#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 3.27 -0.15 2.03 5.36 -0.04 -4.99 117.98 123.46 1hdn s PHE 2 Ca 0.00 -1.31 0.01 0.00 -0.96 0.00 0.00 56.93 54.67 1hdn s PHE 2 Cb 0.00 -2.43 0.00 0.00 -0.34 0.00 0.00 43.02 40.25 1hdn s PHE 2 CO 0.00 -0.72 -0.18 -0.65 -1.46 0.00 0.00 175.22 172.21 1hdn s GLN 3 N 1.45 3.14 -0.03 10.12 -0.21 -1.26 -1.25 119.66 131.62 1hdn s GLN 3 Ca 0.00 -0.79 0.00 0.00 0.02 0.00 0.00 55.36 54.59 1hdn s GLN 3 Cb -0.20 -2.55 0.03 0.00 1.00 0.00 0.00 33.01 31.29 1hdn s GLN 3 CO 0.04 0.00 0.01 -1.14 -2.12 0.00 0.00 175.29 172.08 1hdn s GLN 4 N 0.82 0.16 -0.31 2.91 0.74 -0.62 -4.99 119.66 118.36 1hdn s GLN 4 Ca -0.06 0.12 -0.21 0.00 0.05 0.00 0.00 55.36 55.26 1hdn s GLN 4 Cb -0.15 -0.38 -0.00 0.00 1.10 0.00 0.00 33.01 33.57 1hdn s GLN 4 CO -0.01 -0.15 0.67 -1.21 -0.55 0.00 0.00 175.29 174.04 1hdn s GLU 5 N 1.04 3.88 -0.21 1.67 2.02 -1.26 -0.85 118.70 124.99 1hdn s GLU 5 Ca -0.10 0.33 -0.02 0.00 0.02 0.00 0.00 54.97 55.21 1hdn s GLU 5 Cb -0.13 -3.74 0.00 0.00 0.10 0.00 0.00 34.13 30.36 1hdn s GLU 5 CO -0.02 -0.63 -0.10 0.08 0.02 0.00 0.00 175.26 174.61 1hdn s VAL 6 N 2.72 2.86 -0.41 2.63 1.01 0.29 -4.89 120.40 124.61 1hdn s VAL 6 Ca 0.27 -0.68 -0.24 0.00 0.00 0.00 0.00 61.98 61.33 1hdn s VAL 6 Cb -0.15 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 33.97 1hdn s VAL 6 CO 0.13 0.46 0.86 -0.89 0.00 0.00 0.00 175.10 175.65 1hdn s THR 7 N 1.40 4.61 -0.22 3.92 2.01 -1.26 -0.57 115.64 125.53 1hdn s THR 7 Ca 0.05 0.84 -0.06 0.00 0.31 0.00 0.00 61.69 62.84 1hdn s THR 7 Cb -0.14 -4.32 -0.02 0.00 0.01 0.00 0.00 72.50 68.03 1hdn s THR 7 CO -0.07 -0.62 0.02 -0.63 -0.69 0.00 0.00 174.62 172.64 1hdn s ILE 8 N 3.40 4.01 -1.86 1.82 -1.09 0.24 -4.97 121.20 122.75 1hdn s ILE 8 Ca 0.34 -0.28 0.15 0.00 -2.23 0.00 0.00 60.65 58.63 1hdn s ILE 8 Cb -0.12 -2.84 0.11 0.00 -1.58 0.00 0.00 42.46 38.03 1hdn s ILE 8 CO 0.21 0.39 0.97 0.35 -1.23 0.00 0.00 174.94 175.63 1hdn n THR 9 N 4.60 0.00 -1.91 2.92 -2.24 -1.26 -0.07 114.28 116.33 1hdn n THR 9 Ca -0.17 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.70 1hdn n THR 9 Cb 0.51 1.31 -0.03 0.00 -2.10 0.00 0.00 70.33 70.02 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 -1.32 3.43 0.29 6.98 0.00 -1.26 -4.49 121.76 125.39 1hdn s ALA 10 Ca 0.17 0.91 0.03 0.00 0.00 0.00 0.00 51.96 53.07 1hdn s ALA 10 Cb 0.13 -3.83 0.70 0.00 0.00 0.00 0.00 23.12 20.11 1hdn s ALA 10 CO 0.21 -1.72 1.73 -1.35 0.00 0.00 0.00 175.76 174.63 1hdn h PRO 11 N 10.66 0.52 -0.94 0.00 0.11 -1.95 -2.74 132.00 137.68 1hdn h PRO 11 Ca -0.41 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.73 1hdn h PRO 11 Cb 1.19 -0.12 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 1hdn h PRO 11 CO 0.96 0.34 0.60 -2.95 -0.21 0.00 0.00 178.00 176.74 1hdn h ASN 12 N 0.53 0.97 -2.41 -2.05 7.08 -1.95 -3.37 115.58 114.38 1hdn h ASN 12 Ca 0.55 