#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d3z s GLN 2 N 0.00 3.62 0.25 3.17 -0.21 -1.26 -0.12 119.66 125.11 1d3z s GLN 2 Ca 0.00 0.06 0.04 0.00 0.02 0.00 0.00 55.36 55.48 1d3z s GLN 2 Cb 0.00 -3.18 -0.05 0.00 1.00 0.00 0.00 33.01 30.77 1d3z s GLN 2 CO 0.00 0.73 0.01 0.96 -2.12 0.00 0.00 175.29 174.87 1d3z s ILE 3 N -1.09 1.09 -0.02 1.08 -4.36 -0.33 -0.99 121.20 116.59 1d3z s ILE 3 Ca 0.20 -2.03 0.06 0.00 -0.26 0.00 0.00 60.65 58.61 1d3z s ILE 3 Cb -0.14 -2.46 -0.02 0.00 1.25 0.00 0.00 42.46 41.10 1d3z s ILE 3 CO 0.09 -0.24 -0.20 -0.36 0.24 0.00 0.00 174.94 174.47 1d3z s PHE 4 N -3.38 1.79 -0.13 1.37 0.08 -0.22 -1.38 117.98 116.11 1d3z s PHE 4 Ca 0.31 -0.34 0.02 0.00 0.12 0.00 0.00 56.93 57.04 1d3z s PHE 4 Cb 0.06 -1.15 0.01 0.00 -0.57 0.00 0.00 43.02 41.37 1d3z s PHE 4 CO 0.11 -0.03 -0.19 0.08 -0.10 0.00 0.00 175.22 175.08 1d3z s VAL 5 N -0.47 1.85 -0.11 -0.44 1.01 0.13 0.83 120.40 123.20 1d3z s VAL 5 Ca 0.08 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 1d3z s VAL 5 Cb -0.08 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1d3z s VAL 5 CO -0.01 0.51 0.15 -0.54 0.00 0.00 0.00 175.10 175.21 1d3z s LYS 6 N 0.94 3.46 0.42 2.72 1.02 -0.37 -0.36 119.74 127.57 1d3z s LYS 6 Ca -0.06 -0.11 0.08 0.00 0.02 0.00 0.00 55.97 55.90 1d3z s LYS 6 Cb -0.15 -3.19 0.01 0.00 -0.52 0.00 0.00 37.83 33.98 1d3z s LYS 6 CO -0.03 0.78 0.58 0.95 -0.92 0.00 0.00 175.35 176.70 1d3z s THR 7 N -1.03 3.00 0.47 2.17 -4.23 0.38 -1.23 115.64 115.16 1d3z s THR 7 Ca 0.15 -0.99 0.31 0.00 -1.18 0.00 0.00 61.69 59.98 1d3z s THR 7 Cb -0.12 -3.00 0.34 0.00 1.34 0.00 0.00 72.50 71.05 1d3z s THR 7 CO 0.04 -0.00 2.15 -0.07 -0.54 0.00 0.00 174.62 176.21 1d3z h LEU 8 N 0.63 0.00 -1.12 4.79 3.38 -1.89 -1.99 115.31 119.11 1d3z h LEU 8 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1d3z h LEU 8 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1d3z h LEU 8 CO 0.45 0.07 0.00 0.35 0.09 0.00 0.00 178.44 179.40 1d3z n THR 9 N -3.57 0.00 -0.33 0.22 -2.24 -1.26 -4.92 114.28 102.18 1d3z n THR 9 Ca -0.02 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1d3z n THR 9 Cb 0.18 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1d3z n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d3z n GLY 10 N 1.20 0.82 3.84 3.38 0.00 -0.75 -5.08 105.19 108.60 1d3z n GLY 10 Ca 0.18 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1d3z n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1d3z s LYS 11 N -0.66 4.02 -0.12 1.61 2.20 -1.26 -4.85 119.74 120.68 1d3z s LYS 11 Ca 0.00 0.55 0.03 0.00 -0.36 