#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 3.59 0.26 3.17 -0.21 -1.26 -0.33 119.66 124.87 1d3z s GLN 2 Ca 0.00 0.01 0.04 0.00 0.02 0.00 0.00 55.36 55.43 1d3z s GLN 2 Cb 0.00 -3.17 -0.05 0.00 1.00 0.00 0.00 33.01 30.78 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 -1.10 1.09 -0.02 1.08 -4.36 -0.36 -0.77 121.20 116.75 1d3z s ILE 3 Ca 0.20 -2.03 0.06 0.00 -0.26 0.00 0.00 60.65 58.62 1d3z s ILE 3 Cb -0.13 -2.48 -0.01 0.00 1.25 0.00 0.00 42.46 41.09 1d3z s ILE 3 CO 0.09 -0.22 -0.20 -0.36 0.24 0.00 0.00 174.94 174.49 1d3z s PHE 4 N -3.38 1.81 -0.14 1.37 0.08 -0.21 -1.28 117.98 116.23 1d3z s PHE 4 Ca 0.31 -0.37 0.02 0.00 0.12 0.00 0.00 56.93 57.01 1d3z s PHE 4 Cb 0.06 -1.17 0.01 0.00 -0.57 0.00 0.00 43.02 41.35 1d3z s PHE 4 CO 0.11 -0.05 -0.20 0.08 -0.10 0.00 0.00 175.22 175.06 1d3z s VAL 5 N -0.40 1.92 -0.08 -0.44 1.01 0.65 0.14 120.40 123.20 1d3z s VAL 5 Ca 0.06 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 1d3z s VAL 5 Cb -0.08 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1d3z s VAL 5 CO -0.00 0.52 0.13 -0.54 0.00 0.00 0.00 175.10 175.21 1d3z s LYS 6 N 0.95 3.36 0.29 2.72 1.02 -0.11 -0.01 119.74 127.96 1d3z s LYS 6 Ca -0.05 -0.24 0.07 0.00 0.02 0.00 0.00 55.97 55.77 1d3z s LYS 6 Cb -0.15 -3.10 -0.03 0.00 -0.52 0.00 0.00 37.83 34.04 1d3z s LYS 6 CO -0.04 0.73 0.30 0.95 -0.92 0.00 0.00 175.35 176.38 1d3z s THR 7 N -1.11 4.22 -0.35 2.17 -4.23 0.59 -1.22 115.64 115.71 1d3z s THR 7 Ca 0.19 -1.25 0.21 0.00 -1.18 0.00 0.00 61.69 59.66 1d3z s THR 7 Cb -0.12 -3.41 0.22 0.00 1.34 0.00 0.00 72.50 70.53 1d3z s THR 7 CO 0.09 -0.26 1.65 0.18 -0.54 0.00 0.00 174.62 175.74 1d3z n LEU 8 N -1.36 0.57 -0.84 4.79 4.77 -1.26 -1.33 117.00 122.34 1d3z n LEU 8 Ca -0.05 0.71 0.12 0.00 -0.03 0.00 0.00 56.01 56.77 1d3z n LEU 8 Cb 0.58 -0.72 0.28 0.00 -2.33 0.00 0.00 43.42 41.23 1d3z n LEU 8 CO 0.43 -0.79 0.73 0.35 -1.33 0.00 0.00 177.39 176.78 1d3z n THR 9 N -2.21 0.19 -0.38 -5.08 -2.24 -1.26 -4.93 114.28 98.38 1d3z n THR 9 Ca -0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1d3z n THR 9 Cb 0.10 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.24 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 1.31 0.79 3.83 3.38 0.00 -0.44 -5.07 105.19 108.99 1d3z n GLY 10 Ca 0.17 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.67 4.01 -0.13 1.61 2.20 -1.25 -4.87 119.74 120.63 1d3z s LYS 11 Ca 0.00 0.51 0.01 0.00 -0.36 0.00 0.00 55.97 56.14 1d3z s LYS 11 Cb 0.00 -3.11 -0.00 0.00 -1.51 0.00 0.00 37.83 33.21 1d3z s LYS 11 CO 0.00 0.59 -0.17 0.99 -0.36 0.00 0.00 175.35 176.40 1d3z s THR 12 N -1.25 2.56 -0.07 3.43 2.01 -1.26 -0.30 115.64 120.77 1d3z s THR 12 Ca 0.31 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.50 1d3z s THR 12 Cb -0.17 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.26 