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 53.74 1hdn h ASN 12 Cb 0.95 -0.20 0.02 0.00 -2.08 0.00 0.00 38.32 37.00 1hdn h ASN 12 CO -0.45 0.64 -0.07 0.61 -2.08 0.00 0.00 177.43 176.07 1hdn n GLY 13 N -1.35 0.40 3.30 9.14 0.00 -1.04 -4.64 105.19 111.00 1hdn n GLY 13 Ca 0.13 -0.41 -0.17 0.00 0.00 0.00 0.00 46.02 45.58 1hdn n GLY 13 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hdn n LEU 14 N -1.32 -5.29 0.00 0.99 4.77 -1.26 -4.74 117.00 110.15 1hdn n LEU 14 Ca -0.02 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 1hdn n LEU 14 Cb 0.52 -3.12 0.00 0.00 -2.33 0.00 0.00 43.42 38.48 1hdn n LEU 14 CO 0.06 0.15 0.00 0.00 -1.33 0.00 0.00 177.39 176.27 1hdn n HIS 15 N -3.36 0.00 -0.02 -1.77 1.44 -1.26 -1.82 115.22 108.43 1hdn n HIS 15 Ca -0.08 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.61 1hdn n HIS 15 Cb 0.62 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.72 1hdn n HIS 15 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1hdn n THR 16 N 0.00 0.71 -0.07 0.61 -2.24 -1.26 -4.49 114.28 107.53 1hdn n THR 16 Ca 0.00 0.27 -0.07 0.00 -2.27 0.00 0.00 64.05 61.98 1hdn n THR 16 Cb 0.00 -1.67 -0.01 0.00 -2.10 0.00 0.00 70.33 66.56 1hdn n THR 16 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1hdn h ARG 17 N -0.29 -0.15 -0.39 -0.78 2.43 -2.00 -2.06 114.38 111.14 1hdn h ARG 17 Ca 0.00 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1hdn h ARG 17 Cb 0.29 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1hdn h ARG 17 CO 0.00 -0.10 0.08 -1.35 -1.51 0.00 0.00 179.97 177.08 1hdn h PRO 18 N -0.16 0.65 -0.30 0.20 0.11 -1.87 -1.22 132.00 129.41 1hdn h PRO 18 Ca 0.16 -0.17 0.07 0.00 0.11 0.00 0.00 66.00 66.17 1hdn h PRO 18 Cb 0.40 -0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.36 1hdn h PRO 18 CO -0.39 0.69 -0.19 0.00 -0.21 0.00 0.00 178.00 177.89 1hdn h ALA 19 N 0.93 0.01 -0.39 -0.75 0.00 -1.19 0.30 119.26 118.17 1hdn h ALA 19 Ca 0.12 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1hdn h ALA 19 Cb 0.35 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1hdn h ALA 19 CO 0.01 -0.59 0.24 0.00 0.00 0.00 0.00 179.25 178.90 1hdn h ALA 20 N 1.01 0.50 -0.75 0.00 0.00 -1.24 -2.47 119.26 116.30 1hdn h ALA 20 Ca 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1hdn h ALA 20 Cb 0.40 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1hdn h ALA 20 CO -0.40 -0.02 0.41 1.96 0.00 0.00 0.00 179.25 181.21 1hdn h GLN 21 N 0.51 1.05 0.22 0.00 4.20 -0.71 -0.58 115.11 119.80 1hdn h GLN 21 Ca 0.14 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1hdn h GLN 21 Cb -0.01 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 1hdn h GLN 21 CO -0.03 0.78 -0.17 0.35 -0.67 0.00 0.00 178.83 179.09 1hdn h PHE 22 N 1.04 -0.46 -0.68 2.96 3.04 -0.81 -2.47 116.94 119.56 1hdn h PHE 22 Ca 0.26 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.23 1hdn h PHE 22 Cb 0.04 0.17 -0.04 0.00 2.56 0.00 0.00 35.95 38.68 1hdn h PHE 22 CO -0.00 -0.27 0.43 0.28 -2.02 0.00 0.00 178.31 176.74 1hdn h VAL 23 N -0.41 1.13 -0.31 1.41 2.07 -1.27 0.49 116.25 119.35 1hdn h VAL 23 Ca -0.01 -0.30 0.06 0.00 0.82 0.00 0.00 66.70 67.27 1hdn h VAL 23 Cb 0.36 0.