0.00 0.00 55.97 56.18 1d3z s LYS 11 Cb 0.00 -2.92 -0.00 0.00 -1.51 0.00 0.00 37.83 33.39 1d3z s LYS 11 CO 0.00 0.47 -0.21 0.99 -0.36 0.00 0.00 175.35 176.24 1d3z s THR 12 N -1.47 2.33 -0.06 3.43 2.01 -1.26 -0.47 115.64 120.14 1d3z s THR 12 Ca 0.39 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.49 1d3z s THR 12 Cb -0.15 -1.92 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 1d3z s THR 12 CO 0.19 0.55 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.94 1d3z s ILE 13 N 0.45 3.43 -0.19 1.82 1.01 0.52 -4.93 121.20 123.31 1d3z s ILE 13 Ca -0.14 -0.58 -0.09 0.00 0.00 0.00 0.00 60.65 59.83 1d3z s ILE 13 Cb -0.17 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.87 1d3z s ILE 13 CO 0.06 0.59 0.11 -0.89 0.00 0.00 0.00 174.94 174.81 1d3z s THR 14 N -0.71 5.24 0.07 2.92 2.01 -1.26 -0.69 115.64 123.22 1d3z s THR 14 Ca 0.11 0.13 0.07 0.00 0.31 0.00 0.00 61.69 62.31 1d3z s THR 14 Cb -0.11 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 1d3z s THR 14 CO 0.01 0.46 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.44 1d3z s LEU 15 N 0.27 2.23 -0.26 4.42 1.02 -0.48 -4.99 118.68 120.89 1d3z s LEU 15 Ca 0.07 -0.59 -0.09 0.00 0.02 0.00 0.00 54.13 53.53 1d3z s LEU 15 Cb -0.11 -0.89 -0.04 0.00 0.02 0.00 0.00 46.19 45.16 1d3z s LEU 15 CO -0.01 0.10 0.14 -0.70 0.02 0.00 0.00 176.35 175.89 1d3z s GLU 16 N -1.52 3.88 0.17 1.70 2.56 -1.26 -1.19 118.70 123.04 1d3z s GLU 16 Ca 0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 54.97 54.66 1d3z s GLU 16 Cb -0.09 -3.50 -0.04 0.00 2.00 0.00 0.00 34.13 32.50 1d3z s GLU 16 CO 0.03 -0.10 0.09 0.14 -0.56 0.00 0.00 175.26 174.86 1d3z s VAL 17 N 1.48 0.05 0.12 3.70 -7.23 0.82 -4.96 120.40 114.38 1d3z s VAL 17 Ca 0.06 -1.96 0.10 0.00 -1.81 0.00 0.00 61.98 58.38 1d3z s VAL 17 Cb -0.15 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 1d3z s VAL 17 CO 0.07 -0.23 -0.24 -1.61 -0.31 0.00 0.00 175.10 172.78 1d3z s GLU 18 N -4.11 1.56 0.60 4.82 8.01 -1.26 0.16 118.70 128.48 1d3z s GLU 18 Ca 0.32 -1.28 0.30 0.00 0.01 0.00 0.00 54.97 54.32 1d3z s GLU 18 Cb 0.07 -1.98 1.75 0.00 -4.31 0.00 0.00 34.13 29.66 1d3z s GLU 18 CO 0.07 0.46 2.14 -1.35 0.01 0.00 0.00 175.26 176.59 1d3z h PRO 19 N 3.88 0.00 -0.01 0.39 0.11 -1.95 0.15 132.00 134.56 1d3z h PRO 19 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1d3z h PRO 19 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1d3z h PRO 19 CO 0.42 0.00 -0.04 -1.13 -0.21 0.00 0.00 178.00 177.04 1d3z n SER 20 N -3.69 0.69 -4.77 -2.05 3.41 -1.26 -1.80 113.62 104.14 1d3z n SER 20 Ca 0.00 -1.04 -0.39 0.00 -0.26 0.00 0.00 58.87 57.19 1d3z n SER 20 Cb 0.27 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.17 1d3z n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1d3z s ASP 21 N -2.16 6.67 0.46 4.04 1.01 0.04 -4.86 116.67 121.87 1d3z s ASP 21 Ca 0.38 2.38 -0.08 0.00 0.71 0.00 0.00 52.55 55.94 1d3z s ASP 21 Cb 0.21 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.47 1d3z s ASP 21 CO 0.39 -0.58 0.80 0.42 0.21 0.00 0.00 175.17 176.42 1d3z s THR 22 N -1.35 4.84 0.24 -1.27 -4.23 -1.26 -2.12 115.64 110.48 1d3z s THR 22 Ca 0.54 0.45 -0.06 0.00 -1.18 0.00 0.00 61.69 61.44 1d3z s THR 22 Cb -0.32 -3.81 0.22 0.00 1.34 0.00 0.00 72.50 69.94 1d3z s THR 22 CO 0.41 -0.74 1.88 0.40 -0.54 0.00 0.00 174.62 176.03 1d3z h ILE 23 N 0.54 1.26 -0.86 2.99 1.08 -1.46 -0.86 117.51 120.20 1d3z h ILE 23 Ca -0.47 -0.59 0.01 0.00 -0.39 0.00 0.00 64.86 63.42 1d3z h ILE 23 Cb 1.20 -0.03 -0.04 0.00 -3.07 0.00 0.00 36.82 34.87 1d3z h ILE 23 CO 0.63 0.28 0.57 -0.08 -0.69 0.00 0.00 178.15 178.85 1d3z h GLU 24 N 1.29 1.14 -0.65 2.37 4.81 -1.82 0.43 114.58 122.14 1d3z h GLU 24 Ca 0.33 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.40 1d3z h GLU 24 Cb -0.02 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.08 1d3z h GLU 24 CO -0.06 0.76 0.06 -0.91 -0.73 0.00 0.00 179.01 178.12 1d3z h ASN 25 N 1.17 1.07 -0.50 1.04 2.35 -1.56 -1.17 115.58 117.98 1d3z h ASN 25 Ca 0.32 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1d3z h ASN 25 Cb -0.13 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 37.93 1d3z h ASN 25 CO -0.07 1.09 0.22 0.58 -1.65 0.00 0.00 177.43 177.60 1d3z h VAL 26 N 1.02 1.20 -1.00 2.81 2.07 -0.06 -1.34 116.25 120.95 1d3z h VAL 26 Ca 0.19 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 67.12 1d3z h VAL 26 Cb 0.50 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1d3z h VAL 26 CO 0.02 0.23 0.66 0.11 0.02 0.00 0.00 177.57 178.61 1d3z h LYS 27 N 0.67 1.32 -0.69 1.57 1.57 -0.67 -1.71 116.57 118.63 1d3z h LYS 27 Ca 0.17 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1d3z h LYS 27 Cb 0.16 -0.30 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 1d3z h LYS 27 CO -0.02 0.88 0.28 0.00 -0.57 0.00 0.00 179.45 180.02 1d3z h ALA 28 N 1.37 1.21 -0.69 3.86 0.00 -0.64 -0.26 119.26 124.12 1d3z h ALA 28 Ca 0.37 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1d3z h ALA 28 Cb -0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.34 1d3z h ALA 28 CO -0.08 0.58 0.15 0.87 0.00 0.00 0.00 179.25 180.77 1d3z h LYS 29 N 0.99 1.11 -0.72 0.00 1.57 -0.42 -1.71 