1d3z s THR 12 CO 0.17 0.53 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.91 1d3z s ILE 13 N 0.59 3.47 -0.17 1.82 1.01 0.98 -4.93 121.20 123.97 1d3z s ILE 13 Ca -0.10 -0.56 -0.07 0.00 0.00 0.00 0.00 60.65 59.92 1d3z s ILE 13 Cb -0.16 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1d3z s ILE 13 CO 0.03 0.58 0.07 -0.89 0.00 0.00 0.00 174.94 174.74 1d3z s THR 14 N -0.63 4.89 0.09 2.92 2.01 -1.26 -0.26 115.64 123.40 1d3z s THR 14 Ca 0.09 -0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.16 1d3z s THR 14 Cb -0.11 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.17 1d3z s THR 14 CO 0.02 0.48 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.48 1d3z s LEU 15 N 0.20 2.29 -0.25 4.42 1.43 -0.40 -4.99 118.68 121.37 1d3z s LEU 15 Ca 0.05 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.40 1d3z s LEU 15 Cb -0.12 -0.75 -0.04 0.00 0.03 0.00 0.00 46.19 45.31 1d3z s LEU 15 CO 0.00 0.01 0.13 -0.70 0.23 0.00 0.00 176.35 176.02 1d3z s GLU 16 N -1.83 3.87 0.17 1.70 2.56 -1.26 -1.22 118.70 122.68 1d3z s GLU 16 Ca 0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 54.97 54.62 1d3z s GLU 16 Cb -0.10 -3.46 -0.04 0.00 2.00 0.00 0.00 34.13 32.53 1d3z s GLU 16 CO 0.03 -0.09 0.10 0.14 -0.56 0.00 0.00 175.26 174.89 1d3z s VAL 17 N 1.41 0.04 0.11 3.70 -7.23 0.55 -4.97 120.40 114.02 1d3z s VAL 17 Ca 0.06 -1.97 0.10 0.00 -1.81 0.00 0.00 61.98 58.36 1d3z s VAL 17 Cb -0.15 -2.33 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 1d3z s VAL 17 CO 0.06 -0.18 -0.22 -1.61 -0.31 0.00 0.00 175.10 172.85 1d3z s GLU 18 N -4.12 1.67 0.61 4.82 0.41 -1.26 1.00 118.70 121.83 1d3z s GLU 18 Ca 0.33 -1.22 0.31 0.00 -0.41 0.00 0.00 54.97 53.98 1d3z s GLU 18 Cb 0.07 -2.04 1.77 0.00 -1.78 0.00 0.00 34.13 32.16 1d3z s GLU 18 CO 0.08 0.48 2.14 -1.35 -0.49 0.00 0.00 175.26 176.12 1d3z h PRO 19 N 3.92 0.00 -0.01 0.39 0.11 -1.95 0.46 132.00 134.93 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 0.43 0.00 -0.06 -1.13 -0.21 0.00 0.00 178.00 177.03 1d3z n SER 20 N -3.64 0.66 -4.77 -2.05 3.41 -1.26 -1.81 113.62 104.16 1d3z n SER 20 Ca 0.00 -0.93 -0.39 0.00 -0.26 0.00 0.00 58.87 57.29 1d3z n SER 20 Cb 0.27 -0.03 -0.03 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 -2.25 6.78 0.45 4.04 1.01 0.15 -4.87 116.67 121.99 1d3z s ASP 21 Ca 0.35 2.35 -0.07 0.00 0.71 0.00 0.00 52.55 55.89 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 0.42 -0.50 0.78 0.42 0.21 0.00 0.00 175.17 176.50 1d3z s THR 22 N -1.33 4.86 0.24 -1.27 -4.23 -1.26 -2.25 115.64 110.40 1d3z s THR 22 Ca 0.53 0.37 -0.06 0.00 -1.18 0.00 0.00 61.69 61.35 1d3z s THR 22 Cb -0.32 -3.81 0.22 0.00 1.34 0.00 0.00 72.50 69.93 1d3z s THR 22 CO 0.40 -0.72 1.87 0.40 -0.54 0.00 0.00 174.62 176.04 1d3z h ILE 23 N 0.57 1.26 -0.77 2.99 1.08 -1.44 -0.86 117.51 120.34 1d3z h ILE 23 Ca -0.47 -0.61 0.01 0.00 -0.39 0.00 0.00 64.86 63.40 1d3z h ILE 23 Cb 1.20 -0.