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.23 1hdn h VAL 23 CO -0.01 0.16 -0.40 0.50 0.02 0.00 0.00 177.57 177.84 1hdn h LYS 24 N 0.87 -0.35 -0.30 1.57 3.64 -0.96 -0.35 116.57 120.69 1hdn h LYS 24 Ca 0.26 0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.50 1hdn h LYS 24 Cb -0.03 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1hdn h LYS 24 CO -0.08 -0.23 -0.45 1.49 -2.27 0.00 0.00 179.45 177.91 1hdn h GLU 25 N -0.36 0.84 -0.89 1.90 4.57 -0.95 -2.49 114.58 117.19 1hdn h GLU 25 Ca 0.13 -0.50 0.12 0.00 -1.18 0.00 0.00 59.36 57.93 1hdn h GLU 25 Cb 0.58 0.04 -0.08 0.00 -0.16 0.00 0.00 28.75 29.13 1hdn h GLU 25 CO -0.51 1.13 0.52 0.00 -1.18 0.00 0.00 179.01 178.97 1hdn h ALA 26 N 0.69 1.33 -0.02 2.92 0.00 -0.77 -0.53 119.26 122.89 1hdn h ALA 26 Ca 0.03 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1hdn h ALA 26 Cb 1.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1hdn h ALA 26 CO 0.10 0.07 -0.50 0.87 0.00 0.00 0.00 179.25 179.80 1hdn h LYS 27 N 0.80 0.06 0.00 0.00 1.57 -0.93 -3.06 116.57 115.01 1hdn h LYS 27 Ca 0.46 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 59.14 1hdn h LYS 27 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1hdn h LYS 27 CO -0.30 0.54 -0.30 0.78 -0.57 0.00 0.00 179.45 179.61 1hdn h GLY 28 N 1.46 0.00 -5.51 3.86 0.00 -0.65 -3.43 103.07 98.80 1hdn h GLY 28 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1hdn h GLY 28 CO 0.07 0.00 0.28 -1.36 0.00 0.00 0.00 176.54 175.52 1hdn s PHE 29 N -4.30 3.43 0.14 5.60 0.08 -0.84 -4.97 117.98 117.12 1hdn s PHE 29 Ca -0.03 1.16 -0.13 0.00 0.12 0.00 0.00 56.93 58.05 1hdn s PHE 29 Cb 0.15 -2.93 0.01 0.00 -0.57 0.00 0.00 43.02 39.68 1hdn s PHE 29 CO 0.70 -0.18 1.61 1.79 -0.10 0.00 0.00 175.22 179.04 1hdn h THR 30 N 5.14 1.25 -1.87 0.64 1.35 -1.83 -3.44 112.91 114.15 1hdn h THR 30 Ca -0.31 -0.97 -0.63 0.00 -0.55 0.00 0.00 66.41 63.95 1hdn h THR 30 Cb 1.14 0.98 0.13 0.00 -1.73 0.00 0.00 68.15 68.67 1hdn h THR 30 CO 0.81 0.34 -0.43 -0.24 -0.25 0.00 0.00 175.52 175.75 1hdn n SER 31 N -4.41 -0.92 -4.80 5.36 2.88 -1.26 -4.92 113.62 105.55 1hdn n SER 31 Ca 0.00 1.01 -0.37 0.00 -1.33 0.00 0.00 58.87 58.18 1hdn n SER 31 Cb 0.27 -1.06 -0.06 0.00 -0.75 0.00 0.00 64.21 62.61 1hdn n SER 31 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1hdn s GLU 32 N -1.31 3.96 -0.37 -1.46 2.56 0.17 -4.97 118.70 117.28 1hdn s GLU 32 Ca 0.62 0.22 -0.01 0.00 0.00 0.00 0.00 54.97 55.80 1hdn s GLU 32 Cb -0.72 -3.29 0.10 0.00 2.00 0.00 0.00 34.13 32.21 1hdn s GLU 32 CO 0.59 0.53 0.13 0.42 -0.56 0.00 0.00 