116.57 117.39 1d3z h LYS 29 Ca 0.23 -0.27 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1d3z h LYS 29 Cb 0.17 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1d3z h LYS 29 CO -0.02 0.99 0.18 0.82 -0.57 0.00 0.00 179.45 180.85 1d3z h ILE 30 N 1.05 1.26 -0.58 1.86 2.04 -0.65 -2.04 117.51 120.45 1d3z h ILE 30 Ca 0.21 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.11 1d3z h ILE 30 Cb 0.39 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1d3z h ILE 30 CO 0.01 0.37 0.38 -0.61 0.00 0.00 0.00 178.15 178.30 1d3z h GLN 31 N 1.08 0.76 -0.86 2.37 4.15 -0.63 0.28 115.11 122.26 1d3z h GLN 31 Ca 0.23 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 1d3z h GLN 31 Cb 0.37 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 27.84 1d3z h GLN 31 CO 0.00 0.50 0.44 0.22 -1.93 0.00 0.00 178.83 178.07 1d3z h ASP 32 N 0.79 1.11 0.19 -0.69 3.58 -0.99 0.24 116.42 120.64 1d3z h ASP 32 Ca 0.21 -0.12 -0.27 0.00 0.42 0.00 0.00 57.03 57.28 1d3z h ASP 32 Cb -0.09 -0.28 0.03 0.00 1.72 0.00 0.00 39.33 40.70 1d3z h ASP 32 CO -0.05 0.91 -1.20 0.11 -2.88 0.00 0.00 179.24 176.13 1d3z h LYS 33 N 1.22 0.40 0.00 0.28 1.57 -0.87 -3.40 116.57 115.76 1d3z h LYS 33 Ca 0.30 -0.68 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1d3z h LYS 33 Cb 0.08 0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1d3z h LYS 33 CO -0.04 1.33 -0.61 0.39 -0.57 0.00 0.00 179.45 179.95 1d3z n GLU 34 N -3.91 3.21 -0.96 3.15 -0.58 0.93 -5.01 120.64 117.47 1d3z n GLU 34 Ca -0.17 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 1d3z n GLU 34 Cb 0.96 -1.02 0.00 0.00 -0.57 0.00 0.00 31.44 30.81 1d3z n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d3z n GLY 35 N 1.32 0.51 3.72 0.62 0.00 0.84 -5.02 105.19 107.18 1d3z n GLY 35 Ca 0.01 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1d3z n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1d3z s ILE 36 N -2.00 4.93 0.12 -0.61 1.01 -1.26 -5.00 121.20 118.40 1d3z s ILE 36 Ca 0.00 1.71 -0.30 0.00 0.00 0.00 0.00 60.65 62.06 1d3z s ILE 36 Cb 0.00 -4.16 -0.07 0.00 0.01 0.00 0.00 42.46 38.24 1d3z s ILE 36 CO 0.00 0.23 1.16 -2.16 0.00 0.00 0.00 174.94 174.17 1d3z s PRO 37 N 0.76 4.51 0.52 2.79 0.04 -1.26 -4.00 135.00 138.37 1d3z s PRO 37 Ca 0.43 1.76 0.32 0.00 0.04 0.00 0.00 61.00 63.55 1d3z s PRO 37 Cb -0.19 -3.30 1.47 0.00 0.04 0.00 0.00 34.50 32.51 1d3z s PRO 37 CO 0.23 -0.10 1.85 -1.35 0.04 0.00 0.00 177.00 177.67 1d3z h PRO 38 N 5.89 0.04 0.00 0.56 0.11 -1.94 -0.07 132.00 136.59 1d3z h PRO 38 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1d3z