#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 2.14 -1.24 -1.40 0.63 -1.23 -4.35 116.66 111.21 1dcp n ARG 7 Ca 0.00 0.67 -0.37 0.00 -0.92 0.00 0.00 57.85 57.24 1dcp n ARG 7 Cb 0.00 -3.06 0.06 0.00 0.45 0.00 0.00 32.46 29.91 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 10.01 -0.52 -4.96 6.15 4.77 -0.05 -4.98 117.00 127.42 1dcp n LEU 8 Ca 0.28 0.57 -0.24 0.00 -0.03 0.00 0.00 56.01 56.59 1dcp n LEU 8 Cb 0.40 -1.11 0.08 0.00 -2.33 0.00 0.00 43.42 40.46 1dcp n LEU 8 CO 0.68 -3.65 0.52 -0.94 -1.33 0.00 0.00 177.39 172.68 1dcp s SER 9 N -1.35 4.73 0.36 -1.43 1.04 -1.26 -4.83 113.70 110.96 1dcp s SER 9 Ca 0.62 0.03 0.27 0.00 0.48 0.00 0.00 55.95 57.34 1dcp s SER 9 Cb -0.36 -0.64 1.06 0.00 0.10 0.00 0.00 66.02 66.19 1dcp s SER 9 CO 0.62 -1.59 1.80 0.00 0.98 0.00 0.00 173.24 175.05 1dcp h ALA 10 N -0.40 1.00 0.00 5.32 0.00 -1.96 1.62 119.26 124.84 1dcp h ALA 10 Ca -0.41 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1dcp h ALA 10 Cb 1.29 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1dcp h ALA 10 CO 0.50 0.00 -0.19 1.49 0.00 0.00 0.00 179.25 181.05 1dcp h GLU 11 N 0.00 0.00 -0.65 0.00 4.81 -1.97 0.16 114.58 116.93 1dcp h GLU 11 Ca 0.00 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 1dcp h GLU 11 Cb 0.47 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.76 1dcp h GLU 11 CO 0.00 0.35 0.18 0.93 -0.73 0.00 0.00 179.01 179.73 1dcp h GLU 12 N -1.00 0.30 0.36 1.92 5.08 -1.87 0.28 114.58 119.65 1dcp h GLU 12 Ca -0.03 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1dcp h GLU 12 Cb 0.45 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1dcp h GLU 12 CO -0.02 0.20 -0.24 0.00 -1.00 0.00 0.00 179.01 177.95 1dcp h ARG 13 N 0.31 -0.56 0.00 2.33 3.08 0.23 0.90 114.38 120.67 1dcp h ARG 13 Ca 0.35 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.44 1dcp h ARG 13 Cb 0.53 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1dcp h ARG 13 CO -0.41 -0.38 0.00 -0.44 -1.07 0.00 0.00 179.97 177.67 1dcp h ASP 14 N -0.59 0.00 0.12 7.04 3.32 0.04 0.78 116.42 127.13 1dcp h ASP 14 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1dcp h ASP 14 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1dcp h ASP 14 CO 0.03 0.00 -1.12 1.67 -1.72 0.00 0.00 179.24 178.10 1dcp n GLN 15 N -2.93 0.15 -0.02 3.56 7.27 0.02 -4.47 117.38 120.96 1dcp n GLN 15 Ca -0.02 -0.03 -0.03 0.00 0.07 0.00 0.00 57.00 56.99 1dcp n GLN 15 Cb 0.09 -1.52 -0.03 0.00 2.41 0.00 0.00 30.24 31.19 1dcp n GLN 15 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1dcp n LEU 16 N -1.70 0.76 -0.11 1.69 4.77 0.24 -4.73 117.00 117.92 1dcp n LEU 16 Ca 0.03 -0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 55.91 1dcp n LEU 16 Cb 0.39 0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.57 1dcp n LEU 16 CO 0.42 0.23 0.70 -0.07 -1.33 0.00 0.00 177.39 177.35 1dcp h LEU 17 N 0.00 0.86 -0.95 2.23 3.38 -1.20 -3.35 115.31 116.28 1dcp h LEU 17 Ca -0.12 -0.31 0.13 0.00 0.09 0.00 0.00 57.88 57.66 1dcp h LEU 17 Cb 1.26 -0.24 -0.14 0.00 0.09 0.00 0.00 40.66 41.63 1dcp h LEU 17 CO -0.00 1.04 -0.43 -2.65 0.09 0.00 0.00 178.44 176.50 1dcp n PRO 18 N -4.11 -0.28 -0.09 1.13 -0.02 -1.26 0.00 135.00 130.37 1dcp n PRO 18 Ca 0.00 1.45 -0.06 0.00 -2.02 0.00 0.00 63.50 62.87 1dcp n PRO 18 Cb 0.44 -2.15 -0.00 0.00 -0.02 0.00 0.00 33.50 31.77 