#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dcj s THR 2 N 0.00 3.56 -0.03 2.03 -4.23 -1.26 -5.08 115.64 110.63 1dcj s THR 2 Ca 0.00 -1.25 -0.25 0.00 -1.18 0.00 0.00 61.69 59.01 1dcj s THR 2 Cb 0.00 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1dcj s THR 2 CO 0.00 -0.19 0.76 -0.62 -0.54 0.00 0.00 174.62 174.02 1dcj s ASP 3 N 1.41 7.09 0.24 3.99 2.15 -1.26 -4.94 116.67 125.36 1dcj s ASP 3 Ca -0.02 1.31 0.06 0.00 0.43 0.00 0.00 52.55 54.33 1dcj s ASP 3 Cb -0.20 -2.45 0.27 0.00 -0.30 0.00 0.00 42.92 40.25 1dcj s ASP 3 CO 0.01 -0.11 1.57 -0.07 -0.17 0.00 0.00 175.17 176.41 1dcj h LEU 4 N 6.53 0.20 -1.59 -1.34 3.38 -1.98 -2.69 115.31 117.83 1dcj h LEU 4 Ca -0.42 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1dcj h LEU 4 Cb 1.20 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1dcj h LEU 4 CO 0.74 0.76 0.00 0.49 0.09 0.00 0.00 178.44 180.53 1dcj n PHE 5 N -3.85 0.62 -0.71 1.13 3.01 -1.26 -4.81 117.46 111.59 1dcj n PHE 5 Ca -0.02 -0.23 -0.23 0.00 1.01 0.00 0.00 57.45 57.97 1dcj n PHE 5 Cb 0.62 -0.16 0.10 0.00 -0.01 0.00 0.00 39.48 40.03 1dcj n PHE 5 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1dcj n SER 6 N 0.25 -2.69 -4.46 4.37 7.64 -1.02 -4.38 113.62 113.34 1dcj n SER 6 Ca 0.10 -0.18 -0.46 0.00 1.01 0.00 0.00 58.87 59.35 1dcj n SER 6 Cb 0.46 -0.70 -0.10 0.00 -1.01 0.00 0.00 64.21 62.86 1dcj n SER 6 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1dcj n SER 7 N 0.43 1.25 -4.80 6.43 2.88 -1.26 -4.87 113.62 113.68 1dcj n SER 7 Ca 0.02 0.18 -0.29 0.00 -1.33 0.00 0.00 58.87 57.45 1dcj n SER 7 Cb 0.46 -1.14 0.12 0.00 -0.75 0.00 0.00 64.21 62.89 1dcj n SER 7 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1dcj s PRO 8 N 7.65 1.53 0.26 -1.46 0.04 -1.26 -4.97 135.00 136.79 1dcj s PRO 8 Ca 1.19 0.41 0.17 0.00 0.04 0.00 0.00 61.00 62.81 1dcj s PRO 8 Cb -0.97 -1.87 0.07 0.00 0.04 0.00 0.00 34.50 31.76 1dcj s PRO 8 CO 0.47 -1.95 1.35 -0.44 0.04 0.00 0.00 177.00 176.46 1dcj h ASP 9 N -1.33 0.00 -5.53 6.66 5.19 -1.68 -3.47 116.42 116.26 1dcj h ASP 9 Ca -0.49 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 55.69 1dcj h ASP 9 Cb 1.31 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 40.70 1dcj h ASP 9 CO 0.61 0.41 -0.41 -1.00 -3.12 0.00 0.00 179.24 175.72 1dcj s HIS 10 N -3.02 1.02 0.09 4.55 3.76 -0.48 -4.98 115.29 116.23 1dcj s HIS 10 Ca 0.03 -1.24 -0.07 0.00 -0.15 0.00 0.00 55.06 53.63 1dcj s HIS 10 Cb 0.07 -0.32 -0.01 0.00 1.11 0.00 0.00 32.58 33.43 1dcj s HIS 10 CO 0.75 -0.83 0.15 0.99 -0.85 0.00 0.00 174.74 174.94 1dcj s THR 11 N -3.87 0.15 -0.20 1.30 2.01 -1.26 -1.11 115.64 112.67 1dcj s THR 11 Ca 0.34 -1.35 -0.04 