#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r9p n PRO 2 N 0.00 1.14 0.00 5.56 -0.02 -1.26 -4.87 135.00 135.55 2r9p n PRO 2 Ca 0.00 0.41 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 2r9p n PRO 2 Cb 0.00 -1.95 0.52 0.00 -0.02 0.00 0.00 33.50 32.05 2r9p n PRO 2 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2r9p n ASP 3 N 0.51 0.00 0.19 2.55 8.00 -1.26 -1.68 116.55 124.86 2r9p n ASP 3 Ca 0.10 0.40 0.14 0.00 0.71 0.00 0.00 54.79 56.14 2r9p n ASP 3 Cb 0.40 -0.46 0.45 0.00 -0.02 0.00 0.00 41.12 41.49 2r9p n ASP 3 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 2r9p h PHE 4 N 0.00 0.00 0.00 1.24 -5.15 -1.97 -3.07 116.94 107.99 2r9p h PHE 4 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2r9p h PHE 4 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.54 2r9p h PHE 4 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.31 2r9p n LEU 6 N -2.40 0.58 -4.74 0.00 4.77 -1.16 -4.50 117.00 109.54 2r9p n LEU 6 Ca 0.03 -0.06 -0.40 0.00 -0.03 0.00 0.00 56.01 55.54 2r9p n LEU 6 Cb 0.32 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.15 2r9p n LEU 6 CO 0.25 0.13 0.53 -1.61 -1.33 0.00 0.00 177.39 175.36 2r9p s GLU 7 N -3.01 4.57 1.00 3.23 0.41 -1.07 -4.94 118.70 118.90 2r9p s GLU 7 Ca 0.10 1.20 -0.11 0.00 -0.41 0.00 0.00 54.97 55.75 2r9p s GLU 7 Cb 0.17 -3.36 0.20 0.00 -1.78 0.00 0.00 34.13 29.36 2r9p s GLU 7 CO 0.73 0.29 1.10 -2.14 -0.49 0.00 0.00 175.26 174.75 2r9p s PRO 8 N -0.17 0.32 0.39 0.39 0.02 -1.26 -4.93 135.00 129.76 2r9p s PRO 8 Ca 0.41 1.25 -0.27 0.00 0.02 0.00 0.00 61.00 62.41 2r9p s PRO 8 Cb -0.22 -1.67 -0.09 0.00 0.02 0.00 0.00 34.50 32.54 2r9p s PRO 8 CO 0.26 -3.01 1.35 -1.25 -0.33 0.00 0.00 177.00 174.01 2r9p s PRO 9 N -4.59 4.05 -0.34 5.54 0.04 -1.26 -4.99 135.00 133.45 2r9p s PRO 9 Ca 0.67 2.27 -0.02 0.00 0.04 0.00 0.00 61.00 63.96 2r9p s PRO 9 Cb -0.23 -2.86 0.07 0.00 0.04 0.00 0.00 34.50 31.52 2r9p s PRO 9 CO 0.60 -0.46 0.07 -0.47 0.04 0.00 0.00 177.00 176.78 2r9p s TYR 10 N -1.20 3.42 0.09 0.56 6.14 -1.26 -4.99 117.35 120.10 2r9p s TYR 10 Ca 0.55 -2.16 -0.15 0.00 0.64 0.00 0.00 57.07 55.94 2r9p s TYR 10 Cb -0.40 -2.55 -0.12 0.00 0.42 0.00 0.00 41.96 39.31 2r9p s TYR 10 CO 0.53 -0.87 1.36 1.15 0.64 0.00 0.00 175.55 178.36 2r9p h THR 11 N 6.45 1.31 0.00 4.34 2.02 -1.96 -3.43 112.91 121.64 2r9p h THR 11 Ca -0.17 -1.63 0.00 0.00 0.77 0.00 0.00 66.41 65.38 2r9p h THR 11 Cb 1.05 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 2r9p h THR 11 CO 0.58 0.51 0.00 0.61 0.37 0.00 0.00 175.52 177.60 2r9p n GLY 12 N 0.38 -0.59 0.20 2.16 0.00 -1.26 -0.88 105.19 105.20 2r9p n GLY 12 Ca -0.05 -1.75 0.11 0.00 0.00 0.00 0.00 46.02 44.33 2r9p n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r9p