#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nj3 n SER 2 N 0.00 -7.89 -1.29 1.61 2.88 -1.26 -5.07 113.62 102.61 1nj3 n SER 2 Ca 0.00 0.94 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1nj3 n SER 2 Cb 0.00 -5.30 0.00 0.00 -0.75 0.00 0.00 64.21 58.16 1nj3 n SER 2 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1nj3 n THR 3 N 0.16 0.00 0.00 2.46 5.66 -1.26 -5.11 114.28 116.18 1nj3 n THR 3 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1nj3 n THR 3 Cb 0.24 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.02 1nj3 n THR 3 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1nj3 n SER 4 N -1.61 0.00 -3.24 1.09 7.64 -1.26 -4.94 113.62 111.30 1nj3 n SER 4 Ca 0.00 0.30 0.02 0.00 1.01 0.00 0.00 58.87 60.20 1nj3 n SER 4 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1nj3 n SER 4 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nj3 s ALA 5 N -2.74 -2.11 1.07 -0.43 0.00 -1.26 -5.08 121.76 111.22 1nj3 s ALA 5 Ca 0.00 1.82 -0.16 0.00 0.00 0.00 0.00 51.96 53.61 1nj3 s ALA 5 Cb 0.00 -2.06 0.23 0.00 0.00 0.00 0.00 23.12 21.29 1nj3 s ALA 5 CO 0.00 -1.27 1.16 -1.64 0.00 0.00 0.00 175.76 174.02 1nj3 s MET 6 N 2.83 -0.20 0.09 0.00 1.00 -1.26 -3.91 119.30 117.85 1nj3 s MET 6 Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 55.69 55.84 1nj3 s MET 6 Cb -0.15 -1.71 -0.04 0.00 0.00 0.00 0.00 34.83 32.93 1nj3 s MET 6 CO -0.20 -3.04 -0.03 1.67 0.00 0.00 0.00 175.02 173.42 1nj3 s TRP 7 N -3.25 0.78 -0.26 -0.03 1.48 -0.04 -4.89 118.94 112.72 1nj3 s TRP 7 Ca 0.70 -1.03 -0.05 0.00 -1.06 0.00 0.00 56.10 54.65 1nj3 s TRP 7 Cb -0.10 -0.48 0.00 0.00 -1.16 0.00 0.00 33.47 31.73 1nj3 s TRP 7 CO 0.55 -0.30 0.02 0.00 -4.06 0.00 0.00 176.95 173.17 1nj3 s ALA 8 N -3.80 2.95 0.90 2.67 0.00 -1.26 -0.45 121.76 122.77 1nj3 s ALA 8 Ca 0.13 -1.34 -0.11 0.00 0.00 0.00 0.00 51.96 50.64 1nj3 s ALA 8 Cb 0.07 -1.95 0.13 0.00 0.00 0.00 0.00 23.12 21.37 1nj3 s ALA 8 CO -0.05 -0.73 1.10 0.00 0.00 0.00 0.00 175.76 176.08 1nj3 n GLN 10 N -4.01 2.27 0.13 0.00 3.00 -1.26 -4.02 117.38 113.49 1nj3 n GLN 10 Ca 0.09 -3.59 0.00 0.00 -0.01 0.00 0.00 57.00 53.49 1nj3 n GLN 10 Cb 0.53 -1.85 0.00 0.00 0.00 0.00 0.00 30.24 28.93 1nj3 n GLN 10 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 1nj3 n HIS 11 N -0.99 -2.27 0.04 1.08 -0.00 -1.26 -4.87 115.22 106.96 1nj3 n HIS 11 Ca 0.28 0.40 -0.05 0.00 0.46 0.00 0.00 57.72 58.81 1nj3 n HIS 11 Cb 0.79 0.53 -0.10 0.00 -0.12 0.00 0.00 29.99 31.09 1nj3 n HIS 11 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1nj3 n THR 13 N -3.14 -1.16 -4.52 0.00 -2.24 -1.26 -5.06 114.28 96.90 1nj3 n THR 13 Ca -0.07 -0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.43 1nj3 n THR 13 Cb 0.93 -2.50 -0.11 0.00 -2.10 0.00 0.00 70.33 66.55 1nj3 n THR 13 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1nj3 s PHE 14 N -3.11 2.25 0.32 4.78 5.36 -1.26 -4.90 117.98 121.42 1nj3 s PHE 14 Ca 0.16 -0.64 -0.16 0.00 -0.96 0.00 0.00 56.93 55.33 1nj3 s PHE 14 Cb -0.07 -1.37 -0.09 0.00 -0.34 0.00 0.00 43.02 41.15 1nj3 s PHE 14 CO 0.24 0.41 0.75 1.41 -1.46 0.00 0.00 175.22 176.57 1nj3 s MET 15 N -3.69 4.04 0.03 10.12 -2.45 -1.26 -1.95 119.30 124.14 1nj3 s MET 15 Ca 0.32 0.71 0.00 0.00 -1.25 0.00 0.00 55.69 55.48 1nj3 s MET 15 Cb 0.05 -2.46 -0.02 0.00 1.25 0.00 0.00 34.83 33.64 1nj3 s MET 15 CO 0.15 0.17 -0.03 1.21 1.05 0.00 0.00 175.02 177.57 1nj3 s ASN 16 N -2.21 0.34 0.91 1.11 3.84 0.41 -4.93 114.94 114.41 1nj3 s ASN 