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.90 1d3z h ILE 23 CO 0.63 0.28 0.51 -0.08 -0.69 0.00 0.00 178.15 178.80 1d3z h GLU 24 N 1.28 1.01 -0.43 2.37 4.81 -1.82 0.29 114.58 122.08 1d3z h GLU 24 Ca 0.33 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1d3z h GLU 24 Cb -0.01 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 1d3z h GLU 24 CO -0.06 0.67 -0.02 -0.97 -0.73 0.00 0.00 179.01 177.91 1d3z h ASN 25 N 1.04 0.76 -0.81 1.04 -0.73 -1.56 -1.58 115.58 113.75 1d3z h ASN 25 Ca 0.28 -0.32 -0.00 0.00 1.87 0.00 0.00 56.30 58.13 1d3z h ASN 25 Cb -0.12 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 38.23 1d3z h ASN 25 CO -0.06 0.90 0.50 0.58 -0.37 0.00 0.00 177.43 178.98 1d3z h VAL 26 N 0.61 1.22 -1.01 2.57 2.07 -0.21 -1.39 116.25 120.11 1d3z h VAL 26 Ca 0.12 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.19 1d3z h VAL 26 Cb 0.51 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.31 1d3z h VAL 26 CO 0.03 0.23 0.67 0.11 0.02 0.00 0.00 177.57 178.62 1d3z h LYS 27 N 1.10 1.33 -0.70 1.57 1.57 -0.70 -1.72 116.57 119.02 1d3z h LYS 27 Ca 0.29 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 1d3z h LYS 27 Cb -0.07 -0.30 -0.03 0.00 0.08 0.00 0.00 32.23 31.91 1d3z h LYS 27 CO -0.06 0.88 0.30 0.00 -0.57 0.00 0.00 179.45 180.00 1d3z h ALA 28 N 1.37 1.21 -0.62 3.86 0.00 -0.28 0.10 119.26 124.90 1d3z h ALA 28 Ca 0.37 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1d3z h ALA 28 Cb -0.16 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 1d3z h ALA 28 CO -0.08 0.58 0.07 0.87 0.00 0.00 0.00 179.25 180.70 1d3z h LYS 29 N 1.00 1.03 -0.69 0.00 1.57 -0.49 -1.74 116.57 117.24 1d3z h LYS 29 Ca 0.24 -0.28 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 1d3z h LYS 29 Cb 0.16 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1d3z h LYS 29 CO -0.02 0.96 0.12 0.82 -0.57 0.00 0.00 179.45 180.76 1d3z h ILE 30 N 0.96 1.26 -0.60 1.86 2.04 -0.60 -2.13 117.51 120.30 1d3z h ILE 30 Ca 0.19 -1.03 0.01 0.00 1.00 0.00 0.00 64.86 65.02 1d3z h ILE 30 Cb 0.45 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1d3z h ILE 30 CO 0.02 0.39 0.40 -0.61 0.00 0.00 0.00 178.15 178.34 1d3z h GLN 31 N 1.05 0.79 -0.91 2.37 4.15 -0.59 0.37 115.11 122.34 1d3z h GLN 31 Ca 0.21 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.58 1d3z h GLN 31 Cb 0.43 -0.18 -0.04 0.00 0.21 0.00 0.00 27.48 27.90 1d3z h GLN 31 CO 0.01 0.52 0.55 0.22 -1.93 0.00 0.00 178.83 178.21 1d3z h ASP 32 N 0.81 1.10 0.22 -0.69 3.58 -1.02 0.25 116.42 120.66 1d3z h ASP 32 Ca 0.22 -0.07 -0.31 0.00 0.42 0.00 0.00 57.03 57.29 1d3z h ASP 32 Cb -0.09 -0.28 0.03 0.00 1.72 0.00 0.00 39.33 40.71 1d3z h ASP 32 CO -0.05 0.84 -1.43 0.11 -2.88 0.00 0.00 179.24 175.83 1d3z