#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rwe n VAL 2 N 0.00 4.69 -0.10 -4.37 0.24 -1.26 -4.80 118.33 112.72 1rwe n VAL 2 Ca 0.00 -4.27 -0.05 0.00 -2.04 0.00 0.00 64.34 57.98 1rwe n VAL 2 Cb 0.00 -2.26 0.02 0.00 -1.47 0.00 0.00 33.84 30.13 1rwe n VAL 2 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 1rwe h ASN 3 N 5.26 -0.19 -0.65 -1.34 2.35 -2.06 -2.62 115.58 116.33 1rwe h ASN 3 Ca 0.54 0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 56.37 1rwe h ASN 3 Cb 0.48 0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.99 1rwe h ASN 3 CO 1.58 -0.06 0.37 -0.61 -1.65 0.00 0.00 177.43 177.06 1rwe h GLN 4 N 0.08 0.91 -0.32 0.81 -0.00 -1.99 -1.03 115.11 113.57 1rwe h GLN 4 Ca 0.18 -0.09 -0.11 0.00 -0.00 0.00 0.00 58.65 58.62 1rwe h GLN 4 Cb 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.53 1rwe h GLN 4 CO -0.31 0.67 -0.26 1.25 0.00 0.00 0.00 178.83 180.17 1rwe h HIS 5 N 0.92 0.72 -0.08 3.99 2.76 -1.88 -1.75 115.15 119.82 1rwe h HIS 5 Ca 0.24 -0.17 -0.08 0.00 -2.20 0.00 0.00 60.37 58.16 1rwe h HIS 5 Cb 0.02 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 28.81 1rwe h HIS 5 CO 0.01 0.83 -0.26 -0.07 -1.30 0.00 0.00 177.93 177.13 1rwe h LEU 6 N 0.55 0.38 -0.74 0.26 3.38 -1.15 -3.14 115.31 114.85 1rwe h LEU 6 Ca 0.07 -0.61 0.06 0.00 0.09 0.00 0.00 57.88 57.50 1rwe h LEU 6 Cb 0.73 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 1rwe h LEU 6 CO 0.06 0.92 0.43 0.00 0.09 0.00 0.00 178.44 179.94 1rwe h GLY 8 N 0.78 1.32 0.90 0.00 0.00 -1.33 -0.22 103.07 104.52 1rwe h GLY 8 Ca 0.33 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.32 1rwe h GLY 8 CO -0.19 0.18 0.40 0.23 0.00 0.00 0.00 176.54 177.16 1rwe h SER 9 N 0.87 0.66 -0.31 0.19 0.87 -1.28 -1.66 113.55 112.89 1rwe h SER 9 Ca 0.43 -0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.84 1rwe h SER 9 Cb 0.47 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 1rwe h SER 9 CO -0.19 0.46 -0.35 0.45 -0.53 0.00 0.00 176.83 176.66 1rwe h HIS 10 N 0.79 1.01 -0.12 2.24 3.86 -1.16 -2.95 115.15 118.81 1rwe h HIS 10 Ca 0.25 -0.29 0.03 0.00 -1.16 0.00 0.00 60.37 59.20 1rwe h HIS 10 Cb -0.00 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.22 1rwe h HIS 10 CO -0.05 1.08 -0.06 -0.07 0.86 0.00 0.00 177.93 179.69 1rwe h LEU 11 N 0.70 -0.20 -1.44 2.43 3.38 -0.56 -0.82 115.31 118.80 1rwe h LEU 11 Ca 0.07 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 1rwe h LEU 11 Cb 0.92 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1rwe h LEU 11 CO 0.08 -0.08 -0.26 -0.37 0.09 0.00 0.00 178.44 177.90 1rwe h VAL 12 N -0.05 0.91 -0.30 1.22 -1.51 -1.33 -0.32 116.25 114.87 1rwe h VAL 12 Ca 0.07 -1.01 -0.15 0.00 -1.23 0.00 0.00 66.70 64.38 1rwe h VAL 12 Cb 0.15 1.59 -0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1rwe h VAL 12 CO -0.16 0.26 -0.41 -0.08 -1.23 0.00 0.00 177.57 175.95 1rwe h GLU 13 N 0.00 0.81 -0.47 5.19 4.81 -1.25 -2.13 114.58 121.54 1rwe h GLU 13 Ca -0.00 -0.47 -0.08 0.00 -0.13 0.00 0.00 59.36 58.68 1rwe h GLU 13 Cb 0.57 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 1rwe h GLU 13 CO 0.03 1.10 -0.00 0.00 -0.73 0.00 0.00 179.01 179.41 1rwe h ALA 14 N 0.70 0.64 -0.45 2.92 0.00 -0.69 -2.80 119.26 119.57 1rwe h ALA 14 Ca 0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1rwe h ALA 14 Cb 1.