h PRO 13 N 0.00 0.00 -7.17 1.61 0.13 -1.95 -3.44 132.00 121.18 2r9p h PRO 13 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 2r9p h PRO 13 Cb 0.00 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.16 2r9p h PRO 13 CO 0.00 0.06 0.37 0.00 -0.23 0.00 0.00 178.00 178.20 2r9p n LYS 15 N -1.57 2.75 -1.35 0.00 5.02 -1.18 -4.13 118.16 117.71 2r9p n LYS 15 Ca 0.07 -2.91 -0.29 0.00 -2.02 0.00 0.00 58.31 53.16 2r9p n LYS 15 Cb 0.54 -1.86 0.19 0.00 -0.02 0.00 0.00 35.03 33.88 2r9p n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2r9p s ALA 16 N -2.91 1.23 -0.38 7.82 0.00 -0.13 -5.03 121.76 122.35 2r9p s ALA 16 Ca 0.43 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.69 2r9p s ALA 16 Cb 0.36 -2.96 0.11 0.00 0.00 0.00 0.00 23.12 20.62 2r9p s ALA 16 CO 0.08 -2.90 0.10 0.50 0.00 0.00 0.00 175.76 173.54 2r9p s ARG 17 N -5.34 1.61 -0.14 0.00 3.52 -1.26 -3.98 118.95 113.37 2r9p s ARG 17 Ca 0.68 -2.02 0.02 0.00 -0.13 0.00 0.00 55.73 54.29 2r9p s ARG 17 Cb -0.12 -3.26 0.01 0.00 -1.56 0.00 0.00 34.95 30.02 2r9p s ARG 17 CO 0.55 -0.98 -0.20 0.42 -0.81 0.00 0.00 175.30 174.28 2r9p s ILE 18 N 0.69 1.93 -0.08 4.11 1.01 -0.35 -4.96 121.20 123.55 2r9p s ILE 18 Ca 0.12 -0.89 -0.27 0.00 0.00 0.00 0.00 60.65 59.61 2r9p s ILE 18 Cb -0.20 -1.72 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 2r9p s ILE 18 CO -0.06 0.52 0.88 -0.63 0.00 0.00 0.00 174.94 175.65 2r9p s ILE 19 N 0.93 4.90 0.11 2.92 -1.09 -1.26 -0.74 121.20 126.97 2r9p s ILE 19 Ca -0.05 1.80 0.01 0.00 -2.23 0.00 0.00 60.65 60.17 2r9p s ILE 19 Cb -0.15 -4.20 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 2r9p s ILE 19 CO -0.03 0.12 -0.02 -0.13 -1.23 0.00 0.00 174.94 173.65 2r9p s ARG 20 N 1.41 0.88 0.09 2.79 1.81 -0.90 -4.95 118.95 120.08 2r9p s ARG 20 Ca 0.44 -1.38 0.05 0.00 -1.72 0.00 0.00 55.73 53.12 2r9p s ARG 20 Cb -0.19 -0.07 -0.04 0.00 -0.45 0.00 0.00 34.95 34.21 2r9p s ARG 20 CO 0.20 -0.11 -0.03 0.71 -0.68 0.00 0.00 175.30 175.39 2r9p s TYR 21 N -3.76 2.91 0.04 -0.53 1.51 -0.60 -0.62 117.35 116.30 2r9p s TYR 21 Ca 0.16 -0.07 0.00 0.00 -1.01 0.00 0.00 57.07 56.16 2r9p s TYR 21 Cb 0.06 -1.51 -0.03 0.00 -0.11 0.00 0.00 41.96 40.38 2r9p s TYR 21 CO -0.02 0.46 -0.04 -0.59 -1.11 0.00 0.00 175.55 174.25 2r9p s PHE 22 N -1.27 0.47 -0.37 2.71 -0.12 0.27 -1.00 117.98 118.67 2r9p s PHE 22 Ca 0.24 -0.73 -0.25 0.00 -0.05 0.00 0.00 56.93 56.14 2r9p s PHE 22 Cb -0.11 -0.32 0.01 0.00 -0.63 0.00 0.00 43.02 41.97 2r9p s PHE 22 CO 0.16 -0.23 0.89 -0.47 -0.05 0.00 0.00 175.22 175.53 2r9p s TYR 23 N -2.42 3.08 -0.54 3.49 6.14 -1.26 -1.19 117.35 124.64 2r9p s TYR 23 Ca -0.05 0.71 -0.20 0.00 0.64 0.00 0.00 57.07 58.16 2r9p s TYR 23 Cb -0.03 -3.60 0.06 0.00 0.42 0.00 0.00 41.96 38.81 2r9p s TYR 23 CO -0.04 -0.81 0.73 1.21 0.64 0.00 0.00 175.55 177.28 2r9p s ASN 24 N 1.88 6.23 0.17 4.32 2.47 0.22 -4.76 114.94 125.48 2r9p s ASN 24 Ca 0.36 -0.90 -0.03 0.00 0.42 0.00 0.00 52.86 52.72 2r9p s ASN 24 Cb -0.12 -2.33 0.06 0.00 -1.45 0.00 0.00 41.25 37.40 2r9p s ASN 24 CO 0.18 -1.05 1.45 0.00 -3.72 0.00 0.00 177.10 173.97 2r9p h ALA 25 N 9.14 0.61 -0.86 1.71 0.00 -1.82 0.23 119.26 128.27 2r9p h ALA 25 Ca -0.28 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.04 2r9p h ALA 25 Cb 1.09 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2r9p h ALA 25 CO 1.03 0.73 0.46 -0.22 0.00 0.00 0.00 179.25 181.25 2r9p h LYS 26 N 0.35 1.20 0.00 0.00 3.64 -1.94 -2.56 116.57 117.26 2r9p h LYS 26 Ca -0.02 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 2r9p h LYS 26 Cb 1.24 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2r9p h LYS 26 CO 0.12 0.89 -0.26 0.00 -2.27 0.00 0.00 179.45 177.93 2r9p n ALA 27 N -2.40 2.85 -1.05 5.00 0.00 -0.92 -4.92 120.51 119.07 2r9p n ALA 27 Ca 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 53.44 53.31 2r9p n ALA 27 Cb 0.10 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 2r9p n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r9p n GLY 28 N 1.46 0.41 3.17 0.00 0.00 0.77 -4.97 105.19 106.03 2r9p n GLY 28 Ca 0.06 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 2r9p n GLY 28 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r9p s LEU 29 N -0.36 1.77 0.07 0.99 1.02 -0.95 -4.75 118.68 116.48 2r9p s LEU 29 Ca 0.00 -0.83 -0.30 0.00 0.02 0.00 0.00 54.13 53.02 2r9p s LEU 29 Cb 0.00 0.72 -0.06 0.00 0.02 0.00 0.00 46.19 46.87 2r9p s LEU 29 CO 0.00 -0.70 1.17 0.00 0.02 0.00 0.00 176.35 176.84 2r9p s GLN 31 N 0.86 1.09 0.34 0.00 -0.21 -0.34 -4.94 119.66 116.46 2r9p s GLN 31 Ca 0.57 -1.36 -0.02 0.00 0.02 0.00 0.00 55.36 54.57 2r9p s GLN 31 Cb -0.29 -0.88 -0.04 0.00 1.00 0.00 0.00 33.01 32.80 2r9p s GLN 31 CO 0.30 0.15 0.58 0.95 -2.12 0.00 0.00 175.29 175.15 2r9p s THR 32 N -2.59 5.05 0.26 -0.19 -4.23 -1.26 -0.56 115.64 112.12 2r9p s THR 32 Ca 0.13 -0.17 -0.04 0.00 -1.18 0.00 0.00 61.69 60.43 2r9p s THR 32 Cb -0.02 -3.81 -0.02 0.00 1.34 0.00 0.00 72.50 69.99 2r9p s THR 32 CO 0.03 -0.50 0.33 0.72 -0.54 0.00 0.00 174.62 174.67 2r9p s PHE 33 N -2.27 0.96 -0.28 3.99 -0.12 0.21 -4.91 117.98 115.57 2r9p s PHE 33 Ca 0.42 -1.19 -0.15 0.00 -0.05 0.00 0.00 56.93 55.96 2r9p s PHE 33 Cb -0.10 -0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.01 2r9p s PHE 33 CO 0.35 -0.89 0.37 0.08 -0.05 0.00 0.00 175.22 175.08 2r9p s VAL 34 N -3.78 5.18 -0.19 -2.49 1.01 -1.26 -2.11 120.40 116.75 2r9p s VAL 34 Ca 0.32 0.51 -0.10 0.00 