h LYS 33 N 1.26 0.46 0.00 0.28 1.57 -0.78 -3.41 116.57 115.94 1d3z h LYS 33 Ca 0.33 -0.78 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1d3z h LYS 33 Cb -0.06 0.29 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1d3z h LYS 33 CO -0.06 1.37 -0.91 0.39 -0.57 0.00 0.00 179.45 179.68 1d3z n GLU 34 N -3.77 2.23 -0.89 3.15 -0.58 0.13 -5.01 120.64 115.89 1d3z n GLU 34 Ca -0.19 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.51 1d3z n GLU 34 Cb 1.04 -1.08 0.00 0.00 -0.57 0.00 0.00 31.44 30.84 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 1.56 0.54 3.61 0.62 0.00 0.86 -5.02 105.19 107.36 1d3z n GLY 35 Ca 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 4.73 0.28 -0.61 1.01 -1.26 -5.01 121.20 118.34 1d3z s ILE 36 Ca 0.00 1.19 -0.30 0.00 0.00 0.00 0.00 60.65 61.54 1d3z s ILE 36 Cb 0.00 -4.21 -0.12 0.00 0.01 0.00 0.00 42.46 38.14 1d3z s ILE 36 CO 0.00 -0.34 1.57 -2.65 0.00 0.00 0.00 174.94 173.52 1d3z n PRO 37 N 6.38 2.59 -0.28 2.79 -0.02 -1.26 -4.18 135.00 141.02 1d3z n PRO 37 Ca 0.05 0.92 0.29 0.00 -2.02 0.00 0.00 63.50 62.74 1d3z n PRO 37 Cb 0.48 -2.69 0.66 0.00 -0.02 0.00 0.00 33.50 31.93 1d3z n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1d3z h PRO 38 N 4.80 0.13 0.00 0.52 0.11 -1.95 0.09 132.00 135.70 1d3z h PRO 38 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1d3z h PRO 38 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1d3z h PRO 38 CO 0.80 0.09 0.00 -0.44 -0.21 0.00 0.00 178.00 178.23 1d3z h ASP 39 N 0.14 0.00 -0.21 -2.05 3.32 -1.99 -2.64 116.42 112.99 1d3z h ASP 39 Ca 0.53 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.58 1d3z h ASP 39 Cb 1.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.37 1d3z h ASP 39 CO -0.10 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.42 1d3z n GLN 40 N -2.44 2.42 -4.43 3.56 6.02 0.02 -4.93 117.38 117.59 1d3z n GLN 40 Ca 0.02 -2.11 -0.35 0.00 -0.01 0.00 0.00 57.00 54.55 1d3z n GLN 40 Cb 0.26 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.94 1d3z n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1d3z s GLN 41 N -1.75 2.99 -0.11 -1.09 -0.21 -1.00 -1.16 119.66 117.33 1d3z s GLN 41 Ca 0.33 -0.44 0.01 0.00 0.02 0.00 0.00 55.36 55.28 1d3z s GLN 41 Cb 0.21 -2.76 0.02 0.00 1.00 0.00 0.00 33.01 31.48 1d3z s GLN 41 CO 0.31 0.66 -0.13 1.03 -2.12 0.00 0.00 175.29 175.04 1d3z s ARG 42 N -0.77 2.00 -0.16 2.91 0.52 0.17 -4.98 118.95 118.65 1d3z s ARG 42 Ca 0.12 -0.47 -0.05 0.00 -0.52 0.00 0.00 55.73 54.81 1d3z s ARG 42 Cb -0.11 -1.78 -0.03 0.00 0.52 0.00 0.00 34.95 33.55 1d3z s ARG 42 CO 0.02 -0.11 -0.00 -0.51 0.02 0.00 0.00 175.30 174.71 1d3z s LEU 43 N 1.15 3.45 -0.02 2.53 1.43 -1.26 -0.39 118.68 125.57 1d3z s LEU 43 Ca -0.04 -0.04 0.06 0.00 -1.03 0.00 0.00 54.13 53.09 1d3z s LEU 43 Cb -0.14 