#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dcp n ARG 7 N 0.00 0.22 0.00 -0.41 0.63 -1.26 -4.50 116.66 111.33 1dcp n ARG 7 Ca 0.00 -0.95 0.00 0.00 -0.92 0.00 0.00 57.85 55.98 1dcp n ARG 7 Cb 0.00 -3.04 0.00 0.00 0.45 0.00 0.00 32.46 29.87 1dcp n ARG 7 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1dcp n LEU 8 N 15.41 0.00 -4.73 6.15 4.77 -0.89 -4.92 117.00 132.79 1dcp n LEU 8 Ca 0.40 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 56.09 1dcp n LEU 8 Cb 0.42 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.67 1dcp n LEU 8 CO 0.63 0.00 0.69 -0.94 -1.33 0.00 0.00 177.39 176.43 1dcp s SER 9 N 0.00 2.88 0.40 -1.43 1.04 -1.26 -4.83 113.70 110.49 1dcp s SER 9 Ca 0.00 0.96 0.21 0.00 0.48 0.00 0.00 55.95 57.61 1dcp s SER 9 Cb 0.00 -1.51 0.68 0.00 0.10 0.00 0.00 66.02 65.29 1dcp s SER 9 CO 0.00 -2.95 1.72 0.00 0.98 0.00 0.00 173.24 173.00 1dcp h ALA 10 N -1.77 0.94 -0.03 5.32 0.00 -2.00 -0.90 119.26 120.83 1dcp h ALA 10 Ca -0.51 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.04 1dcp h ALA 10 Cb 1.33 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.07 1dcp h ALA 10 CO 0.57 0.37 -0.32 0.93 0.00 0.00 0.00 179.25 180.79 1dcp h GLU 11 N 0.00 0.27 -0.30 0.00 5.08 -2.01 -3.22 114.58 114.40 1dcp h GLU 11 Ca -0.00 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1dcp h GLU 11 Cb 0.91 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1dcp h GLU 11 CO 0.04 0.93 0.18 0.93 -1.00 0.00 0.00 179.01 180.08 1dcp h GLU 12 N -0.30 0.35 -0.43 2.33 5.08 -1.89 -2.99 114.58 116.73 1dcp h GLU 12 Ca -0.03 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.39 1dcp h GLU 12 Cb 1.02 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 30.11 1dcp h GLU 12 CO 0.06 0.23 -0.12 0.00 -1.00 0.00 0.00 179.01 178.19 1dcp h ARG 13 N 0.36 -0.01 -0.82 2.33 3.08 -1.21 -2.34 114.38 115.76 1dcp h ARG 13 Ca 0.12 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.31 1dcp h ARG 13 Cb -0.00 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 1dcp h ARG 13 CO -0.05 -0.01 0.54 -0.44 -1.07 0.00 0.00 179.97 178.93 1dcp h ASP 14 N -0.01 0.54 1.04 7.04 3.32 -1.53 0.10 116.42 126.91 1dcp h ASP 14 Ca 0.21 0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.14 1dcp h ASP 14 Cb 0.33 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1dcp h ASP 14 CO -0.45 0.28 -1.02 1.56 -1.72 0.00 0.00 179.24 177.90 1dcp h GLN 15 N 0.57 0.00 0.00 3.56 7.50 -1.34 -3.40 115.11 122.01 1dcp h GLN 15 Ca 0.41 0.00 -0.41 0.00 0.50 0.00 0.00 58.65 59.15 1dcp h GLN 15 Cb 0.75 0.00 -0.06 0.00 0.05 0.00 0.00 27.48 28.22 1dcp h GLN 15 CO -0.16 0.43 -2.36 1.28 -1.50 0.00 0.00 178.83 176.52 1dcp n LEU 16 N -3.06 1.81 -0.34 1.46 4.77 -0.94 -4.62 117.00 116.08 1dcp n LEU 16 Ca -0.04 0.27 0.14 0.00 -0.03 0.00 0.00 56.01 56.34 1dcp n LEU 16 Cb 0.81 -0.72 0.33 0.00 -2.33 0.00 0.00 43.42 41.51 1dcp n LEU 16 CO 0.42 0.54 1.15 -0.07 -1.33 0.00 0.00 177.39 178.10 1dcp h LEU 17 N -0.81 0.66 -0.20 2.23 3.38 -1.05 -3.22 115.31 116.30 1dcp h LEU 17 Ca -0.61 0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.50 1dcp h LEU 17 Cb 1.56 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.30 1dcp h LEU 17 CO -0.35 0.17 -0.12 -2.65 0.09 0.00 0.00 178.44 175.58 1dcp n PRO 18 N -4.86 -0.09 -0.12 1.13 -0.02 -1.26 0.20 135.00 129.98 1dcp n PRO 18 Ca 0.24 0.82 0.21 0.00 -2.02 0.00 0.00 63.50 62.74 1dcp n PRO 