0.00 0.31 0.00 0.00 61.69 60.95 1dcj s THR 11 Cb 0.03 -1.44 0.09 0.00 0.01 0.00 0.00 72.50 71.19 1dcj s THR 11 CO 0.15 -0.69 0.22 -0.22 -0.69 0.00 0.00 174.62 173.39 1dcj s LEU 12 N -2.89 -0.12 0.26 4.42 2.96 0.64 -4.88 118.68 119.07 1dcj s LEU 12 Ca 0.07 -0.19 -0.30 0.00 -0.22 0.00 0.00 54.13 53.49 1dcj s LEU 12 Cb 0.05 0.40 -0.09 0.00 0.50 0.00 0.00 46.19 47.05 1dcj s LEU 12 CO -0.09 -0.32 1.02 -0.62 -1.32 0.00 0.00 176.35 175.01 1dcj s ASP 13 N 2.33 7.47 0.00 3.68 -1.08 -1.26 -0.65 116.67 127.16 1dcj s ASP 13 Ca 0.07 2.10 0.00 0.00 -0.52 0.00 0.00 52.55 54.20 1dcj s ASP 13 Cb -0.16 -2.62 0.00 0.00 -1.46 0.00 0.00 42.92 38.69 1dcj s ASP 13 CO -0.12 0.01 0.84 0.00 0.52 0.00 0.00 175.17 176.43 1dcj n ALA 14 N 1.35 1.91 -2.55 3.66 0.00 0.18 -4.83 120.51 120.23 1dcj n ALA 14 Ca -0.02 -0.74 -0.42 0.00 0.00 0.00 0.00 53.44 52.26 1dcj n ALA 14 Cb 0.46 -0.35 -0.02 0.00 0.00 0.00 0.00 19.45 19.53 1dcj n ALA 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dcj s LEU 15 N 0.00 3.50 0.00 0.00 1.43 -1.25 -1.60 118.68 120.77 1dcj s LEU 15 Ca 0.00 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 1dcj s LEU 15 Cb 0.00 -3.28 0.00 0.00 0.03 0.00 0.00 46.19 42.94 1dcj s LEU 15 CO 0.00 -1.44 0.00 0.61 0.23 0.00 0.00 176.35 175.75 1dcj n GLY 16 N 5.03 0.48 3.88 -3.19 0.00 -1.26 -4.83 105.19 105.29 1dcj n GLY 16 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1dcj n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dcj s LEU 17 N 0.00 4.27 0.00 0.99 1.43 -0.63 -4.98 118.68 119.77 1dcj s LEU 17 Ca 0.00 0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 53.87 1dcj s LEU 17 Cb 0.00 -3.33 -0.01 0.00 0.03 0.00 0.00 46.19 42.88 1dcj s LEU 17 CO 0.00 0.05 0.07 0.00 0.23 0.00 0.00 176.35 176.71 1dcj s ARG 18 N -2.41 0.38 0.31 1.70 3.03 -1.26 -4.13 118.95 116.56 1dcj s ARG 18 Ca 0.40 -0.41 -0.27 0.00 2.03 0.00 0.00 55.73 57.48 1dcj s ARG 18 Cb -0.13 0.15 -0.14 0.00 -1.03 0.00 0.00 34.95 33.80 1dcj s ARG 18 CO 0.21 -0.08 0.80 0.00 -1.13 0.00 0.00 175.30 175.10 1dcj n PRO 20 N 0.72 1.64 -0.18 0.00 -0.04 -1.26 -4.91 135.00 130.98 1dcj n PRO 20 Ca 0.12 -0.96 -0.01 0.00 -0.04 0.00 0.00 63.50 62.61 1dcj n PRO 20 Cb 0.32 -1.40 0.09 0.00 -0.04 0.00 0.00 33.50 32.47 1dcj n PRO 20 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1dcj h GLU 21 N 2.00 0.25 0.40 0.54 5.08 -0.73 0.51 114.58 122.64 1dcj h GLU 21 Ca 0.00 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1dcj h GLU 21 Cb 0.44 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1dcj h GLU 21 CO 0.00 0.17 -0.19 -1.00 -1.00 0.00 0.00 179.01 176.98 1dcj h PRO 22 N 0.26 -0.52 -0.79 2.33 0.13 -1.87 -0.34 