175.26 176.37 1hdn s ILE 33 N -0.48 2.96 -0.20 -3.70 -1.09 -1.26 -2.00 121.20 115.44 1hdn s ILE 33 Ca 0.20 -2.03 -0.10 0.00 -2.23 0.00 0.00 60.65 56.49 1hdn s ILE 33 Cb -0.15 -3.01 -0.05 0.00 -1.58 0.00 0.00 42.46 37.67 1hdn s ILE 33 CO 0.09 -0.57 0.14 -0.89 -1.23 0.00 0.00 174.94 172.47 1hdn s THR 34 N 1.09 5.41 -0.36 2.92 2.01 -0.16 -1.59 115.64 124.97 1hdn s THR 34 Ca 0.07 0.21 -0.06 0.00 0.31 0.00 0.00 61.69 62.21 1hdn s THR 34 Cb -0.21 -3.48 0.06 0.00 0.01 0.00 0.00 72.50 68.88 1hdn s THR 34 CO -0.05 0.44 0.13 -0.69 -0.69 0.00 0.00 174.62 173.77 1hdn s VAL 35 N 0.35 3.71 -0.23 3.82 1.01 0.60 -0.56 120.40 129.10 1hdn s VAL 35 Ca 0.08 -1.33 -0.07 0.00 0.00 0.00 0.00 61.98 60.66 1hdn s VAL 35 Cb -0.11 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 1hdn s VAL 35 CO -0.02 -0.30 0.07 -0.89 0.00 0.00 0.00 175.10 173.96 1hdn s THR 36 N 1.36 4.42 -0.35 3.92 2.01 -0.20 -0.79 115.64 126.01 1hdn s THR 36 Ca 0.00 -0.14 0.02 0.00 0.31 0.00 0.00 61.69 61.88 1hdn s THR 36 Cb -0.21 -3.04 0.10 0.00 0.01 0.00 0.00 72.50 69.36 1hdn s THR 36 CO 0.01 0.37 0.09 -0.55 -0.69 0.00 0.00 174.62 173.86 1hdn s SER 37 N 1.29 4.38 -0.11 3.53 0.15 -0.06 -0.85 113.70 122.02 1hdn s SER 37 Ca 0.05 -2.04 -0.10 0.00 0.70 0.00 0.00 55.95 54.56 1hdn s SER 37 Cb -0.15 -1.29 0.02 0.00 -1.71 0.00 0.00 66.02 62.89 1hdn s SER 37 CO 0.03 -0.38 0.17 -0.46 1.20 0.00 0.00 173.24 173.80 1hdn n ASN 38 N 4.37 -3.81 0.00 5.45 0.23 -1.26 -1.48 115.26 118.75 1hdn n ASN 38 Ca 0.02 0.11 0.00 0.00 -0.53 0.00 0.00 54.58 54.18 1hdn n ASN 38 Cb 0.41 -0.98 0.00 0.00 -2.08 0.00 0.00 39.78 37.13 1hdn n ASN 38 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hdn n GLY 39 N 0.55 1.85 3.82 4.83 0.00 -1.26 -4.99 105.19 109.98 1hdn n GLY 39 Ca -0.02 -0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 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 4.03 -0.07 1.61 -0.14 -0.55 -5.09 119.74 119.53 1hdn s LYS 40 Ca 0.00 0.47 0.04 0.00 -1.36 0.00 0.00 55.97 55.12 1hdn s LYS 40 Cb 0.00 -3.25 -0.02 0.00 -1.68 0.00 0.00 37.83 32.88 1hdn s LYS 40 CO 0.00 0.61 -0.19 -1.54 -0.76 0.00 0.00 175.35 173.47 1hdn s SER 41 N -0.85 3.57 -0.05 2.83 1.04 -1.26 -0.88 113.70 118.10 1hdn s SER 41 Ca 0.25 -0.37 0.02 0.00 0.48 0.00 0.00 55.95 56.32 1hdn s SER 41 Cb -0.17 -1.01 0.01 0.00 0.10 0.00 0.00 66.02 64.96 1hdn s SER 41 CO 0.14 0.26 -0.09 0.00 0.98 0.00 0.00 173.24 174.53 1hdn s ALA 42 N -0.23 0.99 -0.45 5.32 0.00 0.03 -5.01 121.76 122.42 1hdn s ALA 42 Ca -0.00 -0.28 -0.28 0.00 0.00 0.00 0.00 51.96 51.40 1hdn s ALA 42 Cb -0.13 -0.47 0.03 0.00 0.00 0.00 0.00 23.12 22.55 1hdn s ALA 42 CO 0.03 0.08 1.09 0.45 0.00 0.00 0.00 175.76 177.41 1hdn s SER 43 N 0.65 6.66 0.58 0.00 0.15 -1.26 -0.29 113.70 120.18 1hdn s SER 43 Ca -0.12 0.51 0.27 0.00 0.70 0.00 0.00 55.95 57.31 1hdn s SER 43 Cb -0.14 -2.53 1.69 0.00 -1.71 0.00 0.00 66.02 63.33 1hdn s SER 43 CO 0.02 -1.15 2.21 0.00 1.20 0.00 0.00 173.24 175.52 1hdn h ALA 44 N 9.00 1.68 0.00 5.45 0.00 -1.67 -2.18 119.26 131.53 1hdn h ALA 44 Ca -0.23 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1hdn h ALA 44 Cb 1.