h PRO 38 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1d3z h PRO 38 CO 0.76 0.03 0.00 0.22 -0.21 0.00 0.00 178.00 178.80 1d3z h ASP 39 N 0.05 0.00 -0.03 -2.05 3.58 -1.92 -2.73 116.42 113.32 1d3z h ASP 39 Ca 0.49 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.94 1d3z h ASP 39 Cb 1.87 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.92 1d3z h ASP 39 CO -0.03 0.00 -0.00 0.00 -2.88 0.00 0.00 179.24 176.33 1d3z n GLN 40 N -2.77 2.32 -4.31 0.28 1.13 -0.04 -4.87 117.38 109.12 1d3z n GLN 40 Ca 0.02 -1.92 -0.35 0.00 -1.94 0.00 0.00 57.00 52.80 1d3z n GLN 40 Cb 0.31 -1.46 -0.09 0.00 0.11 0.00 0.00 30.24 29.11 1d3z n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1d3z s GLN 41 N -2.00 3.07 -0.12 -1.09 -0.21 -1.03 -0.78 119.66 117.49 1d3z s GLN 41 Ca 0.28 -0.38 0.01 0.00 0.02 0.00 0.00 55.36 55.29 1d3z s GLN 41 Cb 0.20 -2.85 0.02 0.00 1.00 0.00 0.00 33.01 31.38 1d3z s GLN 41 CO 0.30 0.69 -0.13 1.03 -2.12 0.00 0.00 175.29 175.07 1d3z s ARG 42 N -0.85 2.04 -0.18 2.91 0.52 -0.05 -4.99 118.95 118.35 1d3z s ARG 42 Ca 0.13 -0.48 -0.08 0.00 -0.52 0.00 0.00 55.73 54.79 1d3z s ARG 42 Cb -0.11 -1.85 -0.04 0.00 0.52 0.00 0.00 34.95 33.46 1d3z s ARG 42 CO 0.02 -0.16 0.07 -0.51 0.02 0.00 0.00 175.30 174.74 1d3z s LEU 43 N 1.30 3.85 -0.04 2.53 1.43 -1.26 -0.59 118.68 125.90 1d3z s LEU 43 Ca -0.01 0.10 0.04 0.00 -1.03 0.00 0.00 54.13 53.24 1d3z s LEU 43 Cb -0.14 -1.98 -0.00 0.00 0.03 0.00 0.00 46.19 44.10 1d3z s LEU 43 CO -0.06 0.18 -0.17 -0.63 0.23 0.00 0.00 176.35 175.90 1d3z s ILE 44 N 0.36 1.39 -0.03 -0.59 1.01 -0.18 -0.84 121.20 122.32 1d3z s ILE 44 Ca 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1d3z s ILE 44 Cb -0.12 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.18 1d3z s ILE 44 CO -0.00 0.40 0.01 0.12 0.00 0.00 0.00 174.94 175.47 1d3z s PHE 45 N -0.03 0.28 -1.62 3.97 5.36 -0.27 -1.22 117.98 124.45 1d3z s PHE 45 Ca -0.02 0.02 -0.16 0.00 -0.96 0.00 0.00 56.93 55.81 1d3z s PHE 45 Cb -0.11 -0.41 0.12 0.00 -0.34 0.00 0.00 43.02 42.29 1d3z s PHE 45 CO 0.02 -0.13 0.89 0.00 -1.46 0.00 0.00 175.22 174.53 1d3z n ALA 46 N 4.24 -1.27 -1.00 11.12 0.00 -1.26 -0.74 120.51 131.59 1d3z n ALA 46 Ca -0.25 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1d3z n ALA 46 Cb 0.50 -4.01 0.00 0.00 0.00 0.00 0.00 19.45 15.94 1d3z n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d3z n GLY 47 N -1.55 0.97 3.50 0.00 0.00 -1.26 -5.03 105.19 101.82 1d3z n GLY 47 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1d3z n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d3z