18 Cb 0.64 -1.21 0.62 0.00 -0.02 0.00 0.00 33.50 33.52 1dcp n PRO 18 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1dcp h ASN 19 N 0.00 0.17 0.05 2.55 4.21 -1.88 0.95 115.58 121.64 1dcp h ASN 19 Ca 0.03 0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.55 1dcp h ASN 19 Cb 0.08 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.26 1dcp h ASN 19 CO -0.19 0.08 -0.02 -0.07 -1.29 0.00 0.00 177.43 175.94 1dcp h LEU 20 N 0.18 -0.06 -0.60 1.61 3.38 -0.39 -2.62 115.31 116.81 1dcp h LEU 20 Ca 0.36 -0.59 0.11 0.00 0.09 0.00 0.00 57.88 57.84 1dcp h LEU 20 Cb 1.15 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.83 1dcp h LEU 20 CO -0.06 0.67 0.15 0.03 0.09 0.00 0.00 178.44 179.32 1dcp h ARG 21 N -0.89 0.28 -0.97 1.13 3.08 0.34 0.16 114.38 117.51 1dcp h ARG 21 Ca -0.01 -0.02 0.17 0.00 0.07 0.00 0.00 59.98 60.20 1dcp h ARG 21 Cb 0.65 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.54 1dcp h ARG 21 CO 0.01 0.19 0.61 0.00 -1.07 0.00 0.00 179.97 179.71 1dcp h ALA 22 N 1.46 1.77 -0.01 0.04 0.00 0.91 -1.70 119.26 121.74 1dcp h ALA 22 Ca 0.31 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1dcp h ALA 22 Cb 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1dcp h ALA 22 CO -0.38 -0.08 -0.07 1.33 0.00 0.00 0.00 179.25 180.05 1dcp n VAL 23 N -4.65 0.00 0.00 0.00 0.24 -0.10 -4.91 118.33 108.91 1dcp n VAL 23 Ca 0.21 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 1dcp n VAL 23 Cb 0.54 0.27 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 1dcp n VAL 23 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dcp n GLY 24 N 1.20 0.92 3.76 7.63 0.00 -0.64 -5.09 105.19 112.97 1dcp n GLY 24 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1dcp n GLY 24 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1dcp s TRP 25 N -2.00 3.73 0.11 1.61 0.52 -0.38 -4.75 118.94 117.78 1dcp s TRP 25 Ca 0.00 1.79 0.07 0.00 0.02 0.00 0.00 56.10 57.98 1dcp s TRP 25 Cb 0.00 -3.13 -0.04 0.00 -1.15 0.00 0.00 33.47 29.15 1dcp s TRP 25 CO 0.00 -0.11 -0.17 -0.80 0.02 0.00 0.00 176.95 175.89 1dcp s ASN 26 N -1.09 2.22 -0.11 2.95 0.01 -0.13 -3.99 114.94 114.80 1dcp s ASN 26 Ca 0.44 -0.74 -0.11 0.00 -0.71 0.00 0.00 52.86 51.74 1dcp s ASN 26 Cb -0.28 -0.10 -0.05 0.00 0.41 0.00 0.00 41.25 41.23 1dcp s ASN 26 CO 0.36 -0.05 0.24 -1.61 -1.51 0.00 0.00 177.10 174.52 1dcp s GLU 27 N -2.28 3.81 -0.06 -0.60 2.02 -1.26 0.64 118.70 120.97 1dcp s GLU 27 Ca 0.07 0.04 -0.18 0.00 0.02 0.00 0.00 54.97 54.92 1dcp s GLU 27 Cb -0.08 -3.27 -0.05 0.00 0.10 0.00 0.00 34.13 30.84 1dcp s GLU 27 CO 0.04 0.60 0.50 -0.51 0.02 0.00 0.00 175.26 175.91 1dcp s LEU 28 N -0.59 4.36 -0.08 1.80 1.43 -0.56 -4.96 118.68 120.08 1dcp s LEU 28 Ca 0.17 0.95 -0.29 0.00 -1.03 0.00 0.00 54.13 53.94 1dcp s LEU 28 Cb -0.13 -2.75 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 1dcp s LEU 28 CO 0.06 0.09 0.96 -1.61 0.23 0.00 0.00 176.35 176.07 1dcp s GLU 29 N 0.05 4.44 0.00 1.70 2.02 -1.26 -3.13 118.70 122.52 1dcp s GLU 29 Ca 0.27 1.31 0.00 0.00 0.02 0.00 0.00 54.97 56.58 1dcp s GLU 29 Cb -0.16 -3.52 0.00 0.00 0.10 0.00 0.00 34.13 30.55 1dcp s GLU 29 CO 0.13 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.60 1dcp n GLY 30 N 3.09 2.18 3.41 -1.39 0.00 -1.26 -5.05 105.19 106.17 1dcp n GLY 30 Ca 0.07 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.26 1dcp n GLY 30 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1dcp