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1hdn h ALA 44 CO 1.09 -0.07 -0.01 0.87 0.00 0.00 0.00 179.25 181.13 1hdn h LYS 45 N 0.00 0.00 -4.82 0.00 1.57 -1.87 -3.36 116.57 108.09 1hdn h LYS 45 Ca 0.02 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.13 1hdn h LYS 45 Cb 0.11 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.19 1hdn h LYS 45 CO -0.00 0.01 -0.58 0.45 -0.57 0.00 0.00 179.45 178.76 1hdn s SER 46 N -5.42 5.38 0.21 0.86 0.15 -0.82 -4.90 113.70 109.16 1hdn s SER 46 Ca -0.04 -0.51 -0.09 0.00 0.70 0.00 0.00 55.95 56.01 1hdn s SER 46 Cb 0.13 -1.96 0.31 0.00 -1.71 0.00 0.00 66.02 62.78 1hdn s SER 46 CO 0.46 -0.17 1.72 0.25 1.20 0.00 0.00 173.24 176.70 1hdn h LEU 47 N 8.30 0.08 -0.38 3.45 5.85 -1.83 -0.78 115.31 130.00 1hdn h LEU 47 Ca -0.33 0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.57 1hdn h LEU 47 Cb 1.15 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.22 1hdn h LEU 47 CO 0.61 0.05 -0.17 0.15 -0.34 0.00 0.00 178.44 178.73 1hdn h PHE 48 N 0.31 -0.41 -0.08 1.25 3.57 -1.94 -1.65 116.94 117.99 1hdn h PHE 48 Ca 0.32 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.86 1hdn h PHE 48 Cb 0.47 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 1hdn h PHE 48 CO -0.22 -0.25 0.03 0.87 -2.23 0.00 0.00 178.31 176.51 1hdn h LYS 49 N -0.10 0.12 -0.74 1.11 1.57 -1.58 -2.66 116.57 114.29 1hdn h LYS 49 Ca 0.19 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.05 1hdn h LYS 49 Cb 0.39 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 1hdn h LYS 49 CO -0.44 0.25 0.37 1.25 -0.57 0.00 0.00 179.45 180.30 1hdn h LEU 50 N -0.03 0.46 -1.36 2.94 5.85 -1.00 -2.32 115.31 119.85 1hdn h LEU 50 Ca 0.03 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 1hdn h LEU 50 Cb 0.17 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1hdn h LEU 50 CO -0.00 0.25 -0.20 1.56 -0.34 0.00 0.00 178.44 179.71 1hdn h GLN 51 N 0.60 0.18 -2.29 1.25 4.20 -1.11 -3.25 115.11 114.68 1hdn h GLN 51 Ca 0.37 -0.05 -0.68 0.00 0.06 0.00 0.00 58.65 58.35 1hdn h GLN 51 Cb 0.43 -0.02 -0.18 0.00 0.30 0.00 0.00 27.48 28.00 1hdn h GLN 51 CO -0.29 0.38 1.40 -2.37 -0.67 0.00 0.00 178.83 177.28 1hdn n THR 52 N -4.23 4.62 -3.70 -0.54 5.66 -0.87 -4.87 114.28 110.35 1hdn n THR 52 Ca -0.01 -4.19 -0.14 0.00 -3.05 0.00 0.00 64.05 56.65 1hdn n THR 52 Cb 0.31 -1.74 -0.08 0.00 -1.55 0.00 0.00 70.33 67.27 1hdn n THR 52 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1hdn s LEU 53 N -2.74 0.47 -1.34 1.09 2.96 -1.23 -4.97 118.68 112.92 1hdn s LEU 53 Ca 0.53 0.21 -0.16 0.00 -0.22 0.00 0.00 54.13 54.49 1hdn s LEU 53 Cb 0.28 1.60 0.07 0.00 0.50 0.00 