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1rwe h ALA 14 CO 0.10 0.44 0.10 -0.07 0.00 0.00 0.00 179.25 179.82 1rwe h LEU 15 N 0.69 0.62 -0.39 0.00 3.38 -1.04 0.18 115.31 118.74 1rwe h LEU 15 Ca 0.13 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1rwe h LEU 15 Cb 0.51 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1rwe h LEU 15 CO 0.03 0.63 0.23 0.22 0.09 0.00 0.00 178.44 179.63 1rwe h TYR 16 N 0.65 0.43 -0.07 1.13 3.20 -1.15 0.74 116.97 121.91 1rwe h TYR 16 Ca 0.15 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 1rwe h TYR 16 Cb 0.26 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 1rwe h TYR 16 CO 0.01 0.25 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.69 1rwe h LEU 17 N 0.46 0.13 -0.22 2.82 3.38 -1.16 -2.52 115.31 118.21 1rwe h LEU 17 Ca 0.16 -0.39 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 1rwe h LEU 17 Cb 0.01 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1rwe h LEU 17 CO -0.07 0.50 -0.04 1.62 0.09 0.00 0.00 178.44 180.53 1rwe h VAL 18 N -0.23 1.28 0.00 1.22 3.04 -0.89 -3.28 116.25 117.39 1rwe h VAL 18 Ca 0.02 -1.01 -0.11 0.00 -1.01 0.00 0.00 66.70 64.58 1rwe h VAL 18 Cb 0.44 1.50 -0.02 0.00 -2.01 0.00 0.00 31.29 31.20 1rwe h VAL 18 CO 0.01 0.31 -0.55 0.00 -1.01 0.00 0.00 177.57 176.33 1rwe n GLY 20 N 0.54 2.83 0.30 0.00 0.00 -0.95 -1.70 105.19 106.21 1rwe n GLY 20 Ca -0.00 -0.14 0.18 0.00 0.00 0.00 0.00 46.02 46.06 1rwe n GLY 20 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1rwe h GLU 21 N 0.00 0.00 0.00 1.61 4.11 -1.93 -2.55 114.58 115.82 1rwe h GLU 21 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 1rwe h GLU 21 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1rwe h GLU 21 CO 0.00 0.03 -0.30 0.00 0.07 0.00 0.00 179.01 178.80 1rwe h ARG 22 N 0.00 0.00 0.00 1.06 3.08 -1.73 -3.49 114.38 113.30 1rwe h ARG 22 Ca -0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.12 1rwe h ARG 22 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1rwe h ARG 22 CO 0.00 0.30 -0.09 0.41 -1.07 0.00 0.00 179.97 179.52 1rwe n GLY 23 N -0.18 -1.89 3.69 0.04 0.00 -0.96 -5.05 105.19 100.84 1rwe n GLY 23 Ca -0.01 -1.33 -0.05 0.00 0.00 0.00 0.00 46.02 44.64 1rwe n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1rwe s PHE 24 N -0.69 -0.19 -0.06 1.61 -0.71 -1.26 -4.86 117.98 111.82 1rwe s PHE 24 Ca 0.00 -0.07 0.03 0.00 -1.04 0.00 0.00 56.93 55.85 1rwe s PHE 24 Cb 0.00 0.61 -0.02 0.00 -1.21 0.00 0.00 43.02 42.40 1rwe s PHE 24 CO 0.00 -0.74 -0.14 -0.06 -1.34 0.00 0.00 175.22 172.93 1rwe s PHE 25 N -3.23 2.72 -0.21 3.49 0.40 -1.26 -5.10 117.98 114.79 1rwe s PHE 25 Ca 0.10 -0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 56.18 1rwe s PHE 25 Cb -0.01 -1.67 0.02 0.00 0.51 0.00 0.00 43.02 41.87 1rwe s PHE 25 CO -0.01 0.11 -0.12 -0.47 0.70 0.00 0.00 175.22 175.43 1rwe s TYR 26 N -0.52 2.93 -0.32 0.36 5.04 -1.26 -5.07 117.35 118.51 1rwe s TYR 26 Ca 0.07 -1.53 -0.01 0.00 -2.44 0.00 0.00 57.07 53.15 1rwe s TYR 26 Cb -0.12 -1.99 0.10 0.00 0.35 0.00 0.00 41.96 40.30 1rwe s TYR 26 CO 0.02 -0.74 0.12 0.95 -1.34 0.00 0.00 175.55 174.56 1rwe s THR 27 N 1.32 0.65 -1.98 4.34 -4.23 -1.26 -4.99 115.64 109.50 1rwe s THR 27 Ca 0.03 -1.35 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 1rwe s THR 27 Cb -0.15 -1.50 0.01 0.00 1.34 0.00 0.00 72.50 72.20 1rwe s THR 27 CO -0.08 -0.72 0.52 -0.81 -0.54 0.00 0.00 174.62 172.99 1rwe n PRO 28 N 4.81 0.01 -0.76 3.99 -0.04 -1.26 -4.66 135.00 137.08 1rwe n PRO 28 Ca -0.01 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1rwe n PRO 28 Cb 0.41 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 1rwe n PRO 28 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1rwe n LYS 29 N -1.01 1.25 -0.99 0.54 4.81 -1.26 -5.24 118.16 116.25 1rwe n LYS 29 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1rwe n LYS 29 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1rwe n LYS 29 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98