#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b2g n VAL 2 N 0.00 0.13 -2.22 1.97 0.24 -1.26 -4.63 118.33 112.56 1b2g n VAL 2 Ca 0.00 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.34 61.71 1b2g n VAL 2 Cb 0.00 0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1b2g n VAL 2 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1b2g n ASN 3 N -1.83 5.42 -2.63 -1.34 3.02 -1.26 -4.85 115.26 111.79 1b2g n ASN 3 Ca 0.03 -3.08 -0.04 0.00 -0.03 0.00 0.00 54.58 51.45 1b2g n ASN 3 Cb 0.41 -1.48 0.02 0.00 -0.61 0.00 0.00 39.78 38.12 1b2g n ASN 3 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b2g n GLN 4 N 3.77 0.69 -2.62 3.52 10.64 -1.26 -5.12 117.38 126.99 1b2g n GLN 4 Ca 0.44 -1.44 -0.43 0.00 -1.83 0.00 0.00 57.00 53.75 1b2g n GLN 4 Cb 0.35 1.86 -0.02 0.00 -0.86 0.00 0.00 30.24 31.57 1b2g n GLN 4 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 1b2g s HIS 5 N -3.23 3.23 -0.23 2.61 3.76 -1.26 -5.00 115.29 115.16 1b2g s HIS 5 Ca 0.16 1.35 0.02 0.00 -0.15 0.00 0.00 55.06 56.44 1b2g s HIS 5 Cb -0.03 -3.38 0.05 0.00 1.11 0.00 0.00 32.58 30.32 1b2g s HIS 5 CO 0.07 -0.72 -0.14 -0.51 -0.85 0.00 0.00 174.74 172.59 1b2g s LEU 6 N 3.34 2.97 0.08 0.89 1.43 -1.26 -5.03 118.68 121.10 1b2g s LEU 6 Ca 0.46 -1.13 0.07 0.00 -1.03 0.00 0.00 54.13 52.50 1b2g s LEU 6 Cb -0.15 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 1b2g s LEU 6 CO 0.09 -0.12 -0.19 0.00 0.23 0.00 0.00 176.35 176.36 1b2g n GLY 8 N 1.28 3.40 0.28 0.00 0.00 -1.26 -1.93 105.19 106.95 1b2g n GLY 8 Ca -0.20 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 45.84 1b2g n GLY 8 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1b2g h SER 9 N 0.71 0.00 -0.57 1.61 4.64 -1.99 -1.48 113.55 116.48 1b2g h SER 9 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 1b2g h SER 9 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1b2g h SER 9 CO 0.00 0.04 -0.02 -0.74 -0.87 0.00 0.00 176.83 175.24 1b2g h HIS 10 N 0.00 1.13 -0.18 4.77 -0.00 -1.77 -0.43 115.15 118.67 1b2g h HIS 10 Ca -0.00 -0.20 -0.11 0.00 -0.00 0.00 0.00 60.37 60.07 1b2g h HIS 10 Cb 0.08 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.20 1b2g h HIS 10 CO 0.00 1.00 -0.31 1.25 -0.00 0.00 0.00 177.93 179.87 1b2g h LEU 11 N 0.94 0.58 -1.01 0.26 5.85 -1.28 -2.24 115.31 118.42 1b2g h LEU 11 Ca 0.17 -0.54 0.01 0.00 0.84 0.00 0.00 57.88 58.36 1b2g h LEU 11 Cb 0.57 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1b2g h LEU 11 CO 0.03 1.01 0.67 0.58 -0.34 0.00 0.00 178.44 180.39 1b2g h VAL 12 N 0.18 1.25 -0.38 1.05 2.07 -1.30 -1.44 116.25 117.69 1b2g h VAL 12 Ca 0.01 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 1b2g h VAL 12 Cb 0.90 -0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1b2g h VAL 12 CO 0.07 0.25 0.13 -0.08 0.02 0.00 0.00 177.57 177.96 1b2g h GLU 13 N 1.36 0.58 -0.32 1.57 4.81 -1.02 -1.50 114.58 120.06 1b2g h GLU 13 Ca 0.37 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.51 1b2g h GLU 13 Cb -0.15 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 1b2g h GLU 13 CO -0.08 0.58 0.15 0.00 -0.73 0.00 0.00 179.01 178.92 1b2g h ALA 14 N 0.97 0.38 -0.94 2.92 0.00 -0.89 -0.78 119.26 120.93 1b2g h ALA 14 Ca 0.12 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1b2g h ALA 14 Cb 0.23 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1b2g h ALA 14 CO -0.01 -0.24 0.62 -0.07 0.00 0.00 0.00 179.25 179.56 1b2g h LEU 15 N 0.31 1.08 -0.38 0.00 3.38 -1.15 -0.08 115.31 118.47 1b2g h LEU 15 Ca 0.14 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1b2g h LEU 15 Cb 0.06 