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 -0.46 -0.54 2.55 2.35 -1.93 1.25 115.58 118.81 1dcp h ASN 19 Ca 0.27 0.12 0.03 0.00 -0.55 0.00 0.00 56.30 56.17 1dcp h ASN 19 Cb 0.51 0.26 -0.04 0.00 0.05 0.00 0.00 38.32 39.11 1dcp h ASN 19 CO -0.93 -0.17 0.31 -0.07 -1.65 0.00 0.00 177.43 174.93 1dcp h LEU 20 N -0.08 0.49 -0.60 1.61 3.38 -1.26 -2.00 115.31 116.86 1dcp h LEU 20 Ca 0.16 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1dcp h LEU 20 Cb 0.32 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1dcp h LEU 20 CO -0.37 0.35 0.31 0.03 0.09 0.00 0.00 178.44 178.84 1dcp h ARG 21 N 0.62 0.84 -0.38 1.13 3.08 0.58 -1.66 114.38 118.59 1dcp h ARG 21 Ca 0.22 -0.11 0.10 0.00 0.07 0.00 0.00 59.98 60.26 1dcp h ARG 21 Cb 0.05 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1dcp h ARG 21 CO -0.11 0.66 0.27 0.00 -1.07 0.00 0.00 179.97 179.72 1dcp h ALA 22 N 1.14 2.28 -0.42 0.04 0.00 0.23 -2.12 119.26 120.40 1dcp h ALA 22 Ca 0.21 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1dcp h ALA 22 Cb 0.08 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1dcp h ALA 22 CO -0.03 -0.38 0.04 1.55 0.00 0.00 0.00 179.25 180.43 1dcp n VAL 23 N -4.44 2.54 0.00 0.00 3.14 -0.68 -4.95 118.33 113.94 1dcp n VAL 23 Ca 0.06 -1.85 0.00 0.00 -2.96 0.00 0.00 64.34 59.59 1dcp n VAL 23 Cb 0.41 -0.29 0.00 0.00 -1.06 0.00 0.00 33.84 32.91 1dcp n VAL 23 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1dcp n GLY 24 N -0.31 0.76 3.73 7.55 0.00 -0.80 -5.07 105.19 111.04 1dcp n GLY 24 Ca 0.28 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 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 3.78 0.08 1.61 0.52 -0.88 -4.73 118.94 117.32 1dcp s TRP 25 Ca 0.00 1.76 0.07 0.00 0.02 0.00 0.00 56.10 57.95 1dcp s TRP 25 Cb 0.00 -3.05 -0.04 0.00 -1.15 0.00 0.00 33.47 29.23 1dcp s TRP 25 CO 0.00 0.17 -0.14 -0.80 0.02 0.00 0.00 176.95 176.20 1dcp s ASN 26 N 0.19 4.15 0.03 2.95 0.01 0.26 -4.31 114.94 118.21 1dcp s ASN 26 Ca 0.47 -0.41 -0.21 0.00 -0.71 0.00 0.00 52.86 52.01 1dcp s ASN 26 Cb -0.23 -0.74 -0.06 0.00 0.41 0.00 0.00 41.25 40.64 1dcp s ASN 26 CO 0.29 0.21 0.61 -1.61 -1.51 0.00 0.00 177.10 175.09 1dcp s GLU 27 N -1.91 4.31 0.52 -0.60 2.02 -1.26 0.10 118.70 121.89 1dcp s GLU 27 Ca 0.18 0.77 -0.12 0.00 0.02 0.00 0.00 54.97 55.83 1dcp s GLU 27 Cb -0.11 -3.31 -0.06 0.00 0.10 0.00 0.00 34.13 30.75 1dcp s GLU 27 CO 0.10 0.44 0.93 -0.51 0.02 0.00 0.00 175.26 176.24 1dcp s LEU 28 N -0.46 3.53 -0.23 1.80 1.43 0.56 -4.95 118.68 120.36 1dcp s LEU 28 Ca 0.31 1.33 -0.08 0.00 -1.03 0.00 0.00 54.13 54.65 1dcp s LEU 28 Cb -0.19 -4.29 -0.11 0.00 0.03 0.00 0.00 46.19 41.63 1dcp s LEU 28 CO 0.18 -0.65 -0.27 -0.62 0.23 0.00 0.00 176.35 175.23 1dcp n GLU 29 N -2.05 0.50 0.10 1.70 -0.58 -1.26 -4.36 120.64 114.69 1dcp n GLU 29 Ca 0.05 0.19 0.11 0.00 -0.42 0.00 0.00 57.16 57.08 1dcp n GLU 29 Cb 0.54 -1.34 0.45 0.00 -0.57 0.00 0.00 31.44 30.52 1dcp n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dcp n GLY 30 N 1.80 -1.18 3.07 0.62 0.00 -1.26 -4.64 105.19 103.59 1dcp n GLY 30 Ca -0.43 0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.26 0.37 -0.72 1.61 1.70 -1.26 -5.10 118.95 112.29 1dcp s ARG 31 Ca 0.04 -0.24 -0.24 0.00 -0.47 0.00 0.00 55.73 54.82 1dcp s ARG 31 Cb 0.09 0.16 0.05 0.00 -0.57 0.00 0.00 34.95 34.68 1dcp s ARG 31 CO 