32 113.62 124.19 1t1k n SER 9 Ca 0.00 0.96 0.04 0.00 1.01 0.00 0.00 58.87 60.88 1t1k n SER 9 Cb 0.00 -0.46 0.16 0.00 -1.01 0.00 0.00 64.21 62.90 1t1k n SER 9 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1t1k h ASP 10 N 0.00 0.05 -0.71 6.43 3.32 -1.63 0.38 116.42 124.27 1t1k h ASP 10 Ca 0.00 0.13 0.12 0.00 0.02 0.00 0.00 57.03 57.30 1t1k h ASP 10 Cb 0.00 0.17 -0.13 0.00 0.22 0.00 0.00 39.33 39.59 1t1k h ASP 10 CO 0.00 -0.00 -0.34 0.25 -1.72 0.00 0.00 179.24 177.43 1t1k h LEU 11 N 0.29 -1.19 0.53 1.55 5.85 -0.45 2.12 115.31 124.01 1t1k h LEU 11 Ca 0.39 0.25 -0.03 0.00 0.84 0.00 0.00 57.88 59.33 1t1k h LEU 11 Cb 0.64 0.61 0.01 0.00 0.37 0.00 0.00 40.66 42.29 1t1k h LEU 11 CO -0.47 -0.30 -0.25 0.00 -0.34 0.00 0.00 178.44 177.08 1t1k h ALA 12 N 1.16 -0.71 -1.45 1.25 0.00 0.16 -1.12 119.26 118.56 1t1k h ALA 12 Ca 0.27 -0.16 0.42 0.00 0.00 0.00 0.00 54.91 55.44 1t1k h ALA 12 Cb 0.56 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 1t1k h ALA 12 CO -0.77 -0.66 1.07 1.49 0.00 0.00 0.00 179.25 180.37 1t1k h GLU 13 N -1.17 0.00 0.07 0.00 4.57 0.51 2.63 114.58 121.19 1t1k h GLU 13 Ca -0.07 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1t1k h GLU 13 Cb 0.56 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1t1k h GLU 13 CO 0.12 0.00 -0.03 0.00 -1.18 0.00 0.00 179.01 177.92 1t1k h ALA 14 N 1.23 -0.09 0.00 2.92 0.00 0.37 -2.60 119.26 121.08 1t1k h ALA 14 Ca 0.69 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 1t1k h ALA 14 Cb 2.81 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 20.63 1t1k h ALA 14 CO -0.01 -0.14 -0.28 -0.07 0.00 0.00 0.00 179.25 178.75 1t1k h LEU 15 N -0.91 0.00 -1.59 0.00 3.38 0.92 -1.62 115.31 115.50 1t1k h LEU 15 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1t1k h LEU 15 Cb 0.59 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1t1k h LEU 15 CO 0.02 0.28 -0.15 0.22 0.09 0.00 0.00 178.44 178.90 1t1k h TYR 16 N 0.00 0.00 -0.01 1.13 5.03 0.43 -0.57 116.97 122.98 1t1k h TYR 16 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1t1k h TYR 16 Cb 0.58 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.86 1t1k h TYR 16 CO 0.00 0.15 -0.49 -0.11 -1.32 0.00 0.00 178.16 176.39 1t1k n LEU 17 N -3.47 1.93 -0.10 2.82 7.94 -0.66 -2.82 117.00 122.65 1t1k n LEU 17 Ca -0.01 -0.75 -0.13 0.00 -1.11 0.00 0.00 56.01 54.01 1t1k n LEU 17 Cb 0.32 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.18 1t1k n LEU 17 CO 0.31 0.36 -1.12 1.33 -1.11 0.00 0.00 177.39 177.16 1t1k n VAL 18 N -0.11 1.09 -0.09 1.96 0.24 -0.91 -4.74 118.33 115.77 1t1k n VAL 18 Ca 0.09 -0.41 -0.11 0.00 -2.04 0.00 0.00 64.34 61.86 1t1k n VAL 18 Cb 0.45 -1.20 -0.10 0.00 -1.47 0.00 0.00 33.84 31.52 1t1k