132.00 131.21 1dcj h PRO 22 Ca 0.28 0.04 0.23 0.00 -0.87 0.00 0.00 66.00 65.68 1dcj h PRO 22 Cb 0.39 0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.61 1dcj h PRO 22 CO -0.36 -0.35 0.80 0.28 -0.23 0.00 0.00 178.00 178.15 1dcj h VAL 23 N -0.90 0.24 -0.03 1.56 2.07 -1.86 0.68 116.25 118.00 1dcj h VAL 23 Ca -0.06 0.00 -0.23 0.00 0.82 0.00 0.00 66.70 67.23 1dcj h VAL 23 Cb 0.41 0.37 0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1dcj h VAL 23 CO 0.09 0.00 -0.89 0.24 0.02 0.00 0.00 177.57 177.03 1dcj h MET 24 N 0.00 0.65 -0.63 1.57 2.86 0.56 -2.71 114.93 117.23 1dcj h MET 24 Ca 0.38 -0.66 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 1dcj h MET 24 Cb 1.97 0.18 -0.03 0.00 0.06 0.00 0.00 31.60 33.78 1dcj h MET 24 CO -0.00 1.26 0.35 0.52 1.06 0.00 0.00 176.91 180.10 1dcj h MET 25 N 0.29 0.87 0.00 1.72 2.86 0.21 0.05 114.93 120.94 1dcj h MET 25 Ca -0.10 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.41 1dcj h MET 25 Cb 1.55 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 33.03 1dcj h MET 25 CO 0.18 0.65 -0.15 0.28 1.06 0.00 0.00 176.91 178.92 1dcj h VAL 26 N 0.85 0.79 0.75 -2.22 2.07 -1.45 -0.85 116.25 116.19 1dcj h VAL 26 Ca 0.22 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 1dcj h VAL 26 Cb 0.02 1.36 0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1dcj h VAL 26 CO -0.04 0.15 -0.36 0.03 0.02 0.00 0.00 177.57 177.38 1dcj h ARG 27 N 0.00 -0.96 -0.80 1.57 2.47 -0.67 0.67 114.38 116.66 1dcj h ARG 27 Ca -0.00 0.07 0.03 0.00 -1.26 0.00 0.00 59.98 58.81 1dcj h ARG 27 Cb 0.35 0.22 -0.05 0.00 -1.65 0.00 0.00 29.97 28.84 1dcj h ARG 27 CO 0.02 -0.63 0.51 0.87 0.56 0.00 0.00 179.97 181.30 1dcj h LYS 28 N -1.24 0.97 -0.52 0.04 1.57 -1.22 0.49 116.57 116.66 1dcj h LYS 28 Ca -0.10 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 1dcj h LYS 28 Cb 0.78 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1dcj h LYS 28 CO 0.17 0.64 0.16 1.15 -0.57 0.00 0.00 179.45 181.00 1dcj h THR 29 N 1.00 1.21 0.00 -0.16 2.02 -1.11 0.29 112.91 116.16 1dcj h THR 29 Ca 0.32 -0.71 -0.07 0.00 0.77 0.00 0.00 66.41 66.72 1dcj h THR 29 Cb 0.00 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1dcj h THR 29 CO -0.11 0.27 -0.34 0.58 0.37 0.00 0.00 175.52 176.29 1dcj h VAL 30 N 0.75 1.03 0.00 3.16 2.07 0.29 0.66 116.25 124.22 1dcj h VAL 30 Ca 0.17 -1.25 -0.18 0.00 0.82 0.00 0.00 66.70 66.27 1dcj h VAL 30 Cb 0.23 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 1dcj h VAL 30 CO -0.01 0.33 -0.84 0.03 0.02 0.00 0.00 177.57 177.10 1dcj h ARG 31 N 0.00 0.02 -0.60 1.57 3.08 0.31 -3.07 114.38 115.69 1dcj h ARG 31 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1dcj