0.35 -0.08 1.14 0.34 -1.08 0.00 0.00 175.30 175.96 1dcp s ASP 32 N -0.95 6.20 -0.13 -2.89 2.15 -1.26 -4.15 116.67 115.64 1dcp s ASP 32 Ca -0.10 -0.81 -0.30 0.00 0.43 0.00 0.00 52.55 51.76 1dcp s ASP 32 Cb -0.06 -2.49 0.11 0.00 -0.30 0.00 0.00 42.92 40.19 1dcp s ASP 32 CO 0.01 -1.61 0.92 0.00 -0.17 0.00 0.00 175.17 174.32 1dcp s ALA 33 N 4.81 -1.89 0.18 3.66 0.00 -1.26 -3.96 121.76 123.30 1dcp s ALA 33 Ca 0.29 1.51 0.08 0.00 0.00 0.00 0.00 51.96 53.84 1dcp s ALA 33 Cb -0.12 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1dcp s ALA 33 CO 0.11 -0.33 -0.02 0.96 0.00 0.00 0.00 175.76 176.48 1dcp s ILE 34 N -1.17 3.60 0.21 0.00 -4.36 -1.10 0.21 121.20 118.59 1dcp s ILE 34 Ca -0.04 -1.50 -0.16 0.00 -0.26 0.00 0.00 60.65 58.69 1dcp s ILE 34 Cb -0.00 -2.82 0.02 0.00 1.25 0.00 0.00 42.46 40.91 1dcp s ILE 34 CO 0.03 -0.13 0.51 0.72 0.24 0.00 0.00 174.94 176.31 1dcp s PHE 35 N -1.77 0.05 -0.22 1.37 -0.71 0.29 -1.10 117.98 115.89 1dcp s PHE 35 Ca 0.27 -0.41 -0.27 0.00 -1.04 0.00 0.00 56.93 55.48 1dcp s PHE 35 Cb -0.09 0.33 0.11 0.00 -1.21 0.00 0.00 43.02 42.16 1dcp s PHE 35 CO 0.18 -0.95 0.94 0.21 -1.34 0.00 0.00 175.22 174.26 1dcp s LYS 36 N -3.92 0.64 -0.12 1.99 2.20 0.13 -0.58 119.74 120.07 1dcp s LYS 36 Ca 0.13 0.50 -0.13 0.00 -0.36 0.00 0.00 55.97 56.11 1dcp s LYS 36 Cb -0.01 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.57 1dcp s LYS 36 CO 0.01 -0.13 0.28 -1.14 -0.36 0.00 0.00 175.35 174.02 1dcp s GLN 37 N -0.27 4.03 0.08 4.03 0.74 -1.26 -0.58 119.66 126.44 1dcp s GLN 37 Ca -0.00 0.11 0.06 0.00 0.05 0.00 0.00 55.36 55.57 1dcp s GLN 37 Cb -0.03 -3.34 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 1dcp s GLN 37 CO -0.01 0.43 -0.06 -0.06 -0.55 0.00 0.00 175.29 175.04 1dcp s PHE 38 N -0.13 2.84 -0.03 1.67 0.40 1.02 -4.96 117.98 118.79 1dcp s PHE 38 Ca 0.17 -0.10 0.01 0.00 -0.60 0.00 0.00 56.93 56.41 1dcp s PHE 38 Cb -0.13 -1.50 0.02 0.00 0.51 0.00 0.00 43.02 41.92 1dcp s PHE 38 CO 0.06 0.43 -0.02 -1.58 0.70 0.00 0.00 175.22 174.80 1dcp s HIS 39 N -1.20 0.52 0.31 0.36 2.46 -1.26 0.09 115.29 116.57 1dcp s HIS 39 Ca 0.22 -0.10 0.03 0.00 0.47 0.00 0.00 55.06 55.68 1dcp s HIS 39 Cb -0.11 -0.51 -0.04 0.00 -0.13 0.00 0.00 32.58 31.78 1dcp s HIS 39 CO 0.14 -0.15 0.11 -0.06 -2.47 0.00 0.00 174.74 172.32 1dcp s PHE 40 N 0.87 1.68 0.21 3.88 0.40 0.23 -4.93 117.98 120.32 1dcp s PHE 40 Ca -0.10 -1.21 -0.10 0.00 -0.60 0.00 0.00 56.93 54.92 1dcp s PHE 40 Cb -0.13 -1.01 0.18 0.00 0.51 0.00 0.00 43.02 42.57 1dcp s PHE 40 CO -0.01 -0.32 1.88 0.87 0.70 0.00 0.00 175.22 178.34 1dcp h LYS 41 N 2.18 0.99 0.00 0.44 1.57 -1.95 -3.45 116.57 116.34 1dcp h LYS 41 Ca -0.37 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.32 1dcp h LYS 41 Cb 1.25 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 1dcp h LYS 41 CO 0.59 0.65 0.06 -0.40 -0.57 0.00 0.00 179.45 179.78 1dcp n ASP 42 N -4.57 -0.67 -0.02 0.86 5.68 -1.26 -4.94 116.55 111.63 1dcp n ASP 42 Ca 0.08 -1.54 -0.11 0.00 -0.50 0.00 0.00 54.79 52.72 1dcp n ASP 42 Cb 0.03 1.13 0.02 0.00 -1.14 0.00 0.00 41.12 41.17 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 1.32 0.83 -0.80 2.11 3.57 -1.91 -1.88 116.94 120.18 1dcp h PHE 43 Ca -0.10 -0.30 0.04 0.00 3.53 0.00 0.00 57.97 61.14 1dcp h PHE 43 Cb 0.40 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1dcp h PHE 43 