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1d3z s LEU 43 CO -0.03 0.19 -0.21 -0.63 0.23 0.00 0.00 176.35 175.90 1d3z s ILE 44 N 0.22 1.65 -0.04 -0.59 1.09 -0.25 -0.87 121.20 122.42 1d3z s ILE 44 Ca -0.00 -0.89 -0.00 0.00 -1.10 0.00 0.00 60.65 58.66 1d3z s ILE 44 Cb -0.13 -1.38 0.03 0.00 -1.06 0.00 0.00 42.46 39.92 1d3z s ILE 44 CO 0.02 0.47 0.01 0.12 -0.10 0.00 0.00 174.94 175.46 1d3z s PHE 45 N -0.44 0.34 -1.60 3.97 5.36 -0.11 -1.38 117.98 124.13 1d3z s PHE 45 Ca 0.07 0.01 -0.16 0.00 -0.96 0.00 0.00 56.93 55.88 1d3z s PHE 45 Cb -0.09 -0.49 0.13 0.00 -0.34 0.00 0.00 43.02 42.23 1d3z s PHE 45 CO -0.00 -0.17 0.84 0.00 -1.46 0.00 0.00 175.22 174.42 1d3z n ALA 46 N 4.47 -1.24 -0.85 11.12 0.00 -1.26 -0.77 120.51 131.98 1d3z n ALA 46 Ca -0.20 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1d3z n ALA 46 Cb 0.50 -3.82 0.00 0.00 0.00 0.00 0.00 19.45 16.13 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 -1.48 0.93 3.51 0.00 0.00 -1.26 -5.04 105.19 101.85 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 -0.15 2.68 0.00 1.61 1.02 0.05 -5.10 119.74 119.86 1d3z s LYS 48 Ca 0.00 -0.64 -0.30 0.00 0.02 0.00 0.00 55.97 55.05 1d3z s LYS 48 Cb 0.00 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.79 1d3z s LYS 48 CO 0.00 0.60 1.02 -0.65 -0.92 0.00 0.00 175.35 175.40 1d3z s GLN 49 N -0.66 4.53 0.06 1.68 -0.21 -1.26 -0.93 119.66 122.86 1d3z s GLN 49 Ca 0.10 1.49 -0.22 0.00 0.02 0.00 0.00 55.36 56.74 1d3z s GLN 49 Cb -0.11 -3.45 -0.06 0.00 1.00 0.00 0.00 33.01 30.39 1d3z s GLN 49 CO 0.01 -0.11 0.67 -0.51 -2.12 0.00 0.00 175.29 173.23 1d3z s LEU 50 N 1.09 4.48 0.23 2.90 1.43 -0.05 -4.97 118.68 123.80 1d3z s LEU 50 Ca 0.53 1.35 -0.11 0.00 -1.03 0.00 0.00 54.13 54.87 1d3z s LEU 50 Cb -0.22 -3.06 -0.07 0.00 0.03 0.00 0.00 46.19 42.86 1d3z s LEU 50 CO 0.28 0.14 0.57 -1.61 0.23 0.00 0.00 176.35 175.96 1d3z s GLU 51 N -0.53 3.85 0.56 1.70 2.02 -1.26 -4.69 118.70 120.34 1d3z s GLU 51 Ca 0.33 0.35 0.34 0.00 0.02 0.00 0.00 54.97 56.01 1d3z s GLU 51 Cb -0.20 -2.65 1.43 0.00 0.10 0.00 0.00 34.13 32.81 1d3z s GLU 51 CO 0.21 0.31 2.01 -0.44 0.02 0.00 0.00 175.26 177.37 1d3z h ASP 52 N 2.61 0.00 -0.35 -0.19 5.19 -1.97 -2.94 116.42 118.77 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 0.68 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.42 1d3z n GLY 53 N -0.03 1.21 3.71 2.75 0.00 -1.26 -3.22 105.19 108.34 1d3z n GLY 53 Ca 0.00 -0.60 -0.23 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.54 2.33 0.36 1.61 1.81 -1.11 -4.99 118.95 117.42 1d3z s ARG 54 Ca 0.36 -1.54 0.07 0.00 -1.72 0.00 0.00 55.73 52.90 1d3z s ARG 54 Cb 0.20 -2.15 -0.02 0.00 -0.45 0.00 0.00 34.95 32.53 1d3z s ARG 54 CO 0.28 0.17 0.34 0.95 -0.68 0.00 0.00 175.30 176.36 1d3z s THR 55 N -2.41 3.35 0.22 0.02 -4.23 -1.26 -1.50 115.64 109.83 1d3z s THR 55 Ca 0.36 -1.32 -0.09 0.00 -1.18 0.00 0.00 61.69 59.46 1d3z s THR 55 Cb -0.03 -3.15 0.18 0.00 1.34 0.00 0.00 72.50 70.84 1d3z s THR 55 CO 0.22 -0.12 1.89 -0.07 -0.54 0.00 0.00 174.62 175.99 1d3z h LEU 56 N 1.14 0.92 -1.75 4.79 3.38 -1.45 -2.20 115.31 120.14 1d3z h LEU 56 Ca -0.44 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 1d3z h LEU 56 Cb 1.26 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1d3z h LEU 56 CO 0.57 0.67 -0.01 -1.28 0.09 0.00 0.00 178.44 178.48 1d3z h SER 57 N 1.09 0.12 0.11 -0.43 0.87 -1.65 -1.32 113.55 112.35 1d3z h SER 57 Ca 0.30 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.83 1d3z h SER 57 Cb -0.12 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 61.80 1d3z h SER 57 CO -0.06 0.16 -0.09 0.44 -0.53 0.00 0.00 176.83 176.75 1d3z h ASP 58 N 0.14 0.00 -0.64 6.23 3.32 -1.68 -1.16 116.42 122.63 1d3z h ASP 58 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1d3z h ASP 58 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1d3z h ASP 58 CO 0.00 0.09 0.00 -1.22 -1.72 0.00 0.00 179.24 176.39 1d3z n TYR 59 N -4.28 1.44 -3.98 4.55 4.01 -0.51 -4.94 117.16 113.44 1d3z n TYR 59 Ca -0.03 -0.58 -0.32 0.00 -0.16 0.00 0.00 57.90 56.81 1d3z n TYR 59 Cb 0.17 -0.23 -0.00 0.00 -0.31 0.00 0.00 39.34 38.97 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 1.13 -4.09 -4.68 7.72 5.03 -0.44 -4.91 115.26 115.02 1d3z n ASN 60 Ca 0.25 -0.83 -0.42 0.00 0.87 0.00 0.00 54.58 54.45 1d3z n ASN 60 Cb 0.86 -3.30 -0.03 0.00 -1.02 0.00 0.00 39.78 36.29 1d3z n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1d3z s ILE 61 N -3.24 4.80 0.40 2.41 1.01 -1.11 -5.04 121.20 120.43 1d3z s ILE 61 Ca 0.67 1.91 0.08 0.00 0.00 0.00 0.00 60.65 63.31 1d3z s ILE 61 Cb -0.35 -4.26 -0.02 0.00 0.01 0.00 0.00 42.46 37.84 1d3z s ILE 61 CO 0.83 -0.02 0.35 -1.10 0.00 0.00 0.00 174.94 175.01 1d3z s GLN 62 N 2.25 2.55 0.34 2.79 -1.52 -1.26 -4.74 119.66 120.07 1d3z s GLN 62 Ca 0.44 -1.50 -0.27 0.00 -1.95 0.00 0.00 55.36 52.08 1d3z s GLN 62 Cb -0.17 -2.38 -0.13 0.00 -0.22 0.00 0.00 33.01 30.11 1d3z s GLN 62 CO 0.14 -0.14 1.02 0.36 -0.25 0.00 0.00 175.29 176.43 1d3z n LYS 63 N -1.50 1.42 -1.67 2.91 2.85 -1.26 -1.45 118.16 119.45 1d3z n LYS 63 Ca 0.02 0.50 -0.14 0.00 -1.05 0.00 0.00 58.31 57.65 1d3z n LYS 63 Cb 0.61 -1.95 -0.04 0.00 -0.65 0.00 0.00 35.03 33.00 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 0.52 -0.99 -2.66 -1.58 1.02 0.05 -5.00 120.64 111.99 1d3z n GLU 64 Ca 0.09 0.88 -0.34 0.00 -0.02 0.00 0.00 57.16 57.77 1d3z n GLU 64 Cb 0.35 -5.01 -0.05 0.00 -0.02 0.00 0.00 31.44 26.71 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 6.66 -0.17 1.62 0.01 -0.53 -4.81 113.70 113.78 1d3z s SER 65 Ca 0.00 1.84 -0.03 0.00 1.31 0.00 0.00 55.95 59.07 1d3z s SER 65 Cb 0.00 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.65 