16 Ca 0.53 -0.57 -0.11 0.00 0.21 0.00 0.00 52.86 52.92 1nj3 s ASN 16 Cb -0.11 0.11 0.14 0.00 -0.55 0.00 0.00 41.25 40.84 1nj3 s ASN 16 CO 0.18 -0.33 1.10 -1.10 -2.79 0.00 0.00 177.10 174.15 1nj3 s GLN 17 N -1.81 1.13 0.00 0.43 -1.52 -1.26 -0.86 119.66 115.77 1nj3 s GLN 17 Ca -0.12 1.10 0.20 0.00 -1.95 0.00 0.00 55.36 54.58 1nj3 s GLN 17 Cb -0.08 -1.77 0.92 0.00 -0.22 0.00 0.00 33.01 31.86 1nj3 s GLN 17 CO -0.02 -2.41 1.63 -0.35 -0.25 0.00 0.00 175.29 173.89 1nj3 n PRO 18 N -4.03 0.13 -0.00 2.91 -0.04 -1.25 -2.89 135.00 129.83 1nj3 n PRO 18 Ca 0.08 0.13 0.05 0.00 -0.04 0.00 0.00 63.50 63.73 1nj3 n PRO 18 Cb 0.54 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.43 1nj3 n PRO 18 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nj3 n GLY 19 N 0.48 -0.17 2.55 0.55 0.00 -1.26 -4.68 105.19 102.66 1nj3 n GLY 19 Ca 0.07 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.41 1nj3 n GLY 19 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nj3 n THR 20 N -1.45 5.33 -0.51 2.61 -2.24 -1.14 -4.77 114.28 112.10 1nj3 n THR 20 Ca 0.01 -4.76 0.44 0.00 -2.27 0.00 0.00 64.05 57.46 1nj3 n THR 20 Cb 0.21 -1.83 0.78 0.00 -2.10 0.00 0.00 70.33 67.38 1nj3 n THR 20 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1nj3 h GLY 21 N 4.91 0.11 0.00 3.38 0.00 -1.83 -3.29 103.07 106.35 1nj3 h GLY 21 Ca 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.94 1nj3 h GLY 21 CO 1.33 -0.03 0.00 1.42 0.00 0.00 0.00 176.54 179.26 1nj3 n HIS 22 N -4.11 0.00 0.00 5.60 8.25 -1.25 0.11 115.22 123.82 1nj3 n HIS 22 Ca 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.81 1nj3 n HIS 22 Cb 1.61 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.72 1nj3 n HIS 22 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nj3 n GLU 24 N -0.28 2.99 0.09 0.00 -0.58 -1.26 -3.80 120.64 117.81 1nj3 n GLU 24 Ca 0.00 -3.06 0.00 0.00 -0.42 0.00 0.00 57.16 53.68 1nj3 n GLU 24 Cb 0.00 -2.07 0.00 0.00 -0.57 0.00 0.00 31.44 28.80 1nj3 n GLU 24 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1nj3 n MET 25 N -0.56 0.00 -0.07 3.49 2.81 -1.26 -4.94 117.12 116.58 1nj3 n MET 25 Ca 0.39 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 56.12 1nj3 n MET 25 Cb 1.27 -0.11 -0.13 0.00 -0.71 0.00 0.00 33.22 33.54 1nj3 n MET 25 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nj3 n SER 27 N -4.55 -0.30 -4.60 0.00 2.88 -1.25 -5.06 113.62 100.75 1nj3 n SER 27 Ca -0.14 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.12 1nj3 n SER 27 Cb 0.53 -0.10 -0.11 0.00 -0.75 0.00 0.00 64.21 63.79 1nj3 n SER 27 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1nj3 s LEU 28 N -0.11 2.71 0.67 2.46 1.43 -1.26 -4.88 118.68 119.71 1nj3 s LEU 28 Ca 0.00 -1.40 -0.11 0.00 -1.03 0.00 0.00 54.13 51.59 1nj3 s LEU 28 Cb 0.00 -0.79 -0.01 0.00 0.03 0.00 0.00 46.19 45.42 1nj3 s LEU 28 CO 0.00 -0.51 1.06 -2.16 0.23 0.00 0.00 176.35 174.97 1nj3 s PRO 29 N -3.75 3.13 0.00 1.29 0.04 -1.26 -2.90 135.00 131.54 1nj3 s PRO 29 Ca 0.33 0.66 0.16 0.00 0.04 0.00 0.00 61.00 62.19 1nj3 s PRO 29 Cb 0.09 -2.03 0.71 0.00 0.04 0.00 0.00 34.50 33.30 1nj3 s PRO 29 CO 0.16 -0.89 1.51 -2.13 0.04 0.00 0.00 177.00 175.70 1nj3 n ARG 30 N -2.95 0.03 0.00 4.56 0.63 0.30 -4.83 116.66 114.40 1nj3 n ARG 30 Ca 0.07 0.21 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 1nj3 n ARG 30 Cb 0.55 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.96 1nj3 n ARG 30 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53