CO 0.00 1.07 0.50 -0.97 -2.23 0.00 0.00 178.31 176.68 1dcp h ASN 44 N 0.50 0.81 -0.07 0.41 -0.73 -1.97 0.23 115.58 114.76 1dcp h ASN 44 Ca 0.01 0.01 -0.16 0.00 1.87 0.00 0.00 56.30 58.02 1dcp h ASN 44 Cb 1.13 -0.17 0.01 0.00 0.27 0.00 0.00 38.32 39.56 1dcp h ASN 44 CO 0.11 0.54 -0.60 0.03 -0.37 0.00 0.00 177.43 177.15 1dcp h ARG 45 N 0.95 0.53 -0.48 6.67 3.08 -1.96 -0.87 114.38 122.29 1dcp h ARG 45 Ca 0.33 -0.47 0.02 0.00 0.07 0.00 0.00 59.98 59.93 1dcp h ARG 45 Cb 0.08 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1dcp h ARG 45 CO -0.14 1.11 0.29 0.00 -1.07 0.00 0.00 179.97 180.16 1dcp h ALA 46 N 0.43 0.62 -0.10 0.04 0.00 -0.93 1.05 119.26 120.36 1dcp h ALA 46 Ca -0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1dcp h ALA 46 Cb 1.26 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1dcp h ALA 46 CO 0.12 -0.01 -0.15 0.35 0.00 0.00 0.00 179.25 179.56 1dcp h PHE 47 N 0.59 0.34 -0.68 0.00 3.57 -0.63 0.37 116.94 120.50 1dcp h PHE 47 Ca 0.19 -0.12 0.15 0.00 3.53 0.00 0.00 57.97 61.72 1dcp h PHE 47 Cb 0.01 -0.07 -0.12 0.00 2.79 0.00 0.00 35.95 38.56 1dcp h PHE 47 CO -0.06 0.75 -0.03 0.78 -2.23 0.00 0.00 178.31 177.52 1dcp h GLY 48 N -0.17 0.70 0.84 2.40 0.00 -0.81 0.34 103.07 106.37 1dcp h GLY 48 Ca 0.01 0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.47 1dcp h GLY 48 CO 0.04 -0.24 0.00 -2.75 0.00 0.00 0.00 176.54 173.58 1dcp h PHE 49 N 0.09 0.00 -1.00 5.60 3.57 0.14 -2.07 116.94 123.28 1dcp h PHE 49 Ca 0.36 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.92 1dcp h PHE 49 Cb 0.60 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.29 1dcp h PHE 49 CO -0.42 -0.01 0.65 0.52 -2.23 0.00 0.00 178.31 176.82 1dcp h MET 50 N 0.04 1.19 -0.33 1.11 2.86 0.24 -1.69 114.93 118.36 1dcp h MET 50 Ca 0.05 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1dcp h MET 50 Cb 0.06 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 1dcp h MET 50 CO -0.09 0.79 0.14 1.15 1.06 0.00 0.00 176.91 179.96 1dcp h THR 51 N 1.23 1.18 -0.21 2.22 2.02 -0.05 0.55 112.91 119.84 1dcp h THR 51 Ca 0.41 -0.53 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 1dcp h THR 51 Cb 0.07 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1dcp h THR 51 CO -0.14 0.19 -0.12 0.03 0.37 0.00 0.00 175.52 175.84 1dcp h ARG 52 N 0.39 0.35 -0.26 6.66 3.08 -1.14 -1.63 114.38 121.83 1dcp h ARG 52 Ca 0.11 -0.09 -0.14 0.00 0.07 0.00 0.00 59.98 59.93 1dcp h ARG 52 Cb 0.16 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1dcp h ARG 52 CO -0.01 0.48 -0.43 0.28 -1.07 0.00 0.00 179.97 179.22 1dcp h VAL 53 N 0.33 1.30 -0.81 2.04 2.07 -0.82 -2.94 116.25 117.41 1dcp h VAL 53 Ca 0.06 -1.61 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 1dcp h VAL 53 Cb 0.42 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.71 1dcp h VAL 53 CO 0.02 0.51 0.48 0.00 0.02 0.00 0.00 177.57 178.61 1dcp h ALA 54 N 1.02 1.32 -0.68 1.67 0.00 0.99 0.17 119.26 123.74 1dcp h ALA 54 Ca 0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1dcp h ALA 54 Cb 0.95 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1dcp h ALA 54 CO 0.09 0.58 0.27 -0.07 0.00 0.00 0.00 179.25 180.12 1dcp h LEU 55 N 1.12 0.95 -0.13 0.00 3.38 -1.28 -1.29 115.31 118.06 1dcp h LEU 55 Ca 0.29 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1dcp h LEU 55 Cb -0.04 