s ARG 31 N 0.00 1.02 -1.22 1.61 1.70 -1.18 -5.08 118.95 115.80 1dcp s ARG 31 Ca 0.00 -0.15 -0.20 0.00 -0.47 0.00 0.00 55.73 54.91 1dcp s ARG 31 Cb 0.00 0.47 0.01 0.00 -0.57 0.00 0.00 34.95 34.86 1dcp s ARG 31 CO 0.00 -0.36 1.79 0.34 -1.08 0.00 0.00 175.30 175.99 1dcp s ASP 32 N -1.81 6.11 -0.02 -2.89 2.15 -1.26 -4.25 116.67 114.71 1dcp s ASP 32 Ca -0.07 -2.02 -0.23 0.00 0.43 0.00 0.00 52.55 50.66 1dcp s ASP 32 Cb -0.01 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 40.08 1dcp s ASP 32 CO 0.01 -1.92 0.51 0.00 -0.17 0.00 0.00 175.17 173.59 1dcp s ALA 33 N 6.88 -1.30 0.19 3.66 0.00 -1.26 -2.49 121.76 127.44 1dcp s ALA 33 Ca 0.59 0.81 0.08 0.00 0.00 0.00 0.00 51.96 53.44 1dcp s ALA 33 Cb 0.02 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 1dcp s ALA 33 CO 0.08 -0.35 -0.02 0.96 0.00 0.00 0.00 175.76 176.43 1dcp s ILE 34 N -1.45 3.56 0.11 0.00 -4.36 -0.59 -1.50 121.20 116.97 1dcp s ILE 34 Ca -0.11 -1.55 -0.01 0.00 -0.26 0.00 0.00 60.65 58.73 1dcp s ILE 34 Cb -0.02 -2.80 -0.04 0.00 1.25 0.00 0.00 42.46 40.85 1dcp s ILE 34 CO 0.06 -0.15 0.01 0.12 0.24 0.00 0.00 174.94 175.22 1dcp s PHE 35 N -1.81 0.79 -0.29 1.37 2.19 0.21 -1.89 117.98 118.54 1dcp s PHE 35 Ca 0.27 -1.13 -0.24 0.00 0.33 0.00 0.00 56.93 56.16 1dcp s PHE 35 Cb -0.09 -0.48 0.16 0.00 -1.31 0.00 0.00 43.02 41.31 1dcp s PHE 35 CO 0.18 -0.41 1.24 0.21 1.83 0.00 0.00 175.22 178.27 1dcp s LYS 36 N -3.98 0.26 -0.23 10.12 2.20 -0.88 -0.96 119.74 126.28 1dcp s LYS 36 Ca 0.17 0.32 -0.05 0.00 -0.36 0.00 0.00 55.97 56.05 1dcp s LYS 36 Cb 0.07 0.12 -0.02 0.00 -1.51 0.00 0.00 37.83 36.50 1dcp s LYS 36 CO -0.02 -0.03 0.01 -1.14 -0.36 0.00 0.00 175.35 173.80 1dcp s GLN 37 N 0.22 3.51 0.05 4.03 2.00 -1.26 0.16 119.66 128.37 1dcp s GLN 37 Ca 0.04 -0.56 0.03 0.00 -2.00 0.00 0.00 55.36 52.88 1dcp s GLN 37 Cb -0.05 -3.14 -0.04 0.00 0.80 0.00 0.00 33.01 30.58 1dcp s GLN 37 CO -0.11 -0.18 0.01 -0.06 -0.50 0.00 0.00 175.29 174.45 1dcp s PHE 38 N 1.50 3.06 -0.06 1.67 0.40 0.13 -4.95 117.98 119.72 1dcp s PHE 38 Ca 0.06 0.04 0.02 0.00 -0.60 0.00 0.00 56.93 56.44 1dcp s PHE 38 Cb -0.15 -1.61 0.02 0.00 0.51 0.00 0.00 43.02 41.79 1dcp s PHE 38 CO -0.00 0.48 -0.10 -1.58 0.70 0.00 0.00 175.22 174.72 1dcp s HIS 39 N -1.24 1.28 0.34 0.36 2.46 -1.26 -0.55 115.29 116.69 1dcp s HIS 39 Ca 0.24 -0.45 0.07 0.00 0.47 0.00 0.00 55.06 55.39 1dcp s HIS 39 Cb -0.12 -0.97 -0.07 0.00 -0.13 0.00 0.00 32.58 31.30 1dcp s HIS 39 CO 0.16 -0.25 -0.04 -0.06 -2.47 0.00 0.00 174.74 172.08 1dcp s PHE 40 N 0.72 2.27 0.39 3.88 0.08 0.08 -5.01 117.98 120.39 1dcp s PHE 40 Ca -0.14 -0.65 0.15 0.00 0.12 0.00 0.00 56.93 56.41 1dcp s PHE 40 Cb -0.15 -1.41 0.90 0.00 -0.57 0.00 0.00 43.02 41.79 1dcp s PHE 40 CO 0.03 0.40 1.91 -0.22 -0.10 0.00 0.00 175.22 177.23 1dcp h LYS 41 N 2.03 0.00 0.00 0.44 3.64 -1.91 -3.45 116.57 117.32 1dcp h LYS 41 Ca -0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1dcp h LYS 41 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1dcp h LYS 41 CO 0.72 0.28 0.23 -0.40 -2.27 0.00 0.00 179.45 178.01 1dcp n ASP 42 N -4.08 -1.51 0.07 4.20 5.68 -1.26 -5.01 116.55 114.63 1dcp n ASP 42 Ca -0.02 -2.01 -0.08 0.00 -0.50 0.00 0.00 54.79 52.18 1dcp n ASP 42 Cb 0.34 2.51 0.06 0.00 -1.14 0.00 0.00 41.12 42.89 1dcp n ASP 42 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1dcp h PHE 43 N 1.68 0.41 0.02 2.11 