h ARG 31 Cb 0.69 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1dcj h ARG 31 CO 0.04 0.85 0.00 0.27 -1.07 0.00 0.00 179.97 180.06 1dcj n ASN 32 N -3.55 3.63 -4.53 7.04 6.94 0.66 -4.95 115.26 120.48 1dcj n ASN 32 Ca -0.01 -1.99 -0.18 0.00 -0.02 0.00 0.00 54.58 52.38 1dcj n ASN 32 Cb 0.80 -0.40 0.05 0.00 -2.36 0.00 0.00 39.78 37.87 1dcj n ASN 32 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 1dcj n MET 33 N 1.33 0.68 -4.10 -3.83 2.81 0.22 -5.02 117.12 109.22 1dcj n MET 33 Ca 0.21 -2.77 -0.13 0.00 -1.81 0.00 0.00 57.70 53.20 1dcj n MET 33 Cb 0.57 -0.10 -0.11 0.00 -0.71 0.00 0.00 33.22 32.86 1dcj n MET 33 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1dcj s GLN 34 N -4.22 0.62 -0.21 0.03 -0.21 -1.26 -4.96 119.66 109.46 1dcj s GLN 34 Ca 0.48 -0.90 -0.29 0.00 0.02 0.00 0.00 55.36 54.66 1dcj s GLN 34 Cb -0.04 -0.32 -0.02 0.00 1.00 0.00 0.00 33.01 33.64 1dcj s GLN 34 CO 0.30 0.05 1.46 -1.25 -2.12 0.00 0.00 175.29 173.72 1dcj s PRO 35 N -2.10 3.98 0.00 2.91 0.04 -1.26 -2.68 135.00 135.89 1dcj s PRO 35 Ca -0.04 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.62 1dcj s PRO 35 Cb -0.07 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.55 1dcj s PRO 35 CO -0.01 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.39 1dcj n GLY 36 N 4.25 1.82 1.66 0.56 0.00 0.16 -4.84 105.19 108.80 1dcj n GLY 36 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 1dcj n GLY 36 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dcj n GLU 37 N -0.60 1.19 -4.09 1.61 4.71 -1.09 -4.95 120.64 117.41 1dcj n GLU 37 Ca 0.00 -1.69 -0.14 0.00 -0.01 0.00 0.00 57.16 55.32 1dcj n GLU 37 Cb 0.00 0.61 -0.11 0.00 -1.01 0.00 0.00 31.44 30.93 1dcj n GLU 37 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1dcj s THR 38 N -2.00 0.68 -0.10 2.62 -4.23 -1.26 -1.04 115.64 110.30 1dcj s THR 38 Ca 0.04 -1.19 -0.03 0.00 -1.18 0.00 0.00 61.69 59.32 1dcj s THR 38 Cb 0.00 -0.79 0.05 0.00 1.34 0.00 0.00 72.50 73.10 1dcj s THR 38 CO 0.02 -0.39 0.11 -0.22 -0.54 0.00 0.00 174.62 173.61 1dcj s LEU 39 N -1.73 0.11 0.15 4.79 2.96 -0.95 -1.39 118.68 122.62 1dcj s LEU 39 Ca -0.07 -0.06 -0.18 0.00 -0.22 0.00 0.00 54.13 53.61 1dcj s LEU 39 Cb -0.09 -0.00 -0.07 0.00 0.50 0.00 0.00 46.19 46.53 1dcj s LEU 39 CO 0.00 -0.28 0.62 -0.22 -1.32 0.00 0.00 176.35 175.15 1dcj s LEU 40 N 2.21 4.40 0.05 -0.68 2.96 -0.27 -0.93 118.68 126.42 1dcj s LEU 40 Ca 0.04 1.25 0.03 0.00 -0.22 0.00 0.00 54.13 55.23 1dcj s LEU 40 Cb -0.13 -3.27 -0.03 0.00 0.50 0.00 0.00 46.19 43.26 1dcj s LEU 40 CO -0.06 0.13 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.37 1dcj s ILE 41 N -1.38 0.73 