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 1dcp h LEU 55 CO -0.05 0.86 -0.01 -0.61 0.09 0.00 0.00 178.44 178.72 1dcp h GLN 56 N 0.97 0.23 -0.99 1.13 5.75 -1.29 -1.24 115.11 119.68 1dcp h GLN 56 Ca 0.23 -0.08 0.25 0.00 -0.15 0.00 0.00 58.65 58.90 1dcp h GLN 56 Cb 0.21 -0.02 -0.13 0.00 1.07 0.00 0.00 27.48 28.61 1dcp h GLN 56 CO -0.02 0.48 0.56 0.00 -2.65 0.00 0.00 178.83 177.21 1dcp h ALA 57 N 0.74 1.76 -0.07 3.38 0.00 -0.32 -0.44 119.26 124.31 1dcp h ALA 57 Ca 0.04 0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.89 1dcp h ALA 57 Cb 0.38 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1dcp h ALA 57 CO 0.01 -0.31 -0.71 0.93 0.00 0.00 0.00 179.25 179.17 1dcp h GLU 58 N 0.53 0.60 -0.99 0.00 4.39 -1.06 0.99 114.58 119.04 1dcp h GLU 58 Ca 0.64 -0.56 0.10 0.00 0.34 0.00 0.00 59.36 59.88 1dcp h GLU 58 Cb 1.25 0.14 -0.08 0.00 -0.10 0.00 0.00 28.75 29.96 1dcp h GLU 58 CO -0.50 1.17 0.62 -0.22 -1.16 0.00 0.00 179.01 178.93 1dcp h LYS 59 N 0.22 1.01 0.00 2.33 3.64 0.01 -2.22 116.57 121.57 1dcp h LYS 59 Ca -0.07 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1dcp h LYS 59 Cb 1.37 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1dcp h LYS 59 CO 0.14 0.67 -0.89 1.28 -2.27 0.00 0.00 179.45 178.38 1dcp n LEU 60 N -4.59 0.66 -3.54 5.20 4.77 -0.29 -4.98 117.00 114.23 1dcp n LEU 60 Ca 0.17 -0.11 -0.19 0.00 -0.03 0.00 0.00 56.01 55.85 1dcp n LEU 60 Cb 0.28 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.33 1dcp n LEU 60 CO 0.29 0.10 0.07 -0.67 -1.33 0.00 0.00 177.39 175.85 1dcp n ASP 61 N -1.76 -2.22 -3.62 -1.43 -0.08 0.25 -4.99 116.55 102.71 1dcp n ASP 61 Ca 0.03 -0.68 -0.18 0.00 -1.51 0.00 0.00 54.79 52.45 1dcp n ASP 61 Cb 0.39 -4.77 -0.15 0.00 2.34 0.00 0.00 41.12 38.92 1dcp n ASP 61 CO 0.00 0.00 0.00 -2.28 0.12 0.00 0.00 177.20 175.04 1dcp s HIS 62 N -3.44 -0.15 -0.05 -0.67 2.46 -0.64 -5.04 115.29 107.76 1dcp s HIS 62 Ca 0.07 0.41 0.03 0.00 0.47 0.00 0.00 55.06 56.03 1dcp s HIS 62 Cb -0.03 -0.34 -0.03 0.00 -0.13 0.00 0.00 32.58 32.05 1dcp s HIS 62 CO 0.76 -0.38 -0.11 -1.01 -2.47 0.00 0.00 174.74 171.53 1dcp s HIS 63 N 2.28 2.81 0.78 3.88 3.76 -1.26 -4.39 115.29 123.14 1dcp s HIS 63 Ca 0.04 -0.08 -0.11 0.00 -0.15 0.00 0.00 55.06 54.76 1dcp s HIS 63 Cb -0.13 -1.65 0.07 0.00 1.11 0.00 0.00 32.58 31.98 1dcp s HIS 63 CO -0.08 0.26 1.14 -1.25 -0.85 0.00 0.00 174.74 173.97 1dcp s PRO 64 N -0.85 2.04 -0.38 8.40 0.04 -1.26 -4.82 135.00 138.18 1dcp s PRO 64 Ca 0.12 0.04 -0.04 0.00 0.04 0.00 0.00 61.00 61.16 1dcp s PRO 64 Cb -0.11 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.51 1dcp s PRO 64 CO 0.02 -1.50 0.15 -1.21 0.04 0.00 0.00 177.00 174.50 1dcp s GLU 65 N -5.50 2.31 0.09 4.56 2.02 -0.83 -5.01 118.70 116.35 1dcp s GLU 65 Ca 0.61 -1.53 0.07 0.00 0.02 0.00 0.00 54.97 54.14 1dcp s GLU 65 Cb -0.11 -3.51 -0.03 0.00 0.10 0.00 0.00 34.13 30.57 1dcp s GLU 65 CO 0.48 -0.89 -0.17 1.67 0.02 0.00 0.00 175.26 176.37 1dcp s TRP 66 N 1.26 1.50 -0.04 1.61 -2.14 -1.26 -1.35 118.94 118.53 1dcp s TRP 66 Ca 0.03 -0.45 0.03 0.00 2.66 0.00 0.00 56.10 58.36 1dcp s TRP 66 Cb -0.22 -0.82 0.00 0.00 -3.10 0.00 0.00 33.47 29.33 1dcp s TRP 66 CO -0.01 0.14 -0.12 0.12 -2.66 0.00 0.00 176.95 174.41 1dcp s PHE 67 N -1.36 1.29 -0.02 1.66 2.19 0.79 -4.92 117.98 117.61 1dcp s PHE 67 Ca 0.03 -0.35 0.02 0.00 0.33 0.00 0.00 56.93 