1d3z s SER 65 CO 0.00 -0.55 -0.05 -0.89 0.41 0.00 0.00 173.24 172.16 1d3z s THR 66 N -2.01 3.62 0.20 1.44 2.01 -1.26 -1.05 115.64 118.60 1d3z s THR 66 Ca 0.64 -0.44 0.06 0.00 0.31 0.00 0.00 61.69 62.25 1d3z s THR 66 Cb -0.14 -2.60 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1d3z s THR 66 CO 0.18 0.47 0.19 -0.76 -0.69 0.00 0.00 174.62 174.01 1d3z s LEU 67 N 0.73 3.88 -0.10 4.42 1.02 0.38 -4.80 118.68 124.21 1d3z s LEU 67 Ca -0.02 -0.14 0.02 0.00 0.02 0.00 0.00 54.13 54.00 1d3z s LEU 67 Cb -0.15 -2.45 -0.01 0.00 0.02 0.00 0.00 46.19 43.60 1d3z s LEU 67 CO 0.02 0.01 -0.17 -1.00 0.02 0.00 0.00 176.35 175.24 1d3z s HIS 68 N -1.92 2.70 -0.14 0.29 3.76 -0.48 -0.93 115.29 118.57 1d3z s HIS 68 Ca 0.32 -0.65 -0.04 0.00 -0.15 0.00 0.00 55.06 54.54 1d3z s HIS 68 Cb -0.09 -1.75 -0.03 0.00 1.11 0.00 0.00 32.58 31.81 1d3z s HIS 68 CO 0.25 -0.19 0.00 -1.17 -0.85 0.00 0.00 174.74 172.78 1d3z s LEU 69 N 0.11 3.52 -0.04 0.89 2.96 -0.35 -1.09 118.68 124.68 1d3z s LEU 69 Ca -0.08 0.02 0.06 0.00 -0.22 0.00 0.00 54.13 53.91 1d3z s LEU 69 Cb -0.15 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.68 1d3z s LEU 69 CO 0.05 0.24 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.41 1d3z s VAL 70 N -0.04 1.80 -0.19 1.68 1.01 0.47 -4.10 120.40 121.03 1d3z s VAL 70 Ca 0.03 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 1d3z s VAL 70 Cb -0.13 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1d3z s VAL 70 CO 0.02 0.51 0.09 -0.76 0.00 0.00 0.00 175.10 174.96 1d3z s LEU 71 N -0.23 3.98 -0.23 3.92 1.02 -1.26 -0.65 118.68 125.22 1d3z s LEU 71 Ca 0.00 0.14 -0.05 0.00 0.02 0.00 0.00 54.13 54.24 1d3z s LEU 71 Cb -0.11 -2.02 -0.02 0.00 0.02 0.00 0.00 46.19 44.06 1d3z s LEU 71 CO 0.02 0.17 0.00 -0.60 0.02 0.00 0.00 176.35 175.97 1d3z s ARG 72 N 0.38 3.49 -0.25 1.70 3.52 -0.31 -5.01 118.95 122.47 1d3z s ARG 72 Ca 0.05 -0.56 -0.08 0.00 -0.13 0.00 0.00 55.73 55.01 1d3z s ARG 72 Cb -0.12 -3.14 -0.03 0.00 -1.56 0.00 0.00 34.95 30.10 1d3z s ARG 72 CO -0.01 -0.19 0.09 -0.51 -0.81 0.00 0.00 175.30 173.87 1d3z s LEU 73 N 1.54 3.56 0.19 -0.88 1.43 -1.26 -4.71 118.68 118.54 1d3z s LEU 73 Ca 0.06 -0.15 -0.10 0.00 -1.03 0.00 0.00 54.13 52.91 1d3z s LEU 73 Cb -0.15 -1.96 0.10 0.00 0.03 0.00 0.00 46.19 44.22 1d3z s LEU 73 CO -0.00 -0.02 1.71 -0.09 0.23 0.00 0.00 176.35 178.18 1d3z h ARG 74 N 8.11 1.06 0.00 1.70 9.65 -1.99 -3.44 114.38 129.46 1d3z h ARG 74 Ca -0.38 -0.24 -0.47 0.00 -1.10 0.00 0.00 59.98 57.79 1d3z h ARG 74 Cb 1.18 -0.14 0.10 0.00 -1.39 0.00 0.00 29.97 29.71 1d3z h ARG 74 CO 0.58 0.93 0.17 0.41 2.80 0.00 0.00 179.97 184.87 1d3z n GLY 75 N -0.69 0.27 3.15 2.80 0.00 -1.26 -5.33 105.19 104.13 1d3z n GLY 75 Ca 0.05 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1d3z n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93