3.57 -1.92 -1.43 116.94 121.39 1dcp h PHE 43 Ca -0.22 -0.18 0.02 0.00 3.53 0.00 0.00 57.97 61.12 1dcp h PHE 43 Cb 0.84 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 1dcp h PHE 43 CO 0.00 0.90 -0.11 -0.97 -2.23 0.00 0.00 178.31 175.90 1dcp h ASN 44 N 0.21 -0.31 -0.08 0.41 -0.73 -1.97 1.83 115.58 114.95 1dcp h ASN 44 Ca -0.02 0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.19 1dcp h ASN 44 Cb 1.25 0.13 -0.00 0.00 0.27 0.00 0.00 38.32 39.96 1dcp h ASN 44 CO 0.11 -0.16 0.03 0.03 -0.37 0.00 0.00 177.43 177.07 1dcp h ARG 45 N -0.20 0.12 -0.46 6.67 3.08 -1.96 0.40 114.38 122.02 1dcp h ARG 45 Ca 0.03 -0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.15 1dcp h ARG 45 Cb 0.24 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.18 1dcp h ARG 45 CO -0.09 0.28 -0.15 0.00 -1.07 0.00 0.00 179.97 178.94 1dcp h ALA 46 N 0.84 0.24 -0.27 0.04 0.00 -0.70 0.30 119.26 119.71 1dcp h ALA 46 Ca 0.03 0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 1dcp h ALA 46 Cb 0.21 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1dcp h ALA 46 CO -0.00 -0.49 -0.38 0.35 0.00 0.00 0.00 179.25 178.73 1dcp h PHE 47 N -0.05 0.73 -0.49 0.00 3.57 0.31 -1.12 116.94 119.90 1dcp h PHE 47 Ca 0.22 -0.21 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1dcp h PHE 47 Cb 0.39 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1dcp h PHE 47 CO -0.43 0.91 0.12 0.78 -2.23 0.00 0.00 178.31 177.46 1dcp h GLY 48 N 1.02 0.80 0.98 2.40 0.00 0.60 -1.38 103.07 107.48 1dcp h GLY 48 Ca 0.05 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1dcp h GLY 48 CO 0.08 0.42 -0.12 -2.75 0.00 0.00 0.00 176.54 174.17 1dcp h PHE 49 N 0.72 -0.32 -0.83 5.60 3.57 -0.03 -2.47 116.94 123.19 1dcp h PHE 49 Ca 0.16 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.75 1dcp h PHE 49 Cb 0.27 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.06 1dcp h PHE 49 CO 0.01 -0.18 0.54 0.52 -2.23 0.00 0.00 178.31 176.97 1dcp h MET 50 N -0.37 0.77 0.06 1.11 2.86 -0.47 -2.15 114.93 116.74 1dcp h MET 50 Ca -0.04 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1dcp h MET 50 Cb 0.28 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1dcp h MET 50 CO 0.06 0.51 -0.03 1.15 1.06 0.00 0.00 176.91 179.66 1dcp h THR 51 N 0.79 0.95 -0.89 2.22 2.02 -1.06 0.76 112.91 117.70 1dcp h THR 51 Ca 0.38 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.51 1dcp h THR 51 Cb 0.43 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1dcp h THR 51 CO -0.15 0.01 0.50 0.03 0.37 0.00 0.00 175.52 176.28 1dcp h ARG 52 N -0.10 1.24 0.06 6.66 3.08 -0.97 -0.58 114.38 123.76 1dcp h ARG 52 Ca -0.01 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1dcp h ARG 52 Cb 0.08 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.88 1dcp h ARG 52 CO 0.01 0.89 -0.03 0.28 -1.07 0.00 0.00 179.97 180.06 1dcp h VAL 53 N 1.24 0.99 -0.82 2.04 2.07 -1.18 -1.93 116.25 118.66 1dcp h VAL 53 Ca 0.32 -0.15 0.20 0.00 0.82 0.00 0.00 66.70 67.89 1dcp h VAL 53 Cb 0.00 1.09 -0.13 0.00 -1.52 0.00 0.00 31.29 30.74 1dcp h VAL 53 CO -0.05 0.04 0.21 0.00 0.02 0.00 0.00 177.57 177.78 1dcp h ALA 54 N 0.80 1.13 -0.38 1.67 0.00 0.14 0.32 119.26 122.94 1dcp h ALA 54 Ca -0.01 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1dcp h ALA 54 Cb 0.12 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1dcp h ALA 54 CO 0.01 -0.40 0.23 -0.07 0.00 0.00 0.00 179.25 