#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2roz s ALA 2 N 0.00 2.50 -0.41 -1.67 0.00 -1.26 -5.10 121.76 115.83 2roz s ALA 2 Ca 0.00 -1.06 -0.13 0.00 0.00 0.00 0.00 51.96 50.77 2roz s ALA 2 Cb 0.00 -0.80 0.04 0.00 0.00 0.00 0.00 23.12 22.36 2roz s ALA 2 CO 0.00 0.55 0.28 0.00 0.00 0.00 0.00 175.76 176.59 2roz s ALA 3 N -0.74 3.40 0.61 0.00 0.00 -1.26 -5.07 121.76 118.71 2roz s ALA 3 Ca 0.12 -1.83 -0.17 0.00 0.00 0.00 0.00 51.96 50.07 2roz s ALA 3 Cb -0.10 -2.79 -0.02 0.00 0.00 0.00 0.00 23.12 20.20 2roz s ALA 3 CO 0.01 -1.50 1.15 0.08 0.00 0.00 0.00 175.76 175.50 2roz s VAL 4 N 1.60 2.94 0.01 0.00 1.01 -1.26 -5.03 120.40 119.67 2roz s VAL 4 Ca 0.03 0.52 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 2roz s VAL 4 Cb -0.20 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 2roz s VAL 4 CO 0.07 -0.19 0.15 0.28 0.00 0.00 0.00 175.10 175.42 2roz s THR 5 N -1.92 5.17 -0.83 3.92 -1.32 -1.26 -4.99 115.64 114.41 2roz s THR 5 Ca 0.72 -0.30 -0.07 0.00 -1.21 0.00 0.00 61.69 60.84 2roz s THR 5 Cb -0.25 -3.42 -0.11 0.00 -1.51 0.00 0.00 72.50 67.21 2roz s THR 5 CO 0.35 0.30 2.60 -0.81 -2.21 0.00 0.00 174.62 174.85 2roz n PRO 6 N 0.90 2.37 0.10 7.08 -0.04 -1.26 -3.15 135.00 141.01 2roz n PRO 6 Ca -0.11 -1.45 0.00 0.00 -0.04 0.00 0.00 63.50 61.91 2roz n PRO 6 Cb 0.52 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.61 2roz n PRO 6 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2roz n GLU 7 N 3.52 0.00 0.01 0.54 4.07 -1.26 -4.90 120.64 122.62 2roz n GLU 7 Ca 0.51 0.00 0.23 0.00 -0.06 0.00 0.00 57.16 57.83 2roz n GLU 7 Cb 0.34 0.00 0.72 0.00 -0.06 0.00 0.00 31.44 32.43 2roz n GLU 7 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 2roz h GLU 8 N 0.00 0.00 -0.42 5.31 4.22 -1.97 0.44 114.58 122.16 2roz h GLU 8 Ca 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.34 2roz h GLU 8 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2roz h GLU 8 CO 0.00 0.00 -0.13 0.00 -2.18 0.00 0.00 179.01 176.70 2roz h ARG 9 N 0.00 0.82 -0.44 1.92 2.47 -1.91 0.89 114.38 118.14 2roz h ARG 9 Ca 0.26 -0.33 -0.13 0.00 -1.26 0.00 0.00 59.98 58.53 2roz h ARG 9 Cb 1.36 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.63 2roz h ARG 9 CO -0.00 0.96 -0.24 1.25 0.56 0.00 0.00 179.97 182.50 2roz h HIS 10 N 0.64 1.03 0.09 3.04 2.76 -0.52 -2.10 115.15 120.10 2roz h HIS 10 Ca 0.10 -0.25 -0.00 0.00 -2.20 0.00 0.00 60.37 58.02 2roz h HIS 10 Cb 0.67 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.39 2roz h HIS 10 CO 0.05 1.04 -0.04 -0.07 -1.30 0.00 0.00 177.93 177.61 2roz h LEU 11 N 0.77 -0.10 -1.32 0.26 3.38 -1.14 -1.68 115.31 115.48 2roz h LEU 11 Ca 0.10 0.00 0.45 0.00 0.09 0.00 0.00 57.88 58.52 2roz h LEU 11 Cb 0.79 0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.44 2roz h LEU 11 CO 