#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hdn s PHE 2 N 0.00 2.38 0.12 1.12 5.36 0.02 -4.99 117.98 122.00 1hdn s PHE 2 Ca 0.00 -0.77 0.06 0.00 -0.96 0.00 0.00 56.93 55.26 1hdn s PHE 2 Cb 0.00 -1.57 -0.04 0.00 -0.34 0.00 0.00 43.02 41.07 1hdn s PHE 2 CO 0.00 -0.26 -0.15 -0.65 -1.46 0.00 0.00 175.22 172.70 1hdn s GLN 3 N -0.02 1.03 -0.07 10.12 -0.21 -1.26 -1.10 119.66 128.15 1hdn s GLN 3 Ca -0.07 -1.21 -0.03 0.00 0.02 0.00 0.00 55.36 54.07 1hdn s GLN 3 Cb -0.15 -0.99 0.04 0.00 1.00 0.00 0.00 33.01 32.92 1hdn s GLN 3 CO 0.05 0.20 0.13 -1.14 -2.12 0.00 0.00 175.29 172.41 1hdn s GLN 4 N -2.48 0.01 -0.74 2.91 2.00 -0.71 -5.00 119.66 115.66 1hdn s GLN 4 Ca 0.08 0.48 -0.22 0.00 -2.00 0.00 0.00 55.36 53.70 1hdn s GLN 4 Cb -0.06 -0.31 0.08 0.00 0.80 0.00 0.00 33.01 33.52 1hdn s GLN 4 CO 0.03 -0.28 1.03 -1.21 -0.50 0.00 0.00 175.29 174.36 1hdn s GLU 5 N 2.04 3.24 0.18 1.67 2.02 -1.26 -1.02 118.70 125.57 1hdn s GLU 5 Ca 0.01 -1.03 0.06 0.00 0.02 0.00 0.00 54.97 54.03 1hdn s GLU 5 Cb -0.12 -4.43 -0.04 0.00 0.10 0.00 0.00 34.13 29.64 1hdn s GLU 5 CO -0.05 -1.84 0.09 0.08 0.02 0.00 0.00 175.26 173.56 1hdn s VAL 6 N 3.87 4.21 0.20 2.63 1.01 -0.08 -4.94 120.40 127.29 1hdn s VAL 6 Ca 0.26 -1.25 0.11 0.00 0.00 0.00 0.00 61.98 61.11 1hdn s VAL 6 Cb -0.13 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 1hdn s VAL 6 CO 0.05 -0.14 -0.24 0.42 0.00 0.00 0.00 175.10 175.19 1hdn s THR 7 N -1.80 2.35 -0.32 3.92 -4.23 -1.26 -0.08 115.64 114.23 1hdn s THR 7 Ca 0.30 -2.07 -0.10 0.00 -1.18 0.00 0.00 61.69 58.64 1hdn s THR 7 Cb -0.09 -2.14 -0.01 0.00 1.34 0.00 0.00 72.50 71.60 1hdn s THR 7 CO 0.22 -0.15 0.17 -0.63 -0.54 0.00 0.00 174.62 173.70 1hdn s ILE 8 N -1.75 4.73 -2.87 2.99 1.01 -0.48 -4.94 121.20 119.88 1hdn s ILE 8 Ca 0.21 -0.42 0.24 0.00 0.00 0.00 0.00 60.65 60.69 1hdn s ILE 8 Cb -0.08 -3.43 0.20 0.00 0.01 0.00 0.00 42.46 39.16 1hdn s ILE 8 CO 0.10 0.03 1.28 0.35 0.00 0.00 0.00 174.94 176.70 1hdn n THR 9 N 5.01 0.00 -3.59 2.92 -2.24 -1.26 -0.26 114.28 114.86 1hdn n THR 9 Ca -0.13 -0.46 -0.38 0.00 -2.27 0.00 0.00 64.05 60.81 1hdn n THR 9 Cb 0.49 1.40 -0.06 0.00 -2.10 0.00 0.00 70.33 70.06 1hdn n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hdn s ALA 10 N -2.05 3.74 0.01 6.98 0.00 -1.26 -4.91 121.76 124.27 1hdn s ALA 10 Ca 0.28 -0.32 -0.04 0.00 0.00 0.00 0.00 51.96 51.88 1hdn s ALA 10 Cb 0.20 -2.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 1hdn s ALA 10 CO 0.33 0.51 1.07 -1.00 0.00 0.00 0.00 175.76 176.66 1hdn h PRO 11 N 4.80 -0.12 -0.48 0.00 0.13 -1.96 -2.78 132.00 131.58 1hdn h PRO 11 Ca -0.52 0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.58 1hdn h PRO 11 Cb 1.22 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 1hdn h PRO 11 CO 0.61 -0.08 0.16 -2.95 -0.23 0.00 0.00 178.00 175.51 1hdn h ASN 12 N -0.13 0.65 0.00 1.44 -1.07 -1.96 -2.86 115.58 111.65 1hdn h ASN 