0.00 46.19 48.64 1hdn s LEU 53 CO -0.18 -0.51 1.87 0.61 -1.32 0.00 0.00 176.35 176.82 1hdn n GLY 54 N 1.09 3.28 2.19 7.98 0.00 -1.26 -4.81 105.19 113.67 1hdn n GLY 54 Ca -0.21 -1.57 -0.26 0.00 0.00 0.00 0.00 46.02 43.99 1hdn n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hdn n LEU 55 N 7.31 6.93 -4.96 0.99 4.77 -1.26 -4.87 117.00 125.91 1hdn n LEU 55 Ca 0.49 -3.83 -0.19 0.00 -0.03 0.00 0.00 56.01 52.45 1hdn n LEU 55 Cb 0.43 -1.06 -0.00 0.00 -2.33 0.00 0.00 43.42 40.46 1hdn n LEU 55 CO 0.80 1.42 0.11 0.28 -1.33 0.00 0.00 177.39 178.67 1hdn s THR 56 N -3.26 2.80 -0.25 -5.08 -1.32 -1.26 -4.13 115.64 103.13 1hdn s THR 56 Ca 0.47 -1.13 -0.35 0.00 -1.21 0.00 0.00 61.69 59.47 1hdn s THR 56 Cb 0.36 -2.92 -0.12 0.00 -1.51 0.00 0.00 72.50 68.31 1hdn s THR 56 CO -0.07 0.00 2.01 0.00 -2.21 0.00 0.00 174.62 174.35 1hdn n GLN 57 N -1.77 1.48 0.00 7.08 10.64 -1.19 -2.12 117.38 131.50 1hdn n GLN 57 Ca 0.07 0.48 0.00 0.00 -1.83 0.00 0.00 57.00 55.72 1hdn n GLN 57 Cb 0.60 -2.50 0.00 0.00 -0.86 0.00 0.00 30.24 27.49 1hdn n GLN 57 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1hdn n GLY 58 N 5.40 3.14 3.72 2.61 0.00 0.90 -4.95 105.19 116.02 1hdn n GLY 58 Ca 0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.92 1hdn n GLY 58 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hdn s THR 59 N -2.78 3.71 -0.44 2.61 2.01 -0.90 -4.67 115.64 115.18 1hdn s THR 59 Ca 0.00 1.31 -0.25 0.00 0.31 0.00 0.00 61.69 63.06 1hdn s THR 59 Cb 0.00 -3.84 0.02 0.00 0.01 0.00 0.00 72.50 68.70 1hdn s THR 59 CO 0.00 0.15 0.88 0.54 -0.69 0.00 0.00 174.62 175.50 1hdn s VAL 60 N 0.59 4.55 -0.18 3.82 0.11 -1.26 -0.59 120.40 127.44 1hdn s VAL 60 Ca 0.57 0.72 -0.06 0.00 -2.93 0.00 0.00 61.98 60.29 1hdn s VAL 60 Cb -0.32 -4.38 -0.03 0.00 -1.53 0.00 0.00 36.38 30.12 1hdn s VAL 60 CO 0.33 -0.75 0.02 0.54 -3.33 0.00 0.00 175.10 171.91 1hdn s VAL 61 N 3.56 4.39 -0.48 2.04 0.11 0.26 -4.66 120.40 125.62 1hdn s VAL 61 Ca 0.35 -0.18 -0.21 0.00 -2.93 0.00 0.00 61.98 59.01 1hdn s VAL 61 Cb -0.11 -2.96 0.04 0.00 -1.53 0.00 0.00 36.38 31.82 1hdn s VAL 61 CO 0.24 0.46 0.70 -0.89 -3.33 0.00 0.00 175.10 172.28 1hdn s THR 62 N 0.47 4.76 -0.71 5.04 2.01 -0.03 -0.55 115.64 126.63 1hdn s THR 62 Ca 0.00 -0.06 -0.26 0.00 0.31 0.00 0.00 61.69 61.68 1hdn s THR 62 Cb -0.13 -4.30 0.04 0.00 0.01 0.00 0.00 72.50 68.11 1hdn s THR 62 CO 0.02 -0.77 1.22 -0.63 -0.69 0.00 0.00 174.62 173.77 1hdn s ILE 63 N 2.97 3.84 -0.54 1.82 -1.09 -0.03 -1.03 121.20 127.14 1hdn s ILE 63 Ca 0.22 0.35 -0.16 0.00 -2.23 0.00 0.00 60.65 58.83 1hdn s ILE 63 Cb -0.16 -4.86 0.12 0.00 -1.58 0.00 0.00 42.46 35.98 1hdn s ILE 63 CO 0.17 -1.74 0.51 -0.55 -1.23 0.00 0.00 174.94 172.09 1hdn s SER 64 N 3.64 6.19 -0.19 3.58 0.15 0.27 -1.59 113.70 125.75 1hdn s SER 64 Ca 0.34 -1.71 -0.06 0.00 0.70 0.00 0.00 55.95 55.22 1hdn s SER 64 Cb -0.09 