0.07 0.02 0.86 -0.24 0.09 0.00 0.00 178.44 179.24 2roz n SER 12 N -2.86 0.17 0.10 -0.43 2.88 0.31 0.15 113.62 113.94 2roz n SER 12 Ca -0.02 1.24 -0.11 0.00 -1.33 0.00 0.00 58.87 58.65 2roz n SER 12 Cb 0.05 -0.61 -0.07 0.00 -0.75 0.00 0.00 64.21 62.83 2roz n SER 12 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2roz h LYS 13 N 0.00 -0.30 -0.08 -1.46 3.64 -1.40 -2.99 116.57 113.98 2roz h LYS 13 Ca 0.81 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 60.24 2roz h LYS 13 Cb 2.69 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 34.58 2roz h LYS 13 CO -0.39 0.07 0.39 0.52 -2.27 0.00 0.00 179.45 177.77 2roz h MET 14 N -0.87 0.00 -0.27 1.90 2.86 0.24 0.31 114.93 119.10 2roz h MET 14 Ca -0.03 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.49 2roz h MET 14 Cb 0.51 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 2roz h MET 14 CO 0.05 0.00 -0.29 1.96 1.06 0.00 0.00 176.91 179.69 2roz h GLN 15 N 0.00 0.68 0.00 1.72 4.20 -0.71 -3.27 115.11 117.72 2roz h GLN 15 Ca 0.04 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.38 2roz h GLN 15 Cb 0.81 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2roz h GLN 15 CO -0.00 0.98 0.00 1.04 -0.67 0.00 0.00 178.83 180.17 2roz n GLN 16 N -4.28 0.00 -0.37 1.46 6.02 0.92 -4.74 117.38 116.40 2roz n GLN 16 Ca -0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.94 2roz n GLN 16 Cb 0.47 0.00 0.04 0.00 1.02 0.00 0.00 30.24 31.78 2roz n GLN 16 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2roz n ASN 17 N -0.72 -0.61 -0.02 1.08 3.02 -0.24 -4.88 115.26 112.89 2roz n ASN 17 Ca 0.00 1.68 0.00 0.00 -0.03 0.00 0.00 54.58 56.23 2roz n ASN 17 Cb 0.00 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 2roz n ASN 17 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2roz n GLY 18 N -1.46 -1.52 2.79 7.41 0.00 -0.67 -4.90 105.19 106.83 2roz n GLY 18 Ca 0.10 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.66 2roz n GLY 18 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2roz s TYR 19 N 0.00 0.12 -0.19 1.61 5.04 -1.26 -4.67 117.35 118.00 2roz s TYR 19 Ca 0.00 0.08 0.01 0.00 -2.44 0.00 0.00 57.07 54.72 2roz s TYR 19 Cb 0.00 -0.28 0.02 0.00 0.35 0.00 0.00 41.96 42.06 2roz s TYR 19 CO 0.00 -0.09 -0.18 -2.00 -1.34 0.00 0.00 175.55 171.93 2roz s GLU 20 N 0.97 2.95 -0.28 4.97 -6.30 -1.26 -5.09 118.70 114.65 2roz s GLU 20 Ca -0.09 -0.86 -0.29 0.00 -2.50 0.00 0.00 54.97 51.23 2roz s GLU 20 Cb -0.12 -2.62 0.01 0.00 0.00 0.00 0.00 34.13 31.40 2roz s GLU 20 CO -0.02 -0.24 1.06 1.21 0.02 0.00 0.00 175.26 177.29 2roz s ASN 21 N 1.28 7.00 0.09 -1.70 3.84 -1.26 -4.91 114.94 119.29 2roz s ASN 21 Ca 0.04 1.19 -0.12 0.00 0.21 0.00 0.00 52.86 54.17 2roz s ASN 21 Cb -0.14 -2.54 -0.19 0.00 -0.55 0.00 0.00 41.25 37.84 2roz s ASN 21 CO -0.12 -0.79 1.25 