0.00 0.00 0.00 61.98 62.72 2r9p s VAL 34 Cb 0.02 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 2r9p s VAL 34 CO 0.15 0.14 0.13 -0.47 0.00 0.00 0.00 175.10 175.04 2r9p s TYR 35 N 2.06 3.41 -0.45 5.22 5.04 0.08 -4.24 117.35 128.46 2r9p s TYR 35 Ca 0.14 0.33 0.25 0.00 -2.44 0.00 0.00 57.07 55.35 2r9p s TYR 35 Cb -0.16 -2.14 0.99 0.00 0.35 0.00 0.00 41.96 41.01 2r9p s TYR 35 CO 0.10 0.31 1.75 0.78 -1.34 0.00 0.00 175.55 177.15 2r9p h GLY 36 N 6.55 0.00 0.00 8.97 0.00 -1.14 -0.91 103.07 116.53 2r9p h GLY 36 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2r9p h GLY 36 CO 0.74 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.89 2r9p n GLY 37 N 0.19 0.82 3.11 4.60 0.00 -1.26 -0.96 105.19 111.69 2r9p n GLY 37 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 2r9p n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r9p n ARG 39 N 0.96 -0.78 -1.52 0.00 1.74 -1.26 -4.53 116.66 111.27 2r9p n ARG 39 Ca -0.20 0.57 -0.51 0.00 -0.77 0.00 0.00 57.85 56.94 2r9p n ARG 39 Cb 0.58 -4.60 -0.05 0.00 -1.02 0.00 0.00 32.46 27.37 2r9p n ARG 39 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2r9p n ALA 40 N -0.86 -1.85 -1.96 7.54 0.00 -1.26 -4.90 120.51 117.22 2r9p n ALA 40 Ca -0.11 0.49 -0.27 0.00 0.00 0.00 0.00 53.44 53.54 2r9p n ALA 40 Cb 0.53 -1.88 0.14 0.00 0.00 0.00 0.00 19.45 18.24 2r9p n ALA 40 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2r9p s LYS 41 N -0.44 1.24 0.29 0.00 1.02 -1.26 -5.02 119.74 115.56 2r9p s LYS 41 Ca 0.75 -0.67 0.08 0.00 0.02 0.00 0.00 55.97 56.15 2r9p s LYS 41 Cb -0.96 -2.08 0.44 0.00 -0.52 0.00 0.00 37.83 34.71 2r9p s LYS 41 CO 0.54 -1.89 1.68 0.00 -0.92 0.00 0.00 175.35 174.75 2r9p h ARG 42 N -1.08 0.15 -3.72 1.68 3.08 -1.94 -3.33 114.38 109.22 2r9p h ARG 42 Ca -0.41 -0.08 -0.66 0.00 0.07 0.00 0.00 59.98 58.90 2r9p h ARG 42 Cb 1.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.31 2r9p h ARG 42 CO 0.42 0.60 3.19 -1.71 -1.07 0.00 0.00 179.97 181.40 2r9p n ASN 43 N -3.96 5.22 -3.19 7.04 5.15 -1.26 -4.67 115.26 119.60 2r9p n ASN 43 Ca -0.02 -2.69 0.03 0.00 -0.60 0.00 0.00 54.58 51.30 2r9p n ASN 43 Cb 0.52 -1.50 -0.02 0.00 -0.53 0.00 0.00 39.78 38.25 2r9p n ASN 43 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2r9p s ASN 44 N 3.17 -1.27 0.05 1.20 3.84 -1.25 -4.56 114.94 116.11 2r9p s ASN 44 Ca 0.54 0.87 0.07 0.00 0.21 0.00 0.00 52.86 54.56 2r9p s ASN 44 Cb 0.15 2.11 -0.03 0.00 -0.55 0.00 0.00 41.25 42.93 2r9p s ASN 44 CO -0.05 -0.26 -0.20 -0.36 -2.79 0.00 0.00 177.10 173.45 2r9p s PHE 45 N 2.84 1.71 -1.07 0.43 0.40 -0.17 -4.95 117.98 117.17 2r9p s PHE 45 Ca 0.19 -0.38 0.28 0.00 -0.60 0.00 0.00 56.93 56.42 2r9p s PHE 45 Cb -0.15 -1.00 1.05 0.00 0.51 0.00 