56.96 1dcp s PHE 67 Cb -0.09 -0.89 0.00 0.00 -1.31 0.00 0.00 43.02 40.73 1dcp s PHE 67 CO 0.03 -0.14 -0.08 1.21 1.83 0.00 0.00 175.22 178.08 1dcp s ASN 68 N 0.17 1.06 -0.23 6.13 3.84 -1.26 -0.68 114.94 123.97 1dcp s ASN 68 Ca -0.04 -0.16 -0.02 0.00 0.21 0.00 0.00 52.86 52.85 1dcp s ASN 68 Cb -0.10 -0.26 0.07 0.00 -0.55 0.00 0.00 41.25 40.41 1dcp s ASN 68 CO 0.01 0.06 0.04 -0.69 -2.79 0.00 0.00 177.10 173.73 1dcp s VAL 69 N 0.15 0.76 0.00 -5.21 1.01 -0.85 -5.01 120.40 111.24 1dcp s VAL 69 Ca -0.02 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1dcp s VAL 69 Cb -0.07 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 35.00 1dcp s VAL 69 CO 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 175.10 174.79 1dcp n TYR 70 N 4.94 0.00 -0.33 5.22 9.36 -1.26 -1.64 117.16 133.46 1dcp n TYR 70 Ca -0.08 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.25 1dcp n TYR 70 Cb 0.45 0.00 0.32 0.00 -0.63 0.00 0.00 39.34 39.48 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 8.03 4.05 -4.44 2.98 6.94 -1.26 -4.26 115.26 127.29 1dcp n ASN 71 Ca 0.00 -2.16 -0.31 0.00 -0.02 0.00 0.00 54.58 52.10 1dcp n ASN 71 Cb 0.00 -0.51 -0.13 0.00 -2.36 0.00 0.00 39.78 36.79 1dcp n ASN 71 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1dcp s LYS 72 N -1.35 2.05 -0.08 -3.83 1.02 -0.65 -0.60 119.74 116.30 1dcp s LYS 72 Ca 0.48 -0.99 -0.02 0.00 0.02 0.00 0.00 55.97 55.46 1dcp s LYS 72 Cb 0.27 -2.17 0.03 0.00 -0.52 0.00 0.00 37.83 35.44 1dcp s LYS 72 CO 0.29 0.54 0.02 0.08 -0.92 0.00 0.00 175.35 175.35 1dcp s VAL 73 N -0.90 0.30 -0.27 3.17 1.01 0.11 -2.01 120.40 121.81 1dcp s VAL 73 Ca 0.14 0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.13 1dcp s VAL 73 Cb -0.10 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 1dcp s VAL 73 CO 0.05 0.18 0.11 -2.28 0.00 0.00 0.00 175.10 173.16 1dcp s HIS 74 N 2.00 3.13 -0.09 5.22 2.46 0.14 0.34 115.29 128.49 1dcp s HIS 74 Ca 0.04 -0.35 0.02 0.00 0.47 0.00 0.00 55.06 55.25 1dcp s HIS 74 Cb -0.13 -2.29 -0.01 0.00 -0.13 0.00 0.00 32.58 30.02 1dcp s HIS 74 CO -0.05 -0.34 -0.17 0.42 -2.47 0.00 0.00 174.74 172.13 1dcp s ILE 75 N 1.64 2.75 -0.06 0.89 1.01 0.26 -0.15 121.20 127.53 1dcp s ILE 75 Ca 0.06 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.96 1dcp s ILE 75 Cb -0.16 -2.10 -0.00 0.00 0.01 0.00 0.00 42.46 40.21 1dcp s ILE 75 CO 0.06 0.55 -0.20 -0.89 0.00 0.00 0.00 174.94 174.46 1dcp s THR 76 N 0.01 1.68 -0.02 2.92 2.01 -0.45 0.21 115.64 121.99 1dcp s THR 76 Ca -0.06 -0.83 0.06 0.00 0.31 0.00 0.00 61.69 61.17 1dcp s THR 76 Cb -0.15 -1.45 -0.01 0.00 0.01 0.00 0.00 72.50 70.90 1dcp s THR 76 CO 0.05 0.47 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.50 1dcp s LEU 77 N 0.18 2.02 0.16 4.42 1.43 -0.26 -1.96 118.68 124.68 1dcp s LEU 77 Ca -0.10 -0.35 -0.24 0.00 -1.03 0.00 0.00 54.13 52.41 1dcp s LEU 77 Cb -0.14 -1.00 0.06 0.00 0.03 0.00 0.00 46.19 45.14 1dcp s LEU 77 CO 0.05 0.23 0.75 -0.94 0.23 0.00 0.00 176.35 176.67 1dcp s SER 78 N -0.39 -0.37 -0.24 2.29 1.04 -1.26 -2.71 113.70 112.06 1dcp s SER 78 Ca 0.06 -0.25 -0.03 0.00 0.48 0.00 0.00 55.95 56.21 1dcp s SER 78 Cb -0.08 0.58 0.01 0.00 0.10 0.00 0.00 66.02 66.63 1dcp s SER 78 CO -0.00 -1.00 -0.04 -0.89 0.98 0.00 0.00 173.24 172.28 1dcp s THR 79 N -3.60 3.13 0.07 2.02 2.01 -0.62 -4.91 115.64 113.74 1dcp s THR 79 Ca 