12 Ca -0.01 -0.09 0.00 0.00 0.07 0.00 0.00 56.30 56.27 1hdn h ASN 12 Cb 0.11 -0.17 0.00 0.00 -2.07 0.00 0.00 38.32 36.19 1hdn h ASN 12 CO -0.00 0.61 0.00 0.61 0.07 0.00 0.00 177.43 178.72 1hdn n GLY 13 N -1.04 1.13 2.54 9.14 0.00 -1.06 -3.84 105.19 112.06 1hdn n GLY 13 Ca 0.04 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 1hdn n GLY 13 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1hdn n LEU 14 N 0.00 7.58 -4.65 0.99 7.94 0.05 -4.62 117.00 124.29 1hdn n LEU 14 Ca 0.00 -4.83 -0.29 0.00 -1.11 0.00 0.00 56.01 49.78 1hdn n LEU 14 Cb 0.00 -1.28 0.18 0.00 0.53 0.00 0.00 43.42 42.85 1hdn n LEU 14 CO 0.00 1.98 0.63 -1.38 -1.11 0.00 0.00 177.39 177.51 1hdn s HIS 15 N -2.08 2.01 0.00 1.96 -3.43 -1.25 -3.77 115.29 108.72 1hdn s HIS 15 Ca 0.52 1.15 0.00 0.00 -0.80 0.00 0.00 55.06 55.93 1hdn s HIS 15 Cb 0.24 -3.20 0.00 0.00 -1.43 0.00 0.00 32.58 28.19 1hdn s HIS 15 CO -0.15 -2.91 0.00 0.25 -2.00 0.00 0.00 174.74 169.93 1hdn n THR 16 N -4.23 0.00 0.07 -5.38 -2.24 -1.26 -0.26 114.28 100.98 1hdn n THR 16 Ca 0.06 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.62 1hdn n THR 16 Cb 0.56 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.64 1hdn n THR 16 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1hdn h ARG 17 N 0.00 0.36 -0.90 -0.78 0.11 -1.97 -1.64 114.38 109.56 1hdn h ARG 17 Ca 0.00 -0.61 0.11 0.00 0.10 0.00 0.00 59.98 59.57 1hdn h ARG 17 Cb 0.00 0.23 -0.08 0.00 1.11 0.00 0.00 29.97 31.23 1hdn h ARG 17 CO 0.00 1.26 0.53 -1.35 0.10 0.00 0.00 179.97 180.52 1hdn h PRO 18 N 0.10 0.85 -0.38 0.08 0.11 -1.71 -0.96 132.00 130.09 1hdn h PRO 18 Ca -0.32 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.78 1hdn h PRO 18 Cb 2.08 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.96 1hdn h PRO 18 CO 0.17 0.56 0.15 0.00 -0.21 0.00 0.00 178.00 178.68 1hdn h ALA 19 N 1.49 0.45 -0.65 -0.75 0.00 -0.65 0.12 119.26 119.27 1hdn h ALA 19 Ca 0.44 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.45 1hdn h ALA 19 Cb 0.41 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1hdn h ALA 19 CO -0.26 -0.23 0.34 0.00 0.00 0.00 0.00 179.25 179.10 1hdn h ALA 20 N 1.23 0.87 -0.64 0.00 0.00 -0.76 0.52 119.26 120.47 1hdn h ALA 20 Ca 0.17 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1hdn h ALA 20 Cb 0.12 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1hdn h ALA 20 CO -0.15 -0.00 0.25 1.96 0.00 0.00 0.00 179.25 181.30 1hdn h GLN 21 N 0.63 0.95 -0.56 0.00 4.20 -0.74 -0.60 115.11 118.99 1hdn h GLN 21 Ca 0.30 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.81 1hdn h GLN 21 Cb 0.22 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 1hdn h GLN 21 CO -0.20 0.81 0.25 0.35 -0.67 0.00 0.00 178.83 179.37 1hdn h PHE 22 N 0.89 0.81 -0.20 2.96 3.57 -0.30 -2.45 116.94 122.23 1hdn h PHE 22 Ca 0.21 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1hdn h PHE 22 Cb 0.22 