0.16 6.68 1.01 -0.70 -0.26 121.20 127.44 1dcj s ILE 41 Ca 0.37 -1.14 0.10 0.00 0.00 0.00 0.00 60.65 59.98 1dcj s ILE 41 Cb -0.17 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 1dcj s ILE 41 CO 0.20 -0.32 -0.21 -0.63 0.00 0.00 0.00 174.94 173.98 1dcj s ILE 42 N -1.31 2.00 -0.29 2.92 1.01 0.18 -1.27 121.20 124.44 1dcj s ILE 42 Ca -0.07 -1.86 -0.15 0.00 0.00 0.00 0.00 60.65 58.57 1dcj s ILE 42 Cb -0.10 -1.88 0.11 0.00 0.01 0.00 0.00 42.46 40.60 1dcj s ILE 42 CO 0.01 -0.16 0.75 0.00 0.00 0.00 0.00 174.94 175.54 1dcj s ALA 43 N -1.65 -2.03 -0.09 9.38 0.00 -0.16 0.49 121.76 127.71 1dcj s ALA 43 Ca 0.15 2.35 0.17 0.00 0.00 0.00 0.00 51.96 54.64 1dcj s ALA 43 Cb -0.08 -1.58 -0.26 0.00 0.00 0.00 0.00 23.12 21.21 1dcj s ALA 43 CO 0.07 -0.50 0.27 -0.40 0.00 0.00 0.00 175.76 175.20 1dcj n ASP 44 N 4.43 0.71 -4.77 0.00 5.68 -1.06 -0.28 116.55 121.26 1dcj n ASP 44 Ca -0.18 0.00 -0.40 0.00 -0.50 0.00 0.00 54.79 53.71 1dcj n ASP 44 Cb 0.57 1.48 0.01 0.00 -1.14 0.00 0.00 41.12 42.03 1dcj n ASP 44 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1dcj s ASP 45 N -4.56 6.11 0.43 -1.12 2.15 -1.23 -4.87 116.67 113.58 1dcj s ASP 45 Ca -0.08 2.95 0.25 0.00 0.43 0.00 0.00 52.55 56.10 1dcj s ASP 45 Cb 0.09 -2.66 0.59 0.00 -0.30 0.00 0.00 42.92 40.65 1dcj s ASP 45 CO 0.75 -1.02 1.70 1.55 -0.17 0.00 0.00 175.17 177.98 1dcj h PRO 46 N 2.64 0.00 -0.01 4.34 0.13 -1.91 -3.06 132.00 134.13 1dcj h PRO 46 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1dcj h PRO 46 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1dcj h PRO 46 CO 0.62 0.00 -0.12 0.00 -0.23 0.00 0.00 178.00 178.27 1dcj n ALA 47 N -2.06 2.81 0.02 -0.56 0.00 -1.26 -3.92 120.51 115.55 1dcj n ALA 47 Ca 0.03 -0.37 -0.22 0.00 0.00 0.00 0.00 53.44 52.89 1dcj n ALA 47 Cb 0.47 -1.22 -0.14 0.00 0.00 0.00 0.00 19.45 18.56 1dcj n ALA 47 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1dcj h THR 48 N 1.33 0.86 -0.75 0.00 1.35 -1.85 -0.68 112.91 113.17 1dcj h THR 48 Ca 0.00 -2.40 0.14 0.00 -0.55 0.00 0.00 66.41 63.60 1dcj h THR 48 Cb 0.43 2.64 -0.05 0.00 -1.73 0.00 0.00 68.15 69.44 1dcj h THR 48 CO 0.00 0.80 0.50 0.71 -0.25 0.00 0.00 175.52 177.28 1dcj h THR 49 N -0.09 0.82 0.03 6.82 1.35 -1.69 0.55 112.91 120.69 1dcj h THR 49 Ca -0.36 -0.15 -0.37 0.00 -0.55 0.00 0.00 66.41 64.97 1dcj h THR 49 Cb 1.94 0.32 -0.05 0.00 -1.73 0.00 0.00 68.15 68.63 1dcj h THR 49 CO 0.09 0.08 -2.29 0.54 -0.25 0.00 0.00 175.52 173.70 1dcj n ARG 50 N -4.48 0.68 -0.06 4.72 1.74 -1.25 -4.44 116.66 113.57 1dcj n ARG 50 Ca 0.14 0.17 -0.18 0.00 -0.77 0.00 0.00 57.85 57.21 1dcj n ARG 50 Cb 0.50 -1.59 -0.13 0.00 -1.02 0.00 0.00 32.46 30.22 