s LYS 48 N -0.00 2.71 0.00 1.61 1.02 0.08 -5.10 119.74 120.06 1d3z s LYS 48 Ca 0.00 -0.64 -0.30 0.00 0.02 0.00 0.00 55.97 55.04 1d3z s LYS 48 Cb 0.00 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1d3z s LYS 48 CO 0.00 0.58 1.05 -0.65 -0.92 0.00 0.00 175.35 175.41 1d3z s GLN 49 N -0.60 4.51 0.05 1.68 -0.21 -1.26 -1.11 119.66 122.72 1d3z s GLN 49 Ca 0.09 1.52 -0.22 0.00 0.02 0.00 0.00 55.36 56.76 1d3z s GLN 49 Cb -0.11 -3.44 -0.06 0.00 1.00 0.00 0.00 33.01 30.39 1d3z s GLN 49 CO 0.01 -0.14 0.67 -0.51 -2.12 0.00 0.00 175.29 173.21 1d3z s LEU 50 N 1.16 4.47 0.21 2.90 1.43 -0.02 -4.97 118.68 123.85 1d3z s LEU 50 Ca 0.54 1.34 -0.08 0.00 -1.03 0.00 0.00 54.13 54.90 1d3z s LEU 50 Cb -0.23 -3.08 -0.07 0.00 0.03 0.00 0.00 46.19 42.85 1d3z s LEU 50 CO 0.27 0.12 0.51 -1.61 0.23 0.00 0.00 176.35 175.87 1d3z s GLU 51 N -0.44 3.76 0.59 1.70 2.02 -1.26 -4.66 118.70 120.40 1d3z s GLU 51 Ca 0.34 0.19 0.37 0.00 0.02 0.00 0.00 54.97 55.88 1d3z s GLU 51 Cb -0.20 -2.70 1.68 0.00 0.10 0.00 0.00 34.13 33.02 1d3z s GLU 51 CO 0.21 0.36 2.10 -0.44 0.02 0.00 0.00 175.26 177.50 1d3z h ASP 52 N 2.62 0.00 -0.19 -0.19 5.19 -1.97 -2.86 116.42 119.02 1d3z h ASP 52 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1d3z h ASP 52 Cb 1.17 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.68 1d3z h ASP 52 CO 0.70 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.43 1d3z n GLY 53 N -0.29 0.79 3.76 2.75 0.00 -1.26 -3.46 105.19 107.47 1d3z n GLY 53 Ca -0.00 -0.56 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 1d3z n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1d3z s ARG 54 N -1.77 2.40 0.37 1.61 1.81 -1.08 -4.99 118.95 117.30 1d3z s ARG 54 Ca 0.34 -1.56 0.08 0.00 -1.72 0.00 0.00 55.73 52.87 1d3z s ARG 54 Cb 0.20 -2.20 -0.03 0.00 -0.45 0.00 0.00 34.95 32.48 1d3z s ARG 54 CO 0.30 0.05 0.30 0.95 -0.68 0.00 0.00 175.30 176.22 1d3z s THR 55 N -2.44 3.04 0.21 0.02 -4.23 -1.26 -1.52 115.64 109.46 1d3z s THR 55 Ca 0.39 -1.41 -0.10 0.00 -1.18 0.00 0.00 61.69 59.39 1d3z s THR 55 Cb -0.02 -3.07 0.16 0.00 1.34 0.00 0.00 72.50 70.91 1d3z s THR 55 CO 0.23 -0.09 1.88 -0.07 -0.54 0.00 0.00 174.62 176.03 1d3z h LEU 56 N 1.20 0.89 -1.80 4.79 3.38 -1.42 -2.37 115.31 119.98 1d3z h LEU 56 Ca -0.43 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 1d3z h LEU 56 Cb 1.26 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1d3z h LEU 56 CO 0.59 0.65 -0.09 0.77 0.09 0.00 0.00 178.44 180.44 1d3z h SER 57 N 1.05 0.01 0.14 -0.43 4.64 -1.65 -1.50 113.55 115.80 1d3z h SER 57 Ca 