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 61.97 1hdn s SER 64 CO 0.15 -0.86 0.02 0.00 1.20 0.00 0.00 173.24 173.75 1hdn s ALA 65 N 1.70 3.14 -0.02 5.45 0.00 -0.38 -0.98 121.76 130.66 1hdn s ALA 65 Ca 0.04 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.14 1hdn s ALA 65 Cb -0.29 -1.80 -0.01 0.00 0.00 0.00 0.00 23.12 21.02 1hdn s ALA 65 CO 0.04 -0.02 -0.16 -1.83 0.00 0.00 0.00 175.76 173.78 1hdn s GLU 66 N 0.76 1.41 0.00 0.00 -1.05 -0.84 -0.86 118.70 118.12 1hdn s GLU 66 Ca 0.01 -0.58 0.00 0.00 -0.15 0.00 0.00 54.97 54.25 1hdn s GLU 66 Cb -0.14 -1.33 0.00 0.00 -0.44 0.00 0.00 34.13 32.22 1hdn s GLU 66 CO 0.02 0.32 0.00 0.41 0.95 0.00 0.00 175.26 176.97 1hdn n GLY 67 N 2.79 0.35 0.00 -3.83 0.00 -1.26 -0.65 105.19 102.59 1hdn n GLY 67 Ca -0.15 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.07 1hdn n GLY 67 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1hdn n GLU 68 N 0.00 0.00 -1.02 1.61 1.02 -1.26 -2.75 120.64 118.24 1hdn n GLU 68 Ca 0.00 0.11 -0.13 0.00 -0.02 0.00 0.00 57.16 57.11 1hdn n GLU 68 Cb 0.00 -0.65 -0.12 0.00 -0.02 0.00 0.00 31.44 30.64 1hdn n GLU 68 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1hdn n ASP 69 N -0.26 5.52 -0.22 1.62 9.92 -1.26 -4.71 116.55 127.15 1hdn n ASP 69 Ca 0.00 -2.62 0.04 0.00 -0.53 0.00 0.00 54.79 51.68 1hdn n ASP 69 Cb 0.00 -1.34 0.29 0.00 -0.64 0.00 0.00 41.12 39.43 1hdn n ASP 69 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 1hdn h GLU 70 N 2.71 0.89 0.51 -1.24 4.11 -1.82 -1.14 114.58 118.60 1hdn h GLU 70 Ca 0.21 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.56 1hdn h GLU 70 Cb 1.29 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1hdn h GLU 70 CO 0.34 0.59 -0.24 1.96 0.07 0.00 0.00 179.01 181.72 1hdn h GLN 71 N 0.91 -0.65 -0.34 1.06 4.20 -1.88 -3.36 115.11 115.05 1hdn h GLN 71 Ca 0.32 0.04 0.04 0.00 0.06 0.00 0.00 58.65 59.12 1hdn h GLN 71 Cb 0.12 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 1hdn h GLN 71 CO -0.10 -0.42 0.10 -0.22 -0.67 0.00 0.00 178.83 177.53 1hdn h LYS 72 N -1.16 0.23 -0.90 1.46 3.64 -1.90 -2.95 116.57 114.99 1hdn h LYS 72 Ca -0.07 -0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.45 1hdn h LYS 72 Cb 0.54 -0.05 -0.10 0.00 -0.41 0.00 0.00 32.23 32.21 1hdn h LYS 72 CO 0.11 0.15 0.49 0.00 -2.27 0.00 0.00 179.45 177.94 1hdn h ALA 73 N 1.23 1.40 0.39 5.00 0.00 -1.37 -1.93 119.26 123.98 1hdn h ALA 73 Ca 0.16 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1hdn h ALA 73 Cb 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1hdn h ALA 73 CO -0.18 -0.07 -0.19 0.28 0.00 0.00 0.00 179.25 179.10 1hdn h VAL 74 N 0.68 0.56 -0.69 0.00 2.07 -1.66 -1.11 116.25 116.11 1hdn h VAL 74 Ca 0.50 -0.50 0.14 0.00 0.82 0.00 0.00 66.70 67.65 1hdn h VAL 74 Cb 0.72 0.79 -0.13 0.00 -1.52 0.00 0.00 31.29 31.14 1hdn h VAL 74 CO -0.37 0.09 -0.14 -0.08 0.02 0.00 0.00 177.57 