1dcj n ARG 50 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1dcj h ASP 51 N 0.02 0.11 -0.59 0.55 5.19 -0.88 -2.86 116.42 117.96 1dcj h ASP 51 Ca -0.51 -0.82 0.12 0.00 -0.62 0.00 0.00 57.03 55.20 1dcj h ASP 51 Cb 1.99 -0.04 -0.09 0.00 0.18 0.00 0.00 39.33 41.37 1dcj h ASP 51 CO -0.01 1.30 0.04 0.40 -3.12 0.00 0.00 179.24 177.84 1dcj h ILE 52 N -0.82 0.56 0.02 0.35 2.04 -1.03 -0.01 117.51 118.61 1dcj h ILE 52 Ca -0.17 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1dcj h ILE 52 Cb 1.29 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 1dcj h ILE 52 CO -0.04 0.03 -0.01 1.55 0.00 0.00 0.00 178.15 179.68 1dcj h PRO 53 N 0.16 -0.02 -0.70 2.37 0.13 -1.74 -2.50 132.00 129.70 1dcj h PRO 53 Ca 0.31 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 65.64 1dcj h PRO 53 Cb 0.48 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.59 1dcj h PRO 53 CO -0.47 0.60 0.75 0.78 -0.23 0.00 0.00 178.00 179.43 1dcj h GLY 54 N -0.67 0.00 0.16 1.56 0.00 -1.20 0.34 103.07 103.26 1dcj h GLY 54 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1dcj h GLY 54 CO 0.00 0.00 -0.02 -2.75 0.00 0.00 0.00 176.54 173.77 1dcj h PHE 55 N 0.00 -0.06 -0.96 5.60 3.57 -0.71 -3.06 116.94 121.32 1dcj h PHE 55 Ca 0.33 -0.00 0.19 0.00 3.53 0.00 0.00 57.97 62.02 1dcj h PHE 55 Cb 1.82 0.02 -0.09 0.00 2.79 0.00 0.00 35.95 40.50 1dcj h PHE 55 CO 0.00 0.57 0.61 0.00 -2.23 0.00 0.00 178.31 177.25 1dcj h THR 57 N 0.62 1.24 -0.31 0.00 2.02 -1.21 -0.78 112.91 114.50 1dcj h THR 57 Ca 0.52 -0.59 -0.07 0.00 0.77 0.00 0.00 66.41 67.03 1dcj h THR 57 Cb 0.98 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1dcj h THR 57 CO -0.27 0.27 -0.12 0.15 0.37 0.00 0.00 175.52 175.92 1dcj h PHE 58 N 1.17 0.56 -0.02 3.16 3.04 -0.27 -2.20 116.94 122.39 1dcj h PHE 58 Ca 0.30 -0.09 0.00 0.00 3.98 0.00 0.00 57.97 62.16 1dcj h PHE 58 Cb 0.02 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.37 1dcj h PHE 58 CO 0.01 0.63 0.00 -1.33 -2.02 0.00 0.00 178.31 175.59 1dcj n MET 59 N -4.20 1.09 -1.37 1.11 2.81 -0.82 -4.86 117.12 110.89 1dcj n MET 59 Ca 0.01 -0.14 -0.01 0.00 -1.81 0.00 0.00 57.70 55.75 1dcj n MET 59 Cb 0.32 -1.36 -0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1dcj n MET 59 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1dcj n GLU 60 N -0.70 -0.05 -2.76 0.03 2.13 -0.83 -4.72 120.64 113.74 1dcj n GLU 60 Ca 0.17 0.35 -0.21 0.00 0.66 0.00 0.00 57.16 58.13 1dcj n GLU 60 Cb 0.11 -3.88 0.06 0.00 0.27 0.00 0.00 31.44 28.00 1dcj n GLU 60 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1dcj s HIS 61 N -2.03 2.15 0.04 4.31 3.76 -0.36 -3.39 115.29 119.78 1dcj s HIS 61 Ca 0.00 -0.30 