0.28 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.58 1d3z h SER 57 Cb -0.12 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1d3z h SER 57 CO -0.06 0.10 -0.10 0.44 -0.87 0.00 0.00 176.83 176.34 1d3z h ASP 58 N 0.01 0.00 -0.67 4.97 3.32 -1.71 -1.30 116.42 121.03 1d3z h ASP 58 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d3z h ASP 58 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1d3z h ASP 58 CO 0.01 0.10 0.00 -1.22 -1.72 0.00 0.00 179.24 176.41 1d3z n TYR 59 N -4.17 1.45 -4.04 4.55 4.01 -0.58 -4.94 117.16 113.43 1d3z n TYR 59 Ca -0.03 -0.59 -0.33 0.00 -0.16 0.00 0.00 57.90 56.79 1d3z n TYR 59 Cb 0.18 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 1d3z n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1d3z n ASN 60 N 1.23 -4.11 -4.67 7.72 3.02 -0.49 -4.91 115.26 113.05 1d3z n ASN 60 Ca 0.26 -0.87 -0.43 0.00 -0.03 0.00 0.00 54.58 53.51 1d3z n ASN 60 Cb 0.87 -3.32 -0.03 0.00 -0.61 0.00 0.00 39.78 36.69 1d3z n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1d3z s ILE 61 N -3.27 4.75 0.40 2.41 1.01 -1.11 -5.03 121.20 120.36 1d3z s ILE 61 Ca 0.70 1.93 0.08 0.00 0.00 0.00 0.00 60.65 63.35 1d3z s ILE 61 Cb -0.37 -4.27 -0.02 0.00 0.01 0.00 0.00 42.46 37.82 1d3z s ILE 61 CO 0.86 -0.10 0.36 -1.10 0.00 0.00 0.00 174.94 174.97 1d3z s GLN 62 N 2.74 2.57 0.34 2.79 -0.21 -1.26 -4.74 119.66 121.89 1d3z s GLN 62 Ca 0.43 -1.48 -0.27 0.00 0.02 0.00 0.00 55.36 54.06 1d3z s GLN 62 Cb -0.16 -2.40 -0.13 0.00 1.00 0.00 0.00 33.01 31.32 1d3z s GLN 62 CO 0.10 -0.14 1.02 0.36 -2.12 0.00 0.00 175.29 174.51 1d3z n LYS 63 N -1.52 1.40 -1.66 2.91 2.85 -1.26 -1.39 118.16 119.50 1d3z n LYS 63 Ca 0.03 0.49 -0.14 0.00 -1.05 0.00 0.00 58.31 57.64 1d3z n LYS 63 Cb 0.61 -1.93 -0.04 0.00 -0.65 0.00 0.00 35.03 33.01 1d3z n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1d3z n GLU 64 N 0.54 -1.00 -2.68 -1.58 1.02 -0.16 -5.00 120.64 111.78 1d3z n GLU 64 Ca 0.09 0.89 -0.35 0.00 -0.02 0.00 0.00 57.16 57.78 1d3z n GLU 64 Cb 0.35 -5.03 -0.05 0.00 -0.02 0.00 0.00 31.44 26.69 1d3z n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1d3z s SER 65 N -2.71 6.79 -0.19 1.62 0.01 -0.49 -4.82 113.70 113.92 1d3z s SER 65 Ca 0.00 1.85 -0.03 0.00 1.31 0.00 0.00 55.95 59.08 1d3z s SER 65 Cb 0.00 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 1d3z s SER 65 CO 0.00 -0.46 -0.06 -0.89 0.41 0.00 0.00 173.24 172.23 1d3z s THR 66 N -1.94 3.40 0.23 1.44 2.01 -1.26 -1.06 115.64 118.47 1d3z s THR 66 Ca 0.61 -0.51 0.06 0.00 0.31 0.00 0.00 61.69 62.17 1d3z s THR 66 Cb -0.15 