177.09 1hdn h GLU 75 N -0.83 0.02 0.05 1.57 4.81 -1.54 0.06 114.58 118.72 1hdn h GLU 75 Ca -0.05 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1hdn h GLU 75 Cb 0.54 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1hdn h GLU 75 CO 0.09 0.01 -0.03 1.25 -0.73 0.00 0.00 179.01 179.60 1hdn h HIS 76 N 0.02 -0.07 -0.82 0.92 2.76 -1.29 -2.86 115.15 113.81 1hdn h HIS 76 Ca 0.34 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.53 1hdn h HIS 76 Cb 0.53 0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.47 1hdn h HIS 76 CO -0.53 0.10 0.54 -0.07 -1.30 0.00 0.00 177.93 176.67 1hdn h LEU 77 N -0.22 0.90 0.03 0.26 3.38 -0.39 -0.75 115.31 118.53 1hdn h LEU 77 Ca -0.01 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1hdn h LEU 77 Cb 0.20 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1hdn h LEU 77 CO 0.01 0.64 -0.23 0.58 0.09 0.00 0.00 178.44 179.53 1hdn h VAL 78 N 1.06 0.48 -0.36 1.22 2.07 -0.89 -0.79 116.25 119.03 1hdn h VAL 78 Ca 0.31 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.83 1hdn h VAL 78 Cb -0.04 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1hdn h VAL 78 CO -0.08 0.00 0.21 0.50 0.02 0.00 0.00 177.57 178.22 1hdn h LYS 79 N -0.38 0.50 -0.30 1.57 3.64 -1.24 -2.36 116.57 118.00 1hdn h LYS 79 Ca 0.05 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1hdn h LYS 79 Cb 0.44 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.10 1hdn h LYS 79 CO -0.18 0.39 -0.09 1.25 -2.27 0.00 0.00 179.45 178.54 1hdn h LEU 80 N 0.47 -0.32 -0.42 5.20 6.46 -0.85 -1.04 115.31 124.79 1hdn h LEU 80 Ca 0.13 0.10 0.03 0.00 -0.12 0.00 0.00 57.88 58.01 1hdn h LEU 80 Cb 0.02 0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 1hdn h LEU 80 CO -0.02 -0.12 0.22 0.24 -0.62 0.00 0.00 178.44 178.14 1hdn h MET 81 N -0.02 0.44 0.00 1.25 2.86 -1.02 -2.37 114.93 116.06 1hdn h MET 81 Ca 0.15 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 1hdn h MET 81 Cb 0.25 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 1hdn h MET 81 CO -0.32 0.29 -0.06 0.00 1.06 0.00 0.00 176.91 177.88 1hdn h ALA 82 N 1.21 1.08 -0.00 6.32 0.00 -0.77 -2.59 119.26 124.52 1hdn h ALA 82 Ca 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1hdn h ALA 82 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1hdn h ALA 82 CO -0.11 0.07 0.00 0.39 0.00 0.00 0.00 179.25 179.60 1hdn n GLU 83 N -3.28 1.03 -4.31 0.00 1.02 -0.49 -4.96 120.64 109.66 1hdn n GLU 83 Ca -0.01 -0.04 -0.29 0.00 -0.02 0.00 0.00 57.16 56.80 1hdn n GLU 83 Cb 0.24 -1.41 -0.11 0.00 -0.02 0.00 0.00 31.44 30.14 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 -1.82 2.73 0.00 -4.62 1.43 -0.98 -5.10 118.68 110.33 1hdn s LEU 84 Ca 0.39 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1hdn s LEU 84 Cb 0.18 -1.54 0.00 0.00 0.03 0.00 0.00 46.19 44.86 1hdn s LEU 84 CO 0.30 0.16 0.31 -0.62 0.23 0.00 0.00 176.35 176.74