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1hdn h PHE 22 CO 0.01 0.64 0.12 0.28 -2.23 0.00 0.00 178.31 177.13 1hdn h VAL 23 N 0.75 1.03 -0.72 1.41 2.07 -0.76 -0.85 116.25 119.19 1hdn h VAL 23 Ca 0.19 -0.09 0.11 0.00 0.82 0.00 0.00 66.70 67.74 1hdn h VAL 23 Cb 0.14 0.76 -0.12 0.00 -1.52 0.00 0.00 31.29 30.55 1hdn h VAL 23 CO -0.02 0.05 -0.39 0.50 0.02 0.00 0.00 177.57 177.73 1hdn h LYS 24 N 0.25 -0.12 -0.20 1.57 3.64 -0.93 0.75 116.57 121.53 1hdn h LYS 24 Ca 0.08 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1hdn h LYS 24 Cb -0.01 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1hdn h LYS 24 CO -0.03 -0.08 0.01 1.49 -2.27 0.00 0.00 179.45 178.56 1hdn h GLU 25 N -0.13 0.34 -0.78 1.90 4.57 -1.13 -2.94 114.58 116.41 1hdn h GLU 25 Ca 0.25 -0.11 0.08 0.00 -1.18 0.00 0.00 59.36 58.40 1hdn h GLU 25 Cb 0.56 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.07 1hdn h GLU 25 CO -0.78 0.54 0.51 0.00 -1.18 0.00 0.00 179.01 178.10 1hdn h ALA 26 N 0.79 1.71 0.00 2.92 0.00 -0.83 0.08 119.26 123.93 1hdn h ALA 26 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1hdn h ALA 26 Cb 0.38 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1hdn h ALA 26 CO 0.01 0.15 -0.06 0.87 0.00 0.00 0.00 179.25 180.22 1hdn h LYS 27 N 0.78 0.00 -0.84 0.00 1.79 -0.68 -2.79 116.57 114.83 1hdn h LYS 27 Ca 0.35 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.82 1hdn h LYS 27 Cb 0.35 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.00 1hdn h LYS 27 CO -0.13 0.06 0.00 0.41 -1.08 0.00 0.00 179.45 178.71 1hdn n GLY 28 N -1.36 1.76 3.12 3.86 0.00 0.01 -4.78 105.19 107.80 1hdn n GLY 28 Ca -0.03 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 1hdn n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hdn s PHE 29 N -1.49 1.21 0.15 1.61 0.08 -1.05 -5.07 117.98 113.42 1hdn s PHE 29 Ca 0.15 -0.30 -0.12 0.00 0.12 0.00 0.00 56.93 56.78 1hdn s PHE 29 Cb 0.11 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.82 1hdn s PHE 29 CO 0.05 0.01 1.56 1.79 -0.10 0.00 0.00 175.22 178.53 1hdn h THR 30 N 4.63 1.27 -3.04 0.64 1.35 -1.86 -3.45 112.91 112.45 1hdn h THR 30 Ca -0.36 -1.21 -0.58 0.00 -0.55 0.00 0.00 66.41 63.70 1hdn h THR 30 Cb 1.17 1.09 0.14 0.00 -1.73 0.00 0.00 68.15 68.82 1hdn h THR 30 CO 0.46 0.42 0.10 -1.20 -0.25 0.00 0.00 175.52 175.04 1hdn n SER 31 N -4.26 0.97 -4.48 5.36 7.64 -1.26 -4.90 113.62 112.69 1hdn n SER 31 Ca 0.00 0.99 -0.43 0.00 1.01 0.00 0.00 58.87 60.45 1hdn n SER 31 Cb 0.38 -1.33 -0.03 0.00 -1.01 0.00 0.00 64.21 62.22 1hdn n SER 31 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1hdn s GLU 32 N -2.05 3.48 -0.51 1.43 2.56 -0.33 -4.85 118.70 118.43 1hdn s GLU 32 Ca 0.65 -1.38 -0.28 0.00 0.00 0.00 0.00 54.97 53.95 1hdn s GLU 32 Cb -0.54 -4.85 0.02 0.00 2.00 0.00 0.00 34.13 30.76 1hdn s GLU 32 CO 0.56 -1.89 1.34 0.42 -0.56 0.00 0.00 175.26 175.13 1hdn s ILE 33 N 3.57 3.91 -0.10 -3.70 1.09 -1.26 -3.14 121.20 121.56 1hdn s ILE 33 Ca 0.34 0.86 -0.03 0.00 -1.10 0.00 0.00 60.65 60.71 1hdn s ILE 33 Cb -0.06 -4.43 -0.03 0.00 -1.06 0.00 0.00 42.46 36.87 1hdn s ILE 33 CO -0.05 -1.05 0.00 -0.89 -0.10 0.00 0.00 174.94 172.85 1hdn s THR 34 N 5.50 4.31 -0.28 2.92 2.01 0.23 -0.38 115.64 129.95 1hdn s THR 34 Ca 0.53 -0.24 -0.06 0.00 0.31 0.00 0.00 61.69 62.23 1hdn s THR 34 Cb -0.11 -2.83 0.01 0.00 0.01 0.00 0.00 72.50 69.58 1hdn s THR 34 CO 0.28 0.58 0.05 -0.69 -0.69 0.00 0.00 174.62 174.15 1hdn s VAL 35 N -0.60 3.77 -0.48 3.82 1.01 0.30 -0.93 120.40 127.29 1hdn s VAL 35 Ca 0.10 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 1hdn s VAL 35 Cb -0.12 -2.93 0.13 0.00 0.00 0.00 0.00 36.38 33.46 1hdn s VAL 35 CO 0.02 0.11 0.29 -0.89 0.00 0.00 0.00 175.10 174.64 1hdn s THR 36 N 1.47 3.59 -0.79 3.92 2.01 -0.16 -0.87 115.64 124.81 1hdn s THR 36 Ca 0.02 -2.22 -0.18 0.00 0.31 0.00 0.00 61.69 59.62 1hdn s THR 36 Cb -0.17 -3.41 0.13 0.00 0.01 0.00 0.00 72.50 69.06 1hdn s THR 36 CO 0.01 -0.76 0.92 -0.44 -0.69 0.00 0.00 174.62 173.67 1hdn s SER 37 N 1.74 6.48 -0.55 3.53 0.01 -0.24 -1.43 113.70 123.24 1hdn s SER 37 Ca 0.10 -1.90 -0.21 0.00 1.31 0.00 0.00 55.95 55.25 1hdn s SER 37 Cb -0.23 -2.34 0.03 0.00 0.21 0.00 0.00 66.02 63.70 1hdn s SER 37 CO -0.03 -1.02 0.64 0.59 0.41 0.00 0.00 173.24 173.83 1hdn n ASN 38 N 6.09 -6.39 0.00 2.44 4.13 0.09 -3.23 115.26 118.38 1hdn n ASN 38 Ca 0.10 -0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.27 1hdn n ASN 38 Cb 0.46 -3.21 0.00 0.00 -1.54 0.00 0.00 39.78 35.50 1hdn n ASN 38 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hdn n GLY 39 N -0.68 1.13 3.70 7.41 0.00 -1.26 -4.93 105.19 110.55 1hdn n GLY 39 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1hdn n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hdn s LYS 40 N 0.00 4.41 -0.06 1.61 1.02 -1.20 -5.00 119.74 120.52 1hdn s LYS 40 Ca 0.00 1.63 0.00 0.00 0.02 0.00 0.00 55.97 57.62 1hdn s LYS 40 Cb 0.00 -3.49 -0.03 0.00 -0.52 0.00 0.00 37.83 33.78 1hdn s LYS 40 CO 0.00 -0.34 -0.03 -1.54 -0.92 0.00 0.00 175.35 172.52 1hdn s SER 41 N 1.28 4.94 -0.08 2.83 1.04 -1.26 -1.08 113.70 121.36 1hdn s SER 41 Ca 0.55 0.03 -0.06 0.00 0.48 0.00 0.00 55.95 56.95 1hdn s SER 41 Cb -0.24 -1.30 0.03 0.00 0.10 0.00 0.00 66.02 64.61 1hdn s SER 41 CO 0.24 0.35 0.20 0.00 0.98 0.00 0.00 173.24 175.01 1hdn s ALA 42 N -0.90 -0.48 0.09 5.32 0.00 -0.05 -5.01 121.76 120.73 1hdn s ALA 42 Ca 0.14 0.69 -0.31 0.00 0.00 0.00 0.00 51.96 52.49 1hdn s ALA 42 Cb -0.11 -0.43 -0.08 0.00 0.00 0.00 0.00 23.12 22.50 1hdn s ALA 42 CO 0.04 -0.13 1.49 0.45 0.00 0.00 0.00 175.76 177.60 1hdn s SER 43 N 0.56 6.73 0.00 0.00 0.15 -1.26 -0.54 113.70 119.34 1hdn s SER 43 Ca -0.04 2.37 0.12 0.00 0.70 0.00 0.00 55.95 59.11 1hdn s SER 43 Cb -0.05 -2.58 0.54 0.00 -1.71 0.00 0.00 66.02 62.22 1hdn s SER 43 CO -0.03 -0.75 