n VAL 18 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t1k n GLY 20 N 2.39 3.27 0.00 0.00 0.00 -1.13 -1.27 105.19 108.45 1t1k n GLY 20 Ca -0.31 -0.15 0.16 0.00 0.00 0.00 0.00 46.02 45.72 1t1k n GLY 20 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1t1k n GLU 21 N 13.22 0.84 0.34 1.61 0.28 -1.26 -3.50 120.64 132.17 1t1k n GLU 21 Ca 0.00 0.00 0.21 0.00 -0.16 0.00 0.00 57.16 57.21 1t1k n GLU 21 Cb 0.00 -1.50 1.14 0.00 1.43 0.00 0.00 31.44 32.51 1t1k n GLU 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1t1k h ARG 22 N 0.00 0.00 -1.74 3.44 2.47 -1.58 -3.47 114.38 113.50 1t1k h ARG 22 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1t1k h ARG 22 Cb 0.08 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.40 1t1k h ARG 22 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.94 1t1k n GLY 23 N -1.11 -2.27 3.16 0.04 0.00 -1.23 -5.06 105.19 98.73 1t1k n GLY 23 Ca -0.03 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 1t1k n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1t1k s PHE 24 N 0.00 2.23 -0.12 1.61 -0.71 -1.26 -5.03 117.98 114.69 1t1k s PHE 24 Ca 0.00 -0.90 -0.07 0.00 -1.04 0.00 0.00 56.93 54.93 1t1k s PHE 24 Cb 0.00 -1.52 -0.04 0.00 -1.21 0.00 0.00 43.02 40.25 1t1k s PHE 24 CO 0.00 -0.38 0.13 -0.59 -1.34 0.00 0.00 175.22 173.04 1t1k s PHE 25 N 0.44 3.56 -0.35 3.49 -0.12 -1.26 -5.01 117.98 118.73 1t1k s PHE 25 Ca -0.18 0.50 0.15 0.00 -0.05 0.00 0.00 56.93 57.35 1t1k s PHE 25 Cb -0.17 -1.93 0.44 0.00 -0.63 0.00 0.00 43.02 40.72 1t1k s PHE 25 CO 0.07 0.71 0.95 2.48 -0.05 0.00 0.00 175.22 179.39 1t1k n TYR 26 N 2.02 1.49 -0.79 3.49 4.11 -1.26 -5.12 117.16 121.11 1t1k n TYR 26 Ca -0.20 -2.97 -0.26 0.00 -0.00 0.00 0.00 57.90 54.47 1t1k n TYR 26 Cb 0.55 -0.34 0.02 0.00 -0.00 0.00 0.00 39.34 39.57 1t1k n TYR 26 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1t1k n THR 27 N -0.10 0.00 -0.87 -3.48 -2.24 -1.26 -4.84 114.28 101.49 1t1k n THR 27 Ca 0.16 -0.35 -0.30 0.00 -2.27 0.00 0.00 64.05 61.28 1t1k n THR 27 Cb 0.77 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 69.16 1t1k n THR 27 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1t1k s LYS 28 N -1.07 1.05 -0.05 -0.78 3.01 -1.26 -4.95 119.74 115.70 1t1k s LYS 28 Ca 0.34 1.27 -0.30 0.00 -1.01 0.00 0.00 55.97 56.27 1t1k s LYS 28 Cb -0.23 -1.75 -0.03 0.00 -1.01 0.00 0.00 37.83 34.81 1t1k s LYS 28 CO 0.53 -2.51 1.11 -1.25 0.51 0.00 0.00 175.35 173.74 1t1k s PRO 29 N -4.72 4.41 0.00 -1.68 0.04 -1.26 -5.32 135.00 126.47 1t1k s PRO 29 Ca 0.65 1.57 0.01 0.00 0.04 0.00 0.00 61.00 63.27 1t1k s PRO 29 Cb -0.21 -3.51 0.01 0.00 0.04 0.00 0.00 34.50 30.82 1t1k s PRO 29 CO 0.58 -0.33 0.53 0.25 0.04 0.00 0.00 177.00 178.08