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 1d3z s THR 66 CO 0.19 0.46 0.22 -0.76 -0.69 0.00 0.00 174.62 174.05 1d3z s LEU 67 N 0.98 3.93 -0.11 4.42 1.02 0.24 -4.85 118.68 124.31 1d3z s LEU 67 Ca -0.00 -0.16 0.00 0.00 0.02 0.00 0.00 54.13 53.99 1d3z s LEU 67 Cb -0.15 -2.48 -0.02 0.00 0.02 0.00 0.00 46.19 43.57 1d3z s LEU 67 CO 0.00 -0.03 -0.12 -1.00 0.02 0.00 0.00 176.35 175.22 1d3z s HIS 68 N -2.04 2.82 -0.15 0.29 3.76 -0.36 -1.23 115.29 118.37 1d3z s HIS 68 Ca 0.33 -0.48 -0.05 0.00 -0.15 0.00 0.00 55.06 54.71 1d3z s HIS 68 Cb -0.08 -1.80 -0.03 0.00 1.11 0.00 0.00 32.58 31.77 1d3z s HIS 68 CO 0.26 -0.09 0.02 -1.17 -0.85 0.00 0.00 174.74 172.91 1d3z s LEU 69 N 0.08 3.61 -0.04 0.89 2.96 -0.36 -1.01 118.68 124.80 1d3z s LEU 69 Ca -0.05 0.04 0.07 0.00 -0.22 0.00 0.00 54.13 53.98 1d3z s LEU 69 Cb -0.14 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 1d3z s LEU 69 CO 0.04 0.23 -0.26 -0.69 -1.32 0.00 0.00 176.35 174.35 1d3z s VAL 70 N 0.04 2.05 -0.12 1.68 1.01 0.24 -4.12 120.40 121.18 1d3z s VAL 70 Ca 0.03 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 60.88 1d3z s VAL 70 Cb -0.13 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1d3z s VAL 70 CO 0.02 0.58 0.06 -0.76 0.00 0.00 0.00 175.10 175.00 1d3z s LEU 71 N -0.40 3.92 -0.02 3.92 1.43 -1.26 -0.87 118.68 125.40 1d3z s LEU 71 Ca 0.04 0.25 0.08 0.00 -1.03 0.00 0.00 54.13 53.46 1d3z s LEU 71 Cb -0.12 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 1d3z s LEU 71 CO 0.01 0.34 -0.26 -0.60 0.23 0.00 0.00 176.35 176.08 1d3z s ARG 72 N -0.66 2.12 0.46 1.70 3.52 0.04 -4.99 118.95 121.14 1d3z s ARG 72 Ca 0.12 -0.93 0.05 0.00 -0.13 0.00 0.00 55.73 54.84 1d3z s ARG 72 Cb -0.12 -2.05 -0.04 0.00 -1.56 0.00 0.00 34.95 31.19 1d3z s ARG 72 CO 0.02 0.56 0.09 -0.51 -0.81 0.00 0.00 175.30 174.66 1d3z s LEU 73 N -0.61 2.71 -0.40 -0.88 1.43 -1.26 -4.76 118.68 114.91 1d3z s LEU 73 Ca 0.10 -1.39 -0.12 0.00 -1.03 0.00 0.00 54.13 51.69 1d3z s LEU 73 Cb -0.10 -1.00 0.02 0.00 0.03 0.00 0.00 46.19 45.13 1d3z s LEU 73 CO -0.01 -0.69 0.46 -1.14 0.23 0.00 0.00 176.35 175.20 1d3z n ARG 74 N -1.23 -2.66 -3.19 1.70 0.63 -1.26 -5.00 116.66 105.65 1d3z n ARG 74 Ca -0.09 2.29 0.00 0.00 -0.92 0.00 0.00 57.85 59.13 1d3z n ARG 74 Cb 0.66 -5.62 0.00 0.00 0.45 0.00 0.00 32.46 27.95 1d3z n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1d3z n GLY 75 N -0.06 -0.50 0.00 5.14 0.00 -1.26 -5.21 105.19 103.29 1d3z n GLY 75 Ca 0.09 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1d3z n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93