0.07 -0.80 -0.25 0.00 0.31 0.00 0.00 61.69 61.01 1dcp s THR 79 Cb -0.02 -2.53 -0.16 0.00 0.01 0.00 0.00 72.50 69.79 1dcp s THR 79 CO -0.04 0.27 1.64 -0.74 -0.69 0.00 0.00 174.62 175.06 1dcp h HIS 80 N 8.07 -0.20 -0.74 4.92 2.76 -1.92 -2.28 115.15 125.76 1dcp h HIS 80 Ca -0.36 -0.00 0.25 0.00 -2.20 0.00 0.00 60.37 58.06 1dcp h HIS 80 Cb 1.13 0.07 -0.14 0.00 1.55 0.00 0.00 27.41 30.02 1dcp h HIS 80 CO 0.58 -0.07 0.20 -1.91 -1.30 0.00 0.00 177.93 175.42 1dcp n GLU 81 N -5.15 -0.05 -0.12 5.26 2.13 -1.26 -2.78 120.64 118.67 1dcp n GLU 81 Ca -0.09 1.06 -0.25 0.00 0.66 0.00 0.00 57.16 58.54 1dcp n GLU 81 Cb 0.14 -1.79 -0.11 0.00 0.27 0.00 0.00 31.44 29.95 1dcp n GLU 81 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1dcp n ALA 83 N -3.79 0.00 -2.15 0.00 0.00 -0.87 -4.83 120.51 108.87 1dcp n ALA 83 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1dcp n ALA 83 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.32 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 0.00 3.83 3.77 0.00 0.00 -1.21 -4.56 105.19 107.02 1dcp n GLY 84 Ca 0.00 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 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 4.14 0.26 0.99 1.43 -1.25 -1.59 118.68 122.65 1dcp s LEU 85 Ca 0.00 2.91 -0.05 0.00 -1.03 0.00 0.00 54.13 55.96 1dcp s LEU 85 Cb 0.00 -3.90 -0.02 0.00 0.03 0.00 0.00 46.19 42.30 1dcp s LEU 85 CO 0.00 -1.12 0.35 -0.94 0.23 0.00 0.00 176.35 174.87 1dcp s SER 86 N -0.49 0.31 0.26 2.29 1.04 -1.26 -0.87 113.70 114.98 1dcp s SER 86 Ca 0.60 -1.25 -0.05 0.00 0.48 0.00 0.00 55.95 55.73 1dcp s SER 86 Cb -0.44 0.53 0.32 0.00 0.10 0.00 0.00 66.02 66.53 1dcp s SER 86 CO 0.56 -1.07 1.94 -0.33 0.98 0.00 0.00 173.24 175.32 1dcp h GLU 87 N 2.34 1.26 -0.30 4.02 5.08 -1.96 -2.04 114.58 122.98 1dcp h GLU 87 Ca -0.30 -0.08 0.07 0.00 -1.00 0.00 0.00 59.36 58.06 1dcp h GLU 87 Cb 1.25 -0.28 -0.08 0.00 0.50 0.00 0.00 28.75 30.14 1dcp h GLU 87 CO 0.42 0.83 -0.25 0.00 -1.00 0.00 0.00 179.01 179.02 1dcp h ARG 88 N 1.30 -0.22 -0.77 2.33 3.08 -1.96 0.22 114.38 118.36 1dcp h ARG 88 Ca 0.35 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.51 1dcp h ARG 88 Cb -0.14 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 29.89 1dcp h ARG 88 CO -0.08 -0.15 0.42 -0.44 -1.07 0.00 0.00 179.97 178.65 1dcp h ASP 89 N -0.23 0.58 0.13 7.04 3.32 -1.73 -1.35 116.42 124.18 1dcp h ASP 89 Ca 0.15 0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.27 1dcp h ASP 89 Cb 0.47 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.92 1dcp h ASP 89 CO -0.43 0.33 -0.45 0.40 -1.72 0.00 0.00 179.24 177.37 1dcp h ILE 90 N 0.71 0.11 -0.47 0.35 1.08 -0.30 0.12 117.51 119.11 1dcp h ILE 90 Ca 0.37 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.93 1dcp h ILE 90 Cb 0.36 0.11 -0.07 0.00 -3.07 0.00 0.00 36.82 34.15 1dcp h ILE 90 CO -0.25 0.00 0.05 0.78 -0.69 0.00 0.00 178.15 178.04 1dcp h ASN 91 N -0.69 -0.09 -0.11 1.72 -0.26 -0.20 -1.72 115.58 114.23 1dcp h ASN 91 Ca 0.01 0.10 -0.00 0.00 -0.56 0.00 0.00 56.30 55.85 1dcp h ASN 91 Cb 0.71 0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 38.12 1dcp h ASN 91 CO -0.25 -0.01 0.07 0.25 -1.06 0.00 0.00 177.43 176.42 1dcp h LEU 92 N 0.17 0.14 -0.71 1.61 5.85 -0.99 -0.39 115.31 121.00 1dcp h LEU 92 Ca 0.24 -0.06 0.12 0.00 0.84 0.00 0.00 57.88 59.02 1dcp h LEU 92 Cb 