1.38 0.00 1.20 0.00 0.00 173.24 175.04 1hdn n ALA 44 N 4.63 1.58 -0.94 5.45 0.00 0.49 -2.46 120.51 129.26 1hdn n ALA 44 Ca 0.13 -0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.30 1hdn n ALA 44 Cb 0.41 -1.20 0.09 0.00 0.00 0.00 0.00 19.45 18.76 1hdn n ALA 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hdn n LYS 45 N -1.47 2.14 -3.55 0.00 5.02 -1.24 -4.12 118.16 114.93 1hdn n LYS 45 Ca 0.03 -2.41 -0.06 0.00 -2.02 0.00 0.00 58.31 53.85 1hdn n LYS 45 Cb 0.14 -1.95 -0.07 0.00 -0.02 0.00 0.00 35.03 33.13 1hdn n LYS 45 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1hdn s SER 46 N -0.85 -0.45 0.08 4.39 0.15 -1.03 -5.00 113.70 111.00 1hdn s SER 46 Ca 0.47 0.96 -0.30 0.00 0.70 0.00 0.00 55.95 57.78 1hdn s SER 46 Cb 0.38 1.58 -0.13 0.00 -1.71 0.00 0.00 66.02 66.13 1hdn s SER 46 CO 0.03 -0.24 1.47 -0.07 1.20 0.00 0.00 173.24 175.63 1hdn h LEU 47 N 8.12 -1.30 -0.63 3.45 3.38 -1.85 -1.90 115.31 124.58 1hdn h LEU 47 Ca -0.18 0.13 0.11 0.00 0.09 0.00 0.00 57.88 58.03 1hdn h LEU 47 Cb 1.12 0.46 -0.08 0.00 0.09 0.00 0.00 40.66 42.25 1hdn h LEU 47 CO 0.16 -0.51 0.19 0.15 0.09 0.00 0.00 178.44 178.52 1hdn h PHE 48 N -0.72 0.33 -0.37 1.13 3.57 -1.97 -0.37 116.94 118.53 1hdn h PHE 48 Ca -0.02 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 1hdn h PHE 48 Cb 0.68 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 1hdn h PHE 48 CO -0.36 0.03 -0.01 0.87 -2.23 0.00 0.00 178.31 176.61 1hdn h LYS 49 N 0.34 0.67 0.00 1.11 1.57 -1.83 -0.86 116.57 117.57 1hdn h LYS 49 Ca 0.33 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.84 1hdn h LYS 49 Cb 0.47 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1hdn h LYS 49 CO -0.37 0.78 -0.25 1.25 -0.57 0.00 0.00 179.45 180.29 1hdn h LEU 50 N 0.48 0.00 -0.15 2.94 5.85 -0.78 -0.88 115.31 122.78 1hdn h LEU 50 Ca 0.10 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.68 1hdn h LEU 50 Cb 0.49 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1hdn h LEU 50 CO 0.02 0.25 -0.67 1.56 -0.34 0.00 0.00 178.44 179.25 1hdn h GLN 51 N 0.00 0.00 0.06 1.25 4.20 -0.88 -3.36 115.11 116.38 1hdn h GLN 51 Ca -0.00 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.42 1hdn h GLN 51 Cb 0.81 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.57 1hdn h GLN 51 CO 0.03 0.67 -1.55 1.79 -0.67 0.00 0.00 178.83 179.10 1hdn h THR 52 N 0.00 1.09 -3.00 -0.54 1.35 -0.97 -3.46 112.91 107.38 1hdn h THR 52 Ca -0.01 -2.82 -0.53 0.00 -0.55 0.00 0.00 66.41 62.51 1hdn h THR 52 Cb 1.45 2.63 0.05 0.00 -1.73 0.00 0.00 68.15 70.55 1hdn h THR 52 CO 0.09 0.74 0.84 -0.22 -0.25 0.00 0.00 175.52 176.71 1hdn s LEU 53 N -6.64 4.37 -0.87 3.87 2.96 -0.35 -4.94 118.68 117.09 1hdn s LEU 53 Ca -0.07 2.62 -0.25 0.00 -0.22 0.00 0.00 54.13 56.21 1hdn s LEU 53 Cb 0.08 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 43.10 1hdn s LEU 53 CO 0.83 -0.78 2.04 -0.83 -1.32 0.00 0.00 176.35 