1.55 -2.79 0.00 0.00 177.10 176.20 2roz h PRO 22 N 7.82 0.71 -1.02 0.43 0.13 -2.06 -3.23 132.00 134.79 2roz h PRO 22 Ca -0.20 -0.69 0.42 0.00 -0.87 0.00 0.00 66.00 64.66 2roz h PRO 22 Cb 1.06 0.18 -0.18 0.00 0.13 0.00 0.00 31.00 32.19 2roz h PRO 22 CO 1.01 1.28 0.56 0.00 -0.23 0.00 0.00 178.00 180.61 2roz h THR 23 N 0.43 0.01 -3.08 1.56 1.03 -2.07 -3.40 112.91 107.39 2roz h THR 23 Ca -0.10 -0.00 -0.54 0.00 -0.01 0.00 0.00 66.41 65.76 2roz h THR 23 Cb 1.58 -0.00 0.22 0.00 -1.07 0.00 0.00 68.15 68.87 2roz h THR 23 CO 0.18 0.00 -0.83 0.00 -0.01 0.00 0.00 175.52 174.87 2roz n TYR 24 N -5.23 -2.19 -3.45 0.00 9.36 -1.22 -5.02 117.16 109.40 2roz n TYR 24 Ca 0.38 0.19 -0.12 0.00 3.32 0.00 0.00 57.90 61.67 2roz n TYR 24 Cb 1.29 -1.72 -0.02 0.00 -0.63 0.00 0.00 39.34 38.26 2roz n TYR 24 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 2roz s LYS 25 N -3.18 1.15 -0.02 2.98 2.20 -1.26 -5.07 119.74 116.54 2roz s LYS 25 Ca 0.54 -0.37 0.01 0.00 -0.36 0.00 0.00 55.97 55.79 2roz s LYS 25 Cb -0.22 0.53 0.02 0.00 -1.51 0.00 0.00 37.83 36.66 2roz s LYS 25 CO 0.70 -0.49 0.53 1.97 -0.36 0.00 0.00 175.35 177.69 2roz n PHE 26 N -0.24 -0.12 -2.14 4.03 -1.74 -1.26 -5.10 117.46 110.89 2roz n PHE 26 Ca -0.15 -0.10 -0.36 0.00 -0.56 0.00 0.00 57.45 56.28 2roz n PHE 26 Cb 0.64 0.59 -0.04 0.00 1.52 0.00 0.00 39.48 42.19 2roz n PHE 26 CO 0.00 0.00 0.00 0.12 -0.56 0.00 0.00 176.76 176.32 2roz s PHE 27 N 0.01 1.83 0.32 2.97 5.36 -1.26 -4.93 117.98 122.28 2roz s PHE 27 Ca 0.01 0.54 0.03 0.00 -0.96 0.00 0.00 56.93 56.55 2roz s PHE 27 Cb 0.03 -4.18 -0.05 0.00 -0.34 0.00 0.00 43.02 38.47 2roz s PHE 27 CO -0.01 -2.10 0.08 -1.21 -1.46 0.00 0.00 175.22 170.52 2roz s GLU 28 N 6.75 1.64 -0.47 10.12 0.41 -1.26 -5.11 118.70 130.78 2roz s GLU 28 Ca 0.63 -1.92 0.04 0.00 -0.41 0.00 0.00 54.97 53.30 2roz s GLU 28 Cb -0.10 -0.63 0.22 0.00 -1.78 0.00 0.00 34.13 31.84 2roz s GLU 28 CO 0.12 -0.28 0.88 0.94 -0.49 0.00 0.00 175.26 176.44 2roz n GLN 29 N -0.67 0.53 0.06 1.61 7.27 -1.26 -5.03 117.38 119.89 2roz n GLN 29 Ca -0.02 -1.64 -0.09 0.00 0.07 0.00 0.00 57.00 55.32 2roz n GLN 29 Cb 0.66 -1.15 -0.06 0.00 2.41 0.00 0.00 30.24 32.11 2roz n GLN 29 CO 0.00 0.00 0.00 0.52 0.07 0.00 0.00 177.06 177.65 2roz h MET 30 N 4.36 -0.24 0.00 3.69 2.86 -2.02 -3.49 114.93 120.08 2roz h MET 30 Ca -0.05 0.02 0.31 0.00 -2.06 0.00 0.00 59.70 57.92 2roz h MET 30 Cb 1.10 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.73 2roz h MET 30 CO 0.09 0.10 -0.41 1.04 1.06 0.00 0.00 176.91 178.79 2roz n GLN 31 N -4.93 -2.31 -0.33 1.72 1.13 -1.26 -5.38 117.38 106.01 2roz n GLN 31 Ca -0.06 1.52 0.00 0.00 -1.94 0.00 0.00 57.00 56.52 2roz n GLN 31 Cb 0.23 -2.82 0.00 0.00 0.11 0.00 0.00 30.24 27.76 2roz n GLN 31 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71