179.03 1dcp h LEU 55 N 0.24 0.45 -0.19 0.00 3.38 -0.68 -1.59 115.31 116.92 1dcp h LEU 55 Ca 0.49 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.40 1dcp h LEU 55 Cb 0.92 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1dcp h LEU 55 CO -0.59 0.36 0.06 1.56 0.09 0.00 0.00 178.44 179.92 1dcp h GLN 56 N 0.50 0.30 -0.70 1.13 1.08 -0.37 -2.06 115.11 115.00 1dcp h GLN 56 Ca 0.14 -0.07 0.13 0.00 -1.45 0.00 0.00 58.65 57.40 1dcp h GLN 56 Cb -0.01 -0.04 -0.13 0.00 -0.05 0.00 0.00 27.48 27.25 1dcp h GLN 56 CO -0.03 0.41 -0.28 0.00 -0.95 0.00 0.00 178.83 177.98 1dcp h ALA 57 N 0.88 0.21 -0.37 3.87 0.00 -0.03 0.62 119.26 124.44 1dcp h ALA 57 Ca 0.06 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1dcp h ALA 57 Cb 0.23 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1dcp h ALA 57 CO -0.00 -0.56 0.22 0.93 0.00 0.00 0.00 179.25 179.84 1dcp h GLU 58 N -0.08 0.50 -0.63 0.00 4.39 -1.26 1.09 114.58 118.59 1dcp h GLU 58 Ca 0.30 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 60.01 1dcp h GLU 58 Cb 0.55 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.05 1dcp h GLU 58 CO -0.75 0.37 0.35 -0.22 -1.16 0.00 0.00 179.01 177.60 1dcp h LYS 59 N 0.48 0.63 0.10 2.33 3.64 -0.44 -2.85 116.57 120.46 1dcp h LYS 59 Ca 0.13 -0.04 -0.27 0.00 -1.27 0.00 0.00 60.65 59.21 1dcp h LYS 59 Cb 0.00 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1dcp h LYS 59 CO -0.02 0.42 -1.24 -0.07 -2.27 0.00 0.00 179.45 176.26 1dcp h LEU 60 N 0.65 0.32 -1.31 5.20 3.38 -0.73 -3.48 115.31 119.33 1dcp h LEU 60 Ca 0.28 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1dcp h LEU 60 Cb 0.17 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1dcp h LEU 60 CO -0.18 1.28 -0.05 -0.67 0.09 0.00 0.00 178.44 178.91 1dcp n ASP 61 N -3.47 -2.22 -3.56 -0.43 2.03 0.36 -5.04 116.55 104.21 1dcp n ASP 61 Ca -0.08 -0.04 -0.22 0.00 0.52 0.00 0.00 54.79 54.97 1dcp n ASP 61 Cb 1.01 -0.84 -0.15 0.00 -0.72 0.00 0.00 41.12 40.42 1dcp n ASP 61 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1dcp s HIS 62 N -3.02 -0.02 0.12 -0.67 2.46 0.03 -5.02 115.29 109.16 1dcp s HIS 62 Ca 0.03 -0.05 0.05 0.00 0.47 0.00 0.00 55.06 55.56 1dcp s HIS 62 Cb -0.01 -0.54 -0.04 0.00 -0.13 0.00 0.00 32.58 31.86 1dcp s HIS 62 CO 0.05 -0.53 0.02 -1.01 -2.47 0.00 0.00 174.74 170.80 1dcp s HIS 63 N 2.22 2.98 0.45 3.88 3.76 -1.26 -4.36 115.29 122.96 1dcp s HIS 63 Ca 0.04 -0.05 -0.03 0.00 -0.15 0.00 0.00 55.06 54.87 1dcp s HIS 63 Cb -0.16 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.00 1dcp s HIS 63 CO -0.10 0.49 0.72 -1.25 -0.85 0.00 0.00 174.74 173.75 1dcp s PRO 64 N -2.54 3.43 -0.50 8.40 0.04 -1.26 -4.88 135.00 137.69 1dcp s PRO 64 Ca 0.27 -0.03 -0.06 0.00 0.04 0.00 0.00 61.00 61.22 1dcp s PRO 64 Cb -0.11 -2.46 0.13 0.00 0.04 0.00 0.00 34.50 32.10 1dcp s PRO 64 CO 0.19 -0.15 0.35 -1.21 0.04 0.00 0.00 177.00 176.22 1dcp s GLU 65 N -4.62 2.41 0.11 4.56 2.02 -1.03 -4.98 118.70 117.18 1dcp s GLU 65 Ca 0.46 -1.98 0.06 0.00 0.02 0.00 0.00 54.97 53.53 1dcp s GLU 65 Cb -0.10 -3.81 -0.04 0.00 0.10 0.00 0.00 34.13 30.28 1dcp s GLU 65 CO 0.42 -1.16 -0.16 1.67 0.02 0.00 0.00 175.26 176.05 1dcp s TRP 66 N 0.93 1.47 0.03 1.61 -2.14 -1.26 -0.18 118.94 119.40 1dcp s TRP 66 Ca 0.09 -0.50 0.09 0.00 2.66 0.00 0.00 56.10 58.44 1dcp s TRP 66 Cb -0.23 -0.78 -0.03 0.00 -3.10 0.00 0.00 33.47 29.33 1dcp s TRP 66 CO -0.03 0.15 -0.25 