176.29 1hdn s GLY 54 N 0.91 -0.02 -0.94 7.98 0.00 -1.26 -4.89 107.32 109.10 1hdn s GLY 54 Ca 0.66 -1.33 -0.02 0.00 0.00 0.00 0.00 44.72 44.03 1hdn s GLY 54 CO 0.35 3.64 0.98 1.04 0.00 0.00 0.00 173.10 179.10 1hdn n LEU 55 N 14.87 4.82 -4.28 0.66 4.77 -1.26 -4.88 117.00 131.70 1hdn n LEU 55 Ca 0.41 -5.18 -0.16 0.00 -0.03 0.00 0.00 56.01 51.05 1hdn n LEU 55 Cb 0.46 -1.14 -0.09 0.00 -2.33 0.00 0.00 43.42 40.32 1hdn n LEU 55 CO 0.59 1.62 -0.21 0.28 -1.33 0.00 0.00 177.39 178.34 1hdn s THR 56 N -1.80 0.19 -0.18 -5.08 -1.32 -1.26 -0.77 115.64 105.43 1hdn s THR 56 Ca 0.31 -2.00 -0.34 0.00 -1.21 0.00 0.00 61.69 58.44 1hdn s THR 56 Cb -0.02 -2.52 -0.16 0.00 -1.51 0.00 0.00 72.50 68.28 1hdn s THR 56 CO -0.06 0.00 1.04 1.67 -2.21 0.00 0.00 174.62 175.06 1hdn n GLN 57 N -0.46 0.00 0.00 7.08 -0.06 -1.08 -3.64 117.38 119.22 1hdn n GLN 57 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 1hdn n GLN 57 Cb 0.65 -1.19 0.00 0.00 -4.06 0.00 0.00 30.24 25.64 1hdn n GLN 57 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1hdn n GLY 58 N 2.07 0.62 0.34 1.69 0.00 0.65 -5.00 105.19 105.56 1hdn n GLY 58 Ca 0.20 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1hdn n GLY 58 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1hdn n THR 59 N 0.00 0.00 -3.06 2.61 -1.04 -1.24 -1.38 114.28 110.17 1hdn n THR 59 Ca 0.00 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.57 1hdn n THR 59 Cb 0.00 -0.07 -0.05 0.00 -1.82 0.00 0.00 70.33 68.39 1hdn n THR 59 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1hdn s VAL 60 N -0.08 4.72 -0.36 12.58 1.01 -1.26 -2.62 120.40 134.39 1hdn s VAL 60 Ca 0.00 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 1hdn s VAL 60 Cb 0.00 -4.46 0.06 0.00 0.00 0.00 0.00 36.38 31.98 1hdn s VAL 60 CO 0.00 -1.07 0.14 0.54 0.00 0.00 0.00 175.10 174.70 1hdn s VAL 61 N 3.00 3.60 -0.35 2.92 0.11 0.89 -0.73 120.40 129.83 1hdn s VAL 61 Ca 0.16 -1.44 -0.26 0.00 -2.93 0.00 0.00 61.98 57.51 1hdn s VAL 61 Cb -0.20 -3.17 0.01 0.00 -1.53 0.00 0.00 36.38 31.49 1hdn s VAL 61 CO 0.10 -0.34 0.94 -0.89 -3.33 0.00 0.00 175.10 171.58 1hdn s THR 62 N 1.32 4.60 -0.56 5.04 2.01 -0.52 -0.90 115.64 126.63 1hdn s THR 62 Ca 0.01 1.32 -0.20 0.00 0.31 0.00 0.00 61.69 63.13 1hdn s THR 62 Cb -0.21 -4.33 0.07 0.00 0.01 0.00 0.00 72.50 68.05 1hdn s THR 62 CO 0.00 -0.48 0.71 -0.63 -0.69 0.00 0.00 174.62 173.53 1hdn s ILE 63 N 3.44 4.77 -0.22 1.82 1.01 -0.19 -0.99 121.20 130.85 1hdn s ILE 63 Ca 0.39 -0.62 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 1hdn s ILE 63 Cb -0.12 -4.42 0.02 0.00 0.01 0.00 0.00 42.46 37.94 1hdn s ILE 63 CO 0.17 -1.01 -0.11 -0.55 0.00 0.00 0.00 174.94 173.44 1hdn s SER 64 N 3.14 3.87 -0.13 3.58 0.15 -0.11 -1.73 113.70 122.47 1hdn s SER 64 Ca 0.15 -0.72 0.03 0.00 0.70 0.00 0.00 55.95 56.11 1hdn s SER 64 Cb -0.20 -1.60 0.01 0.00 -1.71 0.00 0.00 66.02 62.51 1hdn s SER 64 