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1b2g h LEU 15 CO -0.11 0.78 0.21 0.22 0.09 0.00 0.00 178.44 179.63 1b2g h TYR 16 N 1.27 0.53 -0.37 1.13 3.20 -0.69 -0.46 116.97 121.58 1b2g h TYR 16 Ca 0.35 -0.01 -0.15 0.00 3.14 0.00 0.00 58.73 62.05 1b2g h TYR 16 Cb -0.14 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 1b2g h TYR 16 CO -0.01 0.41 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.49 1b2g h LEU 17 N 0.49 0.96 -0.03 2.82 3.38 -0.77 -2.83 115.31 119.34 1b2g h LEU 17 Ca 0.13 -0.47 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 1b2g h LEU 17 Cb 0.06 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.55 1b2g h LEU 17 CO -0.02 1.23 -0.54 0.58 0.09 0.00 0.00 178.44 179.79 1b2g h VAL 18 N 0.71 1.42 0.00 1.22 2.07 -0.97 -3.35 116.25 117.36 1b2g h VAL 18 Ca 0.06 -1.99 -0.15 0.00 0.82 0.00 0.00 66.70 65.44 1b2g h VAL 18 Cb 0.96 2.51 -0.02 0.00 -1.52 0.00 0.00 31.29 33.22 1b2g h VAL 18 CO 0.09 0.58 -0.72 0.00 0.02 0.00 0.00 177.57 177.54 1b2g n GLY 20 N 0.70 3.23 0.11 0.00 0.00 -1.07 -2.20 105.19 105.97 1b2g n GLY 20 Ca -0.00 -0.25 0.09 0.00 0.00 0.00 0.00 46.02 45.86 1b2g n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b2g n GLU 21 N 14.00 0.13 0.07 1.61 -0.58 -1.26 -1.82 120.64 132.79 1b2g n GLU 21 Ca 0.00 0.49 -0.03 0.00 -0.42 0.00 0.00 57.16 57.20 1b2g n GLU 21 Cb 0.00 -1.81 0.19 0.00 -0.57 0.00 0.00 31.44 29.25 1b2g n GLU 21 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1b2g h ARG 22 N 0.00 0.30 0.00 3.49 3.08 -1.85 -3.49 114.38 115.91 1b2g h ARG 22 Ca 0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1b2g h ARG 22 Cb 0.17 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 1b2g h ARG 22 CO 0.00 0.67 -0.00 0.41 -1.07 0.00 0.00 179.97 179.98 1b2g n GLY 23 N -0.12 -2.19 3.83 0.04 0.00 -0.76 -5.06 105.19 100.93 1b2g n GLY 23 Ca -0.02 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.46 1b2g n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b2g s PHE 24 N -0.56 0.01 -0.06 1.61 -0.71 -1.26 -4.79 117.98 112.22 1b2g s PHE 24 Ca 0.00 -0.51 0.03 0.00 -1.04 0.00 0.00 56.93 55.41 1b2g s PHE 24 Cb 0.00 0.75 0.01 0.00 -1.21 0.00 0.00 43.02 42.57 1b2g s PHE 24 CO 0.00 -1.22 -0.13 -0.59 -1.34 0.00 0.00 175.22 171.94 1b2g s PHE 25 N -2.74 1.46 -0.34 3.49 -0.71 -1.26 -5.11 117.98 112.77 1b2g s PHE 25 Ca 0.16 -0.50 -0.06 0.00 -1.04 0.00 0.00 56.93 55.49 1b2g s PHE 25 Cb -0.04 -1.05 0.05 0.00 -1.21 0.00 0.00 43.02 40.77 1b2g s PHE 25 CO 0.07 -0.24 0.10 -0.47 -1.34 0.00 0.00 175.22 173.35 1b2g s TYR 26 N 0.49 3.28 -0.53 3.49 6.14 -1.26 -5.05 117.35 123.91 1b2g s TYR 26 Ca -0.11 -1.56 0.04 0.00 0.64 0.00 0.00 57.07 56.07 1b2g s TYR 26 Cb -0.14 -2.34 0.13 0.00 0.42 0.00 0.00 41.96 40.04 1b2g s TYR 26 CO 0.03 -0.76 0.28 0.99 0.64 0.00 0.00 175.55 176.73 1b2g s THR 27 N 1.36 2.52 0.14 4.34 2.01 -1.26 -4.99 115.64 119.76 1b2g s THR 27 Ca -0.02 -3.35 -0.17 0.00 0.31 0.00 0.00 61.69 58.46 1b2g s THR 27 Cb -0.20 -2.74 -0.01 0.00 0.01 0.00 0.00 72.50 69.56 1b2g s THR 27 CO 0.02 -0.83 1.77 1.55 -0.69 0.00 0.00 174.62 176.44 1b2g h PRO 28 N 6.40 0.47 -4.42 4.92 0.13 -2.05 -3.31 132.00 134.14 1b2g h PRO 28 Ca -0.05 -0.04 -0.74 0.00 -0.87 0.00 0.00 66.00 64.29 1b2g h PRO 28 Cb 0.88 -0.10 -0.21 0.00 0.13 0.00 0.00 31.00 31.70 1b2g h PRO 28 CO 0.67 0.35 0.69 0.15 -0.23 0.00 0.00 178.00 179.64 1b2g s LYS 29 N -6.01 3.80 0.00 0.86 3.01 -1.26 -5.25 119.74 114.90 1b2g s LYS 29 Ca -0.13 -2.36 0.00 0.00 -1.01 0.00 0.00 55.97 52.48 1b2g s LYS 29 Cb 0.10 -4.76 0.00 0.00 -1.01 0.00 0.00 37.83 32.16 1b2g s LYS 29 CO 0.72 -1.56 0.51 0.00 0.51 0.00 0.00 175.35 175.53