0.12 -2.66 0.00 0.00 176.95 174.28 1dcp s PHE 67 N -1.74 2.20 -0.00 1.66 5.36 -0.99 -4.96 117.98 119.50 1dcp s PHE 67 Ca 0.06 -0.41 0.01 0.00 -0.96 0.00 0.00 56.93 55.63 1dcp s PHE 67 Cb -0.07 -1.34 -0.00 0.00 -0.34 0.00 0.00 43.02 41.27 1dcp s PHE 67 CO 0.03 0.09 -0.02 1.21 -1.46 0.00 0.00 175.22 175.07 1dcp s ASN 68 N -1.09 0.20 -0.24 6.13 3.84 -1.26 -1.95 114.94 120.57 1dcp s ASN 68 Ca 0.10 -0.03 -0.04 0.00 0.21 0.00 0.00 52.86 53.11 1dcp s ASN 68 Cb -0.10 -0.02 0.09 0.00 -0.55 0.00 0.00 41.25 40.67 1dcp s ASN 68 CO 0.01 0.02 0.16 0.54 -2.79 0.00 0.00 177.10 175.05 1dcp s VAL 69 N -0.02 -0.18 0.00 -5.21 0.11 -1.13 -5.05 120.40 108.92 1dcp s VAL 69 Ca 0.00 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 1dcp s VAL 69 Cb -0.01 -0.82 0.00 0.00 -1.53 0.00 0.00 36.38 34.03 1dcp s VAL 69 CO -0.00 -0.47 0.00 0.00 -3.33 0.00 0.00 175.10 171.30 1dcp n TYR 70 N 5.28 0.00 -0.20 1.54 9.36 -1.26 -2.84 117.16 129.03 1dcp n TYR 70 Ca -0.06 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.28 1dcp n TYR 70 Cb 0.46 0.00 0.29 0.00 -0.63 0.00 0.00 39.34 39.46 1dcp n TYR 70 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1dcp n ASN 71 N 8.98 3.79 -4.20 2.98 6.94 -1.26 -4.20 115.26 128.29 1dcp n ASN 71 Ca 0.00 -1.99 -0.20 0.00 -0.02 0.00 0.00 54.58 52.36 1dcp n ASN 71 Cb 0.00 -0.42 -0.12 0.00 -2.36 0.00 0.00 39.78 36.88 1dcp n ASN 71 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 1dcp s LYS 72 N -1.11 0.95 -0.03 -3.83 0.00 -1.13 -0.74 119.74 113.85 1dcp s LYS 72 Ca 0.45 -0.97 0.01 0.00 0.00 0.00 0.00 55.97 55.46 1dcp s LYS 72 Cb 0.24 -1.03 0.02 0.00 0.00 0.00 0.00 37.83 37.06 1dcp s LYS 72 CO 0.32 0.24 -0.02 0.14 0.00 0.00 0.00 175.35 176.03 1dcp s VAL 73 N -1.14 0.33 -0.20 1.79 -7.23 0.29 -2.84 120.40 111.41 1dcp s VAL 73 Ca 0.01 -0.03 -0.11 0.00 -1.81 0.00 0.00 61.98 60.05 1dcp s VAL 73 Cb -0.10 -0.38 -0.05 0.00 0.56 0.00 0.00 36.38 36.41 1dcp s VAL 73 CO 0.03 0.17 0.15 -1.00 -0.31 0.00 0.00 175.10 174.14 1dcp s HIS 74 N 0.82 3.41 -0.05 2.82 3.76 -0.82 0.18 115.29 125.41 1dcp s HIS 74 Ca -0.09 0.36 0.05 0.00 -0.15 0.00 0.00 55.06 55.23 1dcp s HIS 74 Cb -0.13 -2.19 -0.02 0.00 1.11 0.00 0.00 32.58 31.36 1dcp s HIS 74 CO -0.01 0.27 -0.20 0.42 -0.85 0.00 0.00 174.74 174.38 1dcp s ILE 75 N 0.40 2.56 -0.11 0.60 1.01 0.42 -2.36 121.20 123.72 1dcp s ILE 75 Ca 0.09 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1dcp s ILE 75 Cb -0.11 -1.97 0.02 0.00 0.01 0.00 0.00 42.46 40.41 1dcp s ILE 75 CO -0.01 0.58 -0.11 -0.89 0.00 0.00 0.00 174.94 174.51 1dcp s THR 76 N -0.47 1.23 -0.06 2.92 2.01 0.75 -2.06 115.64 119.95 1dcp s THR 76 Ca 0.06 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 61.65 1dcp s THR 76 Cb -0.12 -1.19 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 1dcp s THR 76 CO 0.01 0.40 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.39 1dcp s LEU 77 N 1.40 2.43 -0.09 4.42 1.43 -0.79 -2.46 118.68 125.02 1dcp s LEU 77 Ca 0.00 -0.36 -0.30 0.00 -1.03 0.00 0.00 54.13 52.45 1dcp s LEU 77 Cb -0.13 -1.48 0.11 0.00 0.03 0.00 0.00 46.19 44.72 1dcp s LEU 77 CO -0.06 0.28 0.91 -0.55 0.23 0.00 0.00 176.35 177.16 1dcp s SER 78 N -0.34 -0.41 -0.34 2.29 0.15 -1.26 -1.54 113.70 112.25 1dcp s SER 78 Ca 0.02 0.31 -0.10 0.00 0.70 0.00 0.00 55.95 56.89 1dcp s SER 78 Cb -0.13 0.37 0.01 0.00 -1.71 0.00 0.00 66.02 64.57 1dcp s SER 78 CO 0.02 -0.48 0.16 -0.89 1.20 0.00 0.00 173.24 173.26 1dcp s THR 79 N -1.80 4.44 0.15 6.45 2.01 0.43 -4.94 115.64 122.37 1dcp s THR 79 Ca -0.01 -0.71 -0.24 0.00 0.31 0.00 0.00 61.69 61.04 1dcp s THR 79 Cb -0.01 -3.38 0.01 0.00 0.01 0.00 0.00 72.50 69.13 1dcp s THR 79 CO -0.01 -0.09 1.61 0.45 -0.69 0.00 0.00 174.62 175.90 1dcp h HIS 80 N 8.36 -0.80 -0.42 4.92 3.86 -1.96 -1.75 115.15 127.35 1dcp h HIS 80 Ca -0.28 0.04 0.04 0.00 -1.16 0.00 0.00 60.37 59.01 1dcp h HIS 80 Cb 1.12 0.39 -0.05 0.00 1.06 0.00 0.00 27.41 29.93 1dcp h HIS 80 CO 0.60 -0.37 -0.25 0.39 0.86 0.00 0.00 177.93 179.16 1dcp n GLU 81 N -5.40 -0.19 -0.87 2.45 1.02 -1.26 -1.25 120.64 115.14 1dcp n GLU 81 Ca -0.02 0.86 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 1dcp n GLU 81 Cb 0.32 -1.27 0.32 0.00 -0.02 0.00 0.00 31.44 30.79 1dcp n GLU 81 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dcp n ALA 83 N -0.07 -1.35 -3.02 0.00 0.00 -0.38 -4.59 120.51 111.10 1dcp n ALA 83 Ca 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1dcp n ALA 83 Cb 1.23 -2.86 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1dcp n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dcp n GLY 84 N -1.42 0.50 3.76 0.00 0.00 -1.09 -4.66 105.19 102.29 1dcp n GLY 84 Ca 0.03 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.87 1dcp n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dcp s LEU 85 N 0.00 3.83 0.28 0.99 1.43 -1.04 -0.43 118.68 123.74 1dcp s LEU 85 Ca 0.01 2.34 -0.04 0.00 -1.03 0.00 0.00 54.13 55.40 1dcp s LEU 85 Cb -0.00 -4.44 -0.01 0.00 0.03 0.00 0.00 46.19 41.77 1dcp s LEU 85 CO -0.00 -1.25 0.36 -0.94 0.23 0.00 0.00 176.35 174.76 1dcp s SER 86 N -1.49 0.50 0.31 2.29 1.04 -1.26 -2.10 113.70 112.99 1dcp s SER 86 Ca 0.71 -1.33 0.09 0.00 0.48 0.00 0.00 55.95 55.90 1dcp s SER 86 Cb -0.29 0.55 0.87 0.00 0.10 0.00 0.00 66.02 67.25 1dcp s SER 86 CO 0.33 -1.11 1.72 -0.08 0.98 0.00 0.00 173.24 175.08 1dcp h GLU 87 N 2.29 0.51 0.84 4.02 4.81 -1.96 -2.38 114.58 122.70 1dcp h GLU 87 Ca -0.29 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.87 1dcp h GLU 87 Cb 1.24 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1dcp h GLU 87 CO 0.41 0.34 -0.47 0.00 -0.73 0.00 0.00 179.01 178.56 1dcp h ARG 88 N 0.53 -1.16 -1.15 1.92 3.08 -1.96 0.65 114.38 116.28 1dcp h ARG 88 Ca 0.63 0.08 0.33 0.00 0.07 0.00 0.00 59.98 61.09 1dcp h ARG 88 Cb 1.22 0.26 -0.09 0.00 0.08 0.00 0.00 29.97 31.45 1dcp h ARG 88 CO -0.50 -0.78 0.77 -0.44 -1.07 0.00 0.00 179.97 177.96 1dcp h ASP 89 N -1.21 0.29 0.57 7.04 3.32 -1.82 0.29 116.42 124.90 1dcp h ASP 89 Ca -0.11 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 1dcp h ASP 89 Cb 0.95 0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.54 1dcp h ASP 89 CO 0.15 0.01 -0.27 0.40 -1.72 0.00 0.00 179.24 177.80 1dcp h ILE 90 N 0.23 0.23 -0.33 0.35 1.08 -0.99 0.18 117.51 118.25 1dcp h ILE 90 Ca 0.64 -0.39 0.07 0.00 -0.39 0.00 0.00 64.86 64.79 1dcp h ILE 90 Cb 1.96 0.32 -0.08 0.00 -3.07 0.00 0.00 36.82 35.95 1dcp h ILE 90 CO -0.24 0.04 -0.29 0.78 -0.69 0.00 0.00 178.15 177.75 1dcp h ASN 91 N -1.08 -0.94 0.01 1.72 2.35 0.84 0.81 115.58 119.28 1dcp h ASN 91 Ca -0.08 0.17 0.03 0.00 -0.55 0.00 0.00 56.30 55.87 1dcp h ASN 91 Cb 0.64 0.44 -0.04 0.00 0.05 0.00 0.00 38.32 39.42 1dcp h ASN 91 CO 0.13 -0.31 -0.19 0.25 -1.65 0.00 0.00 177.43 175.66 1dcp h LEU 92 N -0.26 -0.57 -1.39 1.61 5.85 -0.56 -0.50 