0.00 43.02 43.43 2r9p s PHE 45 CO -0.21 0.10 1.79 1.63 0.70 0.00 0.00 175.22 179.23 2r9p n LYS 46 N 1.75 0.07 -3.95 0.44 5.02 -1.26 -1.56 118.16 118.68 2r9p n LYS 46 Ca -0.18 -0.02 -0.09 0.00 -2.02 0.00 0.00 58.31 56.00 2r9p n LYS 46 Cb 0.54 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.94 2r9p n LYS 46 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2r9p s SER 47 N -2.94 0.19 0.25 4.39 1.04 -1.26 -4.90 113.70 110.47 2r9p s SER 47 Ca 0.15 -0.48 -0.05 0.00 0.48 0.00 0.00 55.95 56.05 2r9p s SER 47 Cb 0.19 0.17 0.28 0.00 0.10 0.00 0.00 66.02 66.76 2r9p s SER 47 CO 0.57 -0.41 1.82 0.00 0.98 0.00 0.00 173.24 176.20 2r9p h ALA 48 N 4.12 1.15 0.39 5.32 0.00 -1.97 -1.79 119.26 126.49 2r9p h ALA 48 Ca -0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2r9p h ALA 48 Cb 1.19 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2r9p h ALA 48 CO 0.46 0.61 -0.48 0.93 0.00 0.00 0.00 179.25 180.77 2r9p h GLU 49 N 1.05 -0.87 -0.42 0.00 3.07 -1.99 0.07 114.58 115.48 2r9p h GLU 49 Ca 0.24 0.06 0.09 0.00 -0.50 0.00 0.00 59.36 59.25 2r9p h GLU 49 Cb 0.19 0.20 -0.09 0.00 -0.84 0.00 0.00 28.75 28.21 2r9p h GLU 49 CO -0.02 -0.58 -0.21 -0.44 -1.40 0.00 0.00 179.01 176.36 2r9p h ASP 50 N -0.90 -0.71 -0.77 1.42 5.19 -1.98 0.05 116.42 118.72 2r9p h ASP 50 Ca -0.05 0.16 0.15 0.00 -0.62 0.00 0.00 57.03 56.68 2r9p h ASP 50 Cb 0.80 0.38 -0.10 0.00 0.18 0.00 0.00 39.33 40.59 2r9p h ASP 50 CO -0.11 -0.24 0.30 0.00 -3.12 0.00 0.00 179.24 176.08 2r9p h MET 52 N 0.43 0.53 -0.70 0.00 2.86 -0.21 -1.31 114.93 116.52 2r9p h MET 52 Ca 0.43 -0.77 0.13 0.00 -2.06 0.00 0.00 59.70 57.43 2r9p h MET 52 Cb 0.69 0.27 -0.05 0.00 0.06 0.00 0.00 31.60 32.57 2r9p h MET 52 CO -0.43 1.35 0.47 -0.09 1.06 0.00 0.00 176.91 179.27 2r9p h ARG 53 N 0.21 0.39 0.15 1.72 2.43 -0.89 0.32 114.38 118.72 2r9p h ARG 53 Ca -0.19 -0.02 -0.35 0.00 -0.81 0.00 0.00 59.98 58.61 2r9p h ARG 53 Cb 1.97 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 31.43 2r9p h ARG 53 CO 0.24 0.26 -1.81 1.15 -1.51 0.00 0.00 179.97 178.30 2r9p h THR 54 N 0.41 0.85 0.00 0.20 2.02 -1.39 -3.43 112.91 111.57 2r9p h THR 54 Ca 0.34 -2.49 -0.02 0.00 0.77 0.00 0.00 66.41 65.01 2r9p h THR 54 Cb 0.76 2.67 -0.00 0.00 -1.74 0.00 0.00 68.15 69.83 2r9p h THR 54 CO -0.10 0.86 -1.11 0.00 0.37 0.00 0.00 175.52 175.53 2r9p n GLY 56 N 2.62 0.10 3.19 0.00 0.00 0.11 -0.63 105.19 110.59 2r9p n GLY 56 Ca -0.02 0.87 -0.23 0.00 0.00 0.00 0.00 46.02 46.64 2r9p n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r9p n GLY 57 N 3.97 -0.63 0.81 -0.02 0.00 -1.26 -4.57 105.19 103.48 2r9p n GLY 57 Ca 0.30 1.17 0.13 0.00 0.00 0.00 0.00 46.02 47.62 2r9p n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32