CO 0.10 -0.06 -0.22 0.00 1.20 0.00 0.00 173.24 174.26 1hdn s ALA 65 N 1.33 2.21 -0.11 5.45 0.00 -0.26 -0.60 121.76 129.79 1hdn s ALA 65 Ca 0.03 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 50.94 1hdn s ALA 65 Cb -0.15 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.05 1hdn s ALA 65 CO -0.07 0.05 -0.11 -1.83 0.00 0.00 0.00 175.76 173.80 1hdn s GLU 66 N 0.70 1.79 0.00 0.00 -1.05 -1.19 -0.80 118.70 118.15 1hdn s GLU 66 Ca -0.10 -0.38 0.00 0.00 -0.15 0.00 0.00 54.97 54.34 1hdn s GLU 66 Cb -0.16 -1.68 0.00 0.00 -0.44 0.00 0.00 34.13 31.85 1hdn s GLU 66 CO 0.01 -0.18 0.00 0.41 0.95 0.00 0.00 175.26 176.45 1hdn n GLY 67 N 4.59 -0.44 0.35 -3.83 0.00 -1.26 -1.19 105.19 103.40 1hdn n GLY 67 Ca -0.16 -1.45 0.09 0.00 0.00 0.00 0.00 46.02 44.50 1hdn n GLY 67 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1hdn h GLU 68 N 2.24 0.80 -0.76 1.61 5.08 -1.98 -2.73 114.58 118.84 1hdn h GLU 68 Ca 0.00 -0.05 -0.52 0.00 -1.00 0.00 0.00 59.36 57.79 1hdn h GLU 68 Cb 0.00 -0.18 -0.31 0.00 0.50 0.00 0.00 28.75 28.76 1hdn h GLU 68 CO 0.00 0.53 -0.04 -0.40 -1.00 0.00 0.00 179.01 178.09 1hdn n ASP 69 N -4.73 5.34 -0.15 1.42 5.68 -1.26 -4.88 116.55 117.97 1hdn n ASP 69 Ca 0.20 -3.77 -0.12 0.00 -0.50 0.00 0.00 54.79 50.60 1hdn n ASP 69 Cb 0.45 -0.64 -0.07 0.00 -1.14 0.00 0.00 41.12 39.72 1hdn n ASP 69 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1hdn h GLU 70 N 1.84 -0.33 0.10 0.11 4.11 -1.77 0.27 114.58 118.91 1hdn h GLU 70 Ca 0.43 0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.88 1hdn h GLU 70 Cb 1.36 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.68 1hdn h GLU 70 CO 0.98 -0.22 -0.06 1.96 0.07 0.00 0.00 179.01 181.74 1hdn h GLN 71 N -0.35 -0.16 -0.91 1.06 4.20 -1.89 -2.59 115.11 114.47 1hdn h GLN 71 Ca 0.11 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.90 1hdn h GLN 71 Cb 0.59 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.34 1hdn h GLN 71 CO -0.61 -0.11 0.57 -0.22 -0.67 0.00 0.00 178.83 177.79 1hdn h LYS 72 N -0.16 0.99 0.96 1.46 3.64 -1.77 -0.65 116.57 121.03 1hdn h LYS 72 Ca -0.01 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 1hdn h LYS 72 Cb 0.14 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1hdn h LYS 72 CO 0.01 0.65 -0.46 0.00 -2.27 0.00 0.00 179.45 177.38 1hdn h ALA 73 N 1.44 -1.29 -0.52 5.00 0.00 -0.89 -3.30 119.26 119.70 1hdn h ALA 73 Ca 0.41 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1hdn h ALA 73 Cb 0.22 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1hdn h ALA 73 CO -0.19 -1.20 0.33 0.28 0.00 0.00 0.00 179.25 178.47 1hdn h VAL 74 N -1.33 1.10 -0.05 0.00 2.07 -0.99 -1.30 116.25 115.75 1hdn h VAL 74 Ca -0.13 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.18 1hdn h VAL 74 Cb 0.99 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 1hdn h VAL 74 CO 0.22 0.12 -0.41 -0.08 0.02 0.00 0.00 177.57 177.44 1hdn h