0.33 -0.03 -0.13 0.00 0.37 0.00 0.00 40.66 41.20 1dcp h LEU 92 CO -0.35 0.16 -0.33 0.00 -0.34 0.00 0.00 178.44 177.58 1dcp h ALA 93 N 0.99 0.08 -0.40 1.25 0.00 -0.44 1.38 119.26 122.11 1dcp h ALA 93 Ca 0.04 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1dcp h ALA 93 Cb 0.05 0.81 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1dcp h ALA 93 CO -0.01 -0.63 0.26 0.77 0.00 0.00 0.00 179.25 179.64 1dcp h SER 94 N -0.10 0.47 0.26 0.00 0.02 -1.04 0.52 113.55 113.67 1dcp h SER 94 Ca 0.28 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 1dcp h SER 94 Cb 0.56 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1dcp h SER 94 CO -0.77 0.35 -0.12 0.15 -1.14 0.00 0.00 176.83 175.30 1dcp h PHE 95 N 0.53 -0.32 -0.66 3.45 3.57 -0.26 0.48 116.94 123.74 1dcp h PHE 95 Ca 0.14 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.78 1dcp h PHE 95 Cb -0.04 0.11 -0.11 0.00 2.79 0.00 0.00 35.95 38.69 1dcp h PHE 95 CO -0.04 -0.11 -0.01 0.82 -2.23 0.00 0.00 178.31 176.74 1dcp h ILE 96 N -0.48 0.43 -0.91 1.41 2.04 0.23 0.36 117.51 120.59 1dcp h ILE 96 Ca -0.04 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1dcp h ILE 96 Cb 0.36 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1dcp h ILE 96 CO 0.06 0.02 0.54 -0.33 0.00 0.00 0.00 178.15 178.44 1dcp h GLU 97 N 0.10 1.24 -0.50 2.37 4.39 0.11 -1.45 114.58 120.83 1dcp h GLU 97 Ca 0.35 -0.11 0.02 0.00 0.34 0.00 0.00 59.36 59.95 1dcp h GLU 97 Cb 0.58 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 28.94 1dcp h GLU 97 CO -0.58 0.87 0.31 1.96 -1.16 0.00 0.00 179.01 180.40 1dcp h GLN 98 N 1.25 0.61 -0.28 2.33 4.20 0.20 -3.01 115.11 120.41 1dcp h GLN 98 Ca 0.33 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1dcp h GLN 98 Cb -0.05 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1dcp h GLN 98 CO -0.06 0.40 0.18 0.28 -0.67 0.00 0.00 178.83 178.96 1dcp h VAL 99 N 0.63 1.09 -0.61 -0.54 2.07 -0.89 -2.66 116.25 115.34 1dcp h VAL 99 Ca 0.20 -0.19 0.18 0.00 0.82 0.00 0.00 66.70 67.70 1dcp h VAL 99 Cb -0.01 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1dcp h VAL 99 CO -0.07 0.09 0.50 0.00 0.02 0.00 0.00 177.57 178.11 1dcp h ALA 100 N 1.08 2.46 -0.14 1.67 0.00 -1.14 -1.22 119.26 121.97 1dcp h ALA 100 Ca 0.10 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1dcp h ALA 100 Cb -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1dcp h ALA 100 CO -0.02 -0.82 -0.46 0.28 0.00 0.00 0.00 179.25 178.24 1dcp h VAL 101 N 0.00 1.32 0.00 0.00 2.07 -1.41 -2.84 116.25 115.40 1dcp h VAL 101 Ca 0.29 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 66.16 1dcp h VAL 101 Cb 1.29 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.78 1dcp h VAL 101 CO -0.00 0.50 0.00 0.77 0.02 0.00 0.00 177.57 178.86 1dcp h SER 102 N 0.29 0.00 0.00 0.57 4.64 -1.27 -3.37 113.55 114.41 1dcp h SER 102 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1dcp h SER 102 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1dcp h SER 102 CO 0.08 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.27 1dcp n MET 103 N -2.53 0.00 0.00 4.77 2.81 -1.09 -5.16 117.12 115.93 1dcp n MET 103 Ca 0.00 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.95 1dcp n MET 103 Cb 0.18 -0.24 0.35 0.00 -0.71 0.00 0.00 33.22 32.80 1dcp n MET 103 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73