115.31 119.50 1dcp h LEU 92 Ca 0.16 0.08 0.11 0.00 0.84 0.00 0.00 57.88 59.07 1dcp h LEU 92 Cb 0.51 0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.72 1dcp h LEU 92 CO -0.47 -0.26 0.52 0.00 -0.34 0.00 0.00 178.44 177.89 1dcp h ALA 93 N 0.58 1.85 -0.20 1.25 0.00 0.13 0.33 119.26 123.19 1dcp h ALA 93 Ca 0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1dcp h ALA 93 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1dcp h ALA 93 CO -0.18 -0.03 0.07 0.77 0.00 0.00 0.00 179.25 179.89 1dcp h SER 94 N 0.65 0.29 -0.38 0.00 0.02 0.33 -1.71 113.55 112.75 1dcp h SER 94 Ca 0.38 -0.19 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1dcp h SER 94 Cb 0.56 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1dcp h SER 94 CO -0.14 0.40 0.16 0.15 -1.14 0.00 0.00 176.83 176.25 1dcp h PHE 95 N 0.16 0.29 -0.83 3.45 3.57 0.46 -1.14 116.94 122.91 1dcp h PHE 95 Ca 0.07 0.02 0.16 0.00 3.53 0.00 0.00 57.97 61.74 1dcp h PHE 95 Cb 0.21 -0.07 -0.10 0.00 2.79 0.00 0.00 35.95 38.78 1dcp h PHE 95 CO -0.00 0.13 0.40 0.82 -2.23 0.00 0.00 178.31 177.43 1dcp h ILE 96 N 0.33 0.67 -0.22 1.41 2.04 0.07 -0.58 117.51 121.24 1dcp h ILE 96 Ca 0.17 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1dcp h ILE 96 Cb 0.12 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.26 1dcp h ILE 96 CO -0.15 0.10 0.13 -0.33 0.00 0.00 0.00 178.15 177.90 1dcp h GLU 97 N 0.55 0.26 -0.12 2.37 4.39 -0.33 0.62 114.58 122.32 1dcp h GLU 97 Ca 0.47 -0.02 0.03 0.00 0.34 0.00 0.00 59.36 60.18 1dcp h GLU 97 Cb 0.71 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 1dcp h GLU 97 CO -0.40 0.17 -0.06 1.96 -1.16 0.00 0.00 179.01 179.53 1dcp h GLN 98 N 0.27 -0.04 -0.65 2.33 1.08 -0.53 -1.89 115.11 115.67 1dcp h GLN 98 Ca 0.09 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.40 1dcp h GLN 98 Cb -0.00 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.36 1dcp h GLN 98 CO -0.04 -0.03 0.23 0.28 -0.95 0.00 0.00 178.83 178.32 1dcp h VAL 99 N -0.04 0.71 -0.88 -0.54 2.07 -0.82 -2.19 116.25 114.55 1dcp h VAL 99 Ca 0.07 -0.13 0.09 0.00 0.82 0.00 0.00 66.70 67.54 1dcp h VAL 99 Cb 0.14 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.14 1dcp h VAL 99 CO -0.15 0.07 0.57 0.00 0.02 0.00 0.00 177.57 178.08 1dcp h ALA 100 N 1.47 1.61 -0.67 1.67 0.00 -0.10 -1.27 119.26 121.96 1dcp h ALA 100 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1dcp h ALA 100 Cb 0.47 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1dcp h ALA 100 CO -0.36 0.22 0.43 0.28 0.00 0.00 0.00 179.25 179.83 1dcp h VAL 101 N 0.91 1.18 0.00 0.00 2.07 -0.86 -1.83 116.25 117.72 1dcp h VAL 101 Ca 0.40 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1dcp h VAL 101 Cb 0.35 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1dcp h VAL 101 CO -0.16 0.17 0.00 -1.54 0.02 0.00 0.00 177.57 176.06 1dcp n SER 102 N -4.61 1.26 -3.75 0.57 3.41 -0.48 -4.49 113.62 105.54 1dcp n SER 102 Ca 0.06 -0.95 -0.30 0.00 -0.26 0.00 0.00 58.87 57.42 1dcp n SER 102 Cb 0.03 -0.24 -0.13 0.00 -0.26 0.00 0.00 64.21 63.61 1dcp n SER 102 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1dcp s MET 103 N 0.27 1.30 0.00 4.33 -1.94 -0.69 -5.08 119.30 117.48 1dcp s MET 103 Ca 0.00 -1.96 0.00 0.00 -1.71 0.00 0.00 55.69 52.02 1dcp s MET 103 Cb 0.00 -2.42 0.00 0.00 2.01 0.00 0.00 34.83 34.42 1dcp s MET 103 CO 0.00 -1.13 0.00 2.41 -0.01 0.00 0.00 175.02 176.29