0.08 0.00 -0.15 0.00 0.00 55.06 54.69 1dcj s HIS 61 Cb 0.00 -2.66 -0.03 0.00 1.11 0.00 0.00 32.58 31.00 1dcj s HIS 61 CO 0.00 -1.13 -0.23 -1.21 -0.85 0.00 0.00 174.74 171.32 1dcj s GLU 62 N -4.80 1.58 -0.64 1.40 0.41 -0.62 -4.44 118.70 111.59 1dcj s GLU 62 Ca 0.61 -1.01 -0.25 0.00 -0.41 0.00 0.00 54.97 53.90 1dcj s GLU 62 Cb -0.08 -1.72 0.04 0.00 -1.78 0.00 0.00 34.13 30.60 1dcj s GLU 62 CO 0.40 0.44 1.09 -1.17 -0.49 0.00 0.00 175.26 175.52 1dcj s LEU 63 N -1.18 3.81 -0.03 1.80 2.96 -1.26 0.86 118.68 125.63 1dcj s LEU 63 Ca 0.09 -0.48 -0.26 0.00 -0.22 0.00 0.00 54.13 53.27 1dcj s LEU 63 Cb -0.09 -2.69 -0.20 0.00 0.50 0.00 0.00 46.19 43.70 1dcj s LEU 63 CO 0.02 -1.50 1.21 0.58 -1.32 0.00 0.00 176.35 175.33 1dcj h VAL 64 N 6.03 1.44 -2.97 1.68 2.07 -0.64 -3.46 116.25 120.40 1dcj h VAL 64 Ca -0.27 -1.35 -0.18 0.00 0.82 0.00 0.00 66.70 65.72 1dcj h VAL 64 Cb 1.06 2.31 -0.29 0.00 -1.52 0.00 0.00 31.29 32.86 1dcj h VAL 64 CO 1.19 0.36 -0.45 0.00 0.02 0.00 0.00 177.57 178.68 1dcj s ALA 65 N -3.96 -0.64 0.28 1.67 0.00 -1.16 -4.91 121.76 113.04 1dcj s ALA 65 Ca -0.16 1.06 0.05 0.00 0.00 0.00 0.00 51.96 52.90 1dcj s ALA 65 Cb 0.01 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.45 1dcj s ALA 65 CO 0.69 -0.20 0.42 0.15 0.00 0.00 0.00 175.76 176.82 1dcj s LYS 66 N 1.18 3.36 -0.16 0.00 3.01 -1.26 0.61 119.74 126.48 1dcj s LYS 66 Ca -0.08 -0.75 -0.04 0.00 -1.01 0.00 0.00 55.97 54.09 1dcj s LYS 66 Cb -0.09 -2.83 0.06 0.00 -1.01 0.00 0.00 37.83 33.95 1dcj s LYS 66 CO -0.08 0.29 0.06 -1.21 0.51 0.00 0.00 175.35 174.91 1dcj s GLU 67 N -4.09 0.35 -0.09 1.68 2.02 0.53 -4.88 118.70 114.21 1dcj s GLU 67 Ca 0.38 -0.18 0.23 0.00 0.02 0.00 0.00 54.97 55.42 1dcj s GLU 67 Cb -0.09 -1.79 0.45 0.00 0.10 0.00 0.00 34.13 32.80 1dcj s GLU 67 CO 0.31 -0.60 1.16 0.25 0.02 0.00 0.00 175.26 176.40 1dcj n THR 68 N 5.17 0.63 1.75 3.63 -2.24 -1.26 -1.57 114.28 120.39 1dcj n THR 68 Ca -0.08 -1.81 0.08 0.00 -2.27 0.00 0.00 64.05 59.97 1dcj n THR 68 Cb 0.48 0.86 0.45 0.00 -2.10 0.00 0.00 70.33 70.02 1dcj n THR 68 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1dcj n ASP 69 N 0.02 0.00 0.00 3.42 8.00 -1.26 -4.84 116.55 121.89 1dcj n ASP 69 Ca 0.09 -1.28 0.00 0.00 0.71 0.00 0.00 54.79 54.31 1dcj n ASP 69 Cb 1.01 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 42.11 1dcj n ASP 69 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dcj n GLY 70 N 0.57 3.86 2.27 0.44 0.00 -1.26 -5.08 105.19 105.99 1dcj n GLY 70 Ca 0.11 -0.91 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 1dcj n GLY 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dcj n LEU 71 N 0.00 -1.83 -4.82 0.99 4.77 -1.26 -4.48 117.00 110.36 1dcj n LEU 71 Ca 0.00 0.58 -0.33 0.00 -0.03 0.00 0.00 56.01 56.23 1dcj n LEU 71 Cb 0.00 -0.61 -0.07 0.00 -2.33 0.00 0.00 43.42 40.41 1dcj n LEU 71 CO 0.00 -2.78 0.58 -2.16 -1.33 0.00 0.00 177.39 171.70 1dcj s PRO 72 N -0.69 4.21 0.87 3.23 0.04 -1.26 -5.13 135.00 136.28 1dcj s PRO 72 Ca 0.41 1.