GLU 75 N 0.67 -0.45 -0.34 1.57 4.81 -1.28 0.00 114.58 119.56 1hdn h GLU 75 Ca 0.20 0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1hdn h GLU 75 Cb -0.04 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1hdn h GLU 75 CO -0.06 -0.30 -0.12 1.25 -0.73 0.00 0.00 179.01 179.04 1hdn h HIS 76 N -0.47 0.65 -0.03 0.92 2.76 -1.61 -2.98 115.15 114.39 1hdn h HIS 76 Ca 0.02 -0.11 -0.11 0.00 -2.20 0.00 0.00 60.37 57.97 1hdn h HIS 76 Cb 0.53 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.30 1hdn h HIS 76 CO -0.52 0.70 -0.49 -0.07 -1.30 0.00 0.00 177.93 176.25 1hdn h LEU 77 N 0.55 0.07 -0.85 0.26 3.38 -0.75 -2.43 115.31 115.53 1hdn h LEU 77 Ca 0.10 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1hdn h LEU 77 Cb 0.54 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1hdn h LEU 77 CO 0.03 0.55 0.38 0.58 0.09 0.00 0.00 178.44 180.08 1hdn h VAL 78 N 0.05 1.26 -0.01 1.22 2.07 -0.85 -1.45 116.25 118.54 1hdn h VAL 78 Ca -0.00 -0.76 0.02 0.00 0.82 0.00 0.00 66.70 66.78 1hdn h VAL 78 Cb 0.89 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1hdn h VAL 78 CO 0.07 0.32 -0.09 0.11 0.02 0.00 0.00 177.57 177.99 1hdn h LYS 79 N 1.20 -0.15 -0.62 1.57 1.57 -1.47 -0.47 116.57 118.19 1hdn h LYS 79 Ca 0.28 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.16 1hdn h LYS 79 Cb 0.15 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.42 1hdn h LYS 79 CO -0.03 -0.10 0.27 -0.07 -0.57 0.00 0.00 179.45 178.94 1hdn h LEU 80 N -0.16 0.31 -0.16 2.94 4.07 -1.15 0.41 115.31 121.58 1hdn h LEU 80 Ca 0.04 0.07 0.01 0.00 0.08 0.00 0.00 57.88 58.08 1hdn h LEU 80 Cb 0.21 0.02 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 1hdn h LEU 80 CO -0.11 0.19 0.08 -0.03 -1.08 0.00 0.00 178.44 177.49 1hdn h MET 81 N 0.47 0.16 -0.12 1.13 4.05 -1.05 -1.73 114.93 117.85 1hdn h MET 81 Ca 0.31 -0.01 -0.07 0.00 -0.28 0.00 0.00 59.70 59.65 1hdn h MET 81 Cb 0.35 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 1hdn h MET 81 CO -0.28 0.11 -0.25 0.00 0.23 0.00 0.00 176.91 176.72 1hdn h ALA 82 N 1.08 1.36 0.00 0.39 0.00 -0.07 -3.33 119.26 118.69 1hdn h ALA 82 Ca 0.06 -0.29 -0.27 0.00 0.00 0.00 0.00 54.91 54.42 1hdn h ALA 82 Cb 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1hdn h ALA 82 CO -0.04 0.44 -2.13 0.39 0.00 0.00 0.00 179.25 177.91 1hdn n GLU 83 N -4.17 0.67 -2.61 0.00 1.02 0.04 -5.02 120.64 110.57 1hdn n GLU 83 Ca -0.01 0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.74 1hdn n GLU 83 Cb 0.35 -1.58 -0.04 0.00 -0.02 0.00 0.00 31.44 30.15 1hdn n GLU 83 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1hdn s LEU 84 N -5.41 4.52 0.00 -4.62 1.43 -0.66 -5.09 118.68 108.86 1hdn s LEU 84 Ca -0.08 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 1hdn s LEU 84 Cb 0.08 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.70 1hdn s LEU 84 CO 0.84 -0.11 0.00 1.21 0.23 0.00 0.00 176.35 178.52