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.35 1dcj s PRO 72 Cb -0.46 -2.34 0.11 0.00 0.04 0.00 0.00 34.50 31.85 1dcj s PRO 72 CO 0.43 0.07 1.10 0.71 0.04 0.00 0.00 177.00 179.35 1dcj s TYR 73 N -2.04 2.51 0.01 0.56 2.02 0.62 -4.76 117.35 116.28 1dcj s TYR 73 Ca 0.58 1.13 -0.12 0.00 -0.37 0.00 0.00 57.07 58.29 1dcj s TYR 73 Cb -0.11 -3.19 0.01 0.00 -0.40 0.00 0.00 41.96 38.27 1dcj s TYR 73 CO 0.16 -2.21 0.25 1.03 -1.57 0.00 0.00 175.55 173.20 1dcj s ARG 74 N -5.07 0.67 -0.21 -0.62 0.52 -0.61 -0.99 118.95 112.64 1dcj s ARG 74 Ca 0.63 -0.40 -0.09 0.00 -0.52 0.00 0.00 55.73 55.35 1dcj s ARG 74 Cb -0.16 0.29 0.09 0.00 0.52 0.00 0.00 34.95 35.68 1dcj s ARG 74 CO 0.55 -0.19 0.47 0.71 0.02 0.00 0.00 175.30 176.87 1dcj s TYR 75 N -1.89 -0.85 0.29 -0.53 2.02 -0.40 0.20 117.35 116.19 1dcj s TYR 75 Ca -0.10 1.64 -0.10 0.00 -0.37 0.00 0.00 57.07 58.14 1dcj s TYR 75 Cb -0.04 0.40 -0.07 0.00 -0.40 0.00 0.00 41.96 41.85 1dcj s TYR 75 CO 0.00 -0.48 0.64 -1.17 -1.57 0.00 0.00 175.55 172.97 1dcj s LEU 76 N 2.29 4.06 -0.21 -1.29 2.96 0.20 -1.72 118.68 124.98 1dcj s LEU 76 Ca -0.05 1.01 -0.04 0.00 -0.22 0.00 0.00 54.13 54.84 1dcj s LEU 76 Cb -0.11 -3.82 0.09 0.00 0.50 0.00 0.00 46.19 42.86 1dcj s LEU 76 CO -0.14 -0.19 0.20 -0.63 -1.32 0.00 0.00 176.35 174.27 1dcj s ILE 77 N -2.00 -0.28 -0.46 6.68 1.01 -0.11 0.11 121.20 126.15 1dcj s ILE 77 Ca 0.49 -0.20 -0.28 0.00 0.00 0.00 0.00 60.65 60.66 1dcj s ILE 77 Cb -0.11 -0.71 -0.00 0.00 0.01 0.00 0.00 42.46 41.65 1dcj s ILE 77 CO 0.24 -0.28 1.63 -0.60 0.00 0.00 0.00 174.94 175.92 1dcj s ARG 78 N 2.28 3.24 0.64 2.79 3.52 0.25 -2.24 118.95 129.43 1dcj s ARG 78 Ca 0.06 0.91 -0.17 0.00 -0.13 0.00 0.00 55.73 56.40 1dcj s ARG 78 Cb -0.16 -4.18 -0.06 0.00 -1.56 0.00 0.00 34.95 29.00 1dcj s ARG 78 CO -0.15 -1.98 0.59 1.63 -0.81 0.00 0.00 175.30 174.57 1dcj n LYS 79 N 8.55 0.48 -2.05 5.12 4.76 -0.21 -1.59 118.16 133.22 1dcj n LYS 79 Ca 0.18 0.20 -0.01 0.00 -2.87 0.00 0.00 58.31 55.81 1dcj n LYS 79 Cb 0.49 -1.82 0.01 0.00 -1.84 0.00 0.00 35.03 31.86 1dcj n LYS 79 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1dcj n GLY 80 N 1.66 1.09 2.98 0.72 0.00 -1.26 -0.67 105.19 109.72 1dcj n GLY 80 Ca 0.11 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1dcj n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93