#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 3.06 -0.23 1.12 5.36 -1.03 -4.93 117.98 121.32 1hdn s PHE 2 Ca 0.00 -0.36 0.00 0.00 -0.96 0.00 0.00 56.93 55.61 1hdn s PHE 2 Cb 0.00 -2.06 0.03 0.00 -0.34 0.00 0.00 43.02 40.65 1hdn s PHE 2 CO 0.00 -0.15 -0.12 -1.14 -1.46 0.00 0.00 175.22 172.35 1hdn s GLN 3 N 0.81 2.80 -0.17 10.12 -0.44 -1.26 -0.69 119.66 130.82 1hdn s GLN 3 Ca 0.01 -0.98 0.01 0.00 -2.50 0.00 0.00 55.36 51.89 1hdn s GLN 3 Cb -0.14 -2.83 0.01 0.00 -1.64 0.00 0.00 33.01 28.41 1hdn s GLN 3 CO 0.02 -0.36 -0.19 -1.14 0.50 0.00 0.00 175.29 174.12 1hdn s GLN 4 N 1.28 3.04 -0.40 1.67 0.74 -0.66 -5.00 119.66 120.33 1hdn s GLN 4 Ca 0.00 -0.82 -0.28 0.00 0.05 0.00 0.00 55.36 54.32 1hdn s GLN 4 Cb -0.16 -2.57 0.02 0.00 1.10 0.00 0.00 33.01 31.41 1hdn s GLN 4 CO -0.07 -0.14 1.04 -2.00 -0.55 0.00 0.00 175.29 173.57 1hdn s GLU 5 N 1.14 3.84 -0.00 1.67 2.12 -1.26 -1.93 118.70 124.27 1hdn s GLU 5 Ca 0.01 0.68 0.06 0.00 0.36 0.00 0.00 54.97 56.08 1hdn s GLU 5 Cb -0.14 -3.83 -0.02 0.00 0.26 0.00 0.00 34.13 30.40 1hdn s GLU 5 CO -0.08 -1.12 -0.20 0.08 -0.54 0.00 0.00 175.26 173.40 1hdn s VAL 6 N 3.90 1.57 -0.20 3.70 1.01 -0.14 -5.03 120.40 125.22 1hdn s VAL 6 Ca 0.44 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 1hdn s VAL 6 Cb -0.10 -1.32 -0.00 0.00 0.00 0.00 0.00 36.38 34.95 1hdn s VAL 6 CO 0.23 0.39 -0.09 0.42 0.00 0.00 0.00 175.10 176.05 1hdn s THR 7 N -0.54 3.05 -0.22 3.92 -4.23 -1.26 0.10 115.64 116.47 1hdn s THR 7 Ca 0.07 -0.61 -0.10 0.00 -1.18 0.00 0.00 61.69 59.88 1hdn s THR 7 Cb -0.08 -2.36 -0.05 0.00 1.34 0.00 0.00 72.50 71.35 1hdn s THR 7 CO -0.00 0.46 0.13 -0.63 -0.54 0.00 0.00 174.62 174.04 1hdn s ILE 8 N 1.32 5.19 -0.47 2.99 1.01 -0.48 -5.01 121.20 125.75 1hdn s ILE 8 Ca 0.04 0.12 0.08 0.00 0.00 0.00 0.00 60.65 60.89 1hdn s ILE 8 Cb -0.14 -3.40 0.38 0.00 0.01 0.00 0.00 42.46 39.31 1hdn s ILE 8 CO -0.05 0.38 0.96 1.07 0.00 0.00 0.00 174.94 177.31 1hdn n THR 9 N 4.07 2.03 -3.57 2.92 5.66 -1.21 -2.23 114.28 121.94 1hdn n THR 9 Ca -0.16 -4.87 -0.40 0.00 -3.05 0.00 0.00 64.05 55.58 1hdn n THR 9 Cb 0.52 -0.88 -0.11 0.00 -1.55 0.00 0.00 70.33 68.31 1hdn n THR 9 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hdn s ALA 10 N -3.27 3.41 0.32 1.79 0.00 -0.16 -4.52 121.76 119.33 1hdn s ALA 10 Ca 0.44 -1.42 0.02 0.00 0.00 0.00 0.00 51.96 51.00 1hdn s ALA 10 Cb 0.35 -2.58 0.53 0.00 0.00 0.00 0.00 23.12 21.43 1hdn s ALA 10 CO -0.12 -1.00 1.86 -1.00 0.00 0.00 0.00 175.76 175.51 1hdn h PRO 11 N 8.45 0.64 0.04 0.00 0.13 -1.96 -1.87 132.00 137.42 1hdn h PRO 11 Ca -0.31 -0.13 0.02 0.00 -0.87 0.00 0.00 66.00 64.71 1hdn h PRO 11 Cb 1.15 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1hdn h PRO 11 CO 0.63 0.62 -0.13 -2.95 -0.23 0.00 0.00 178.00 175.94 1hdn h ASN 12 N 0.62 -0.38 -3.99 1.44 -1.07 -1.95 -3.46 115.58 106.80 1hdn h ASN 12 Ca 0.14 0.05 0.00 0.00 0.07 0.00 0.00 56.30 56.56 1hdn h ASN 12 Cb 0.30 0.15 0.00 0.00 -2.07 0.00 0.00 38.32 36.70 1hdn h ASN 12 CO 0.00 -0.19 -0.25 0.61 0.07 0.00 0.00 177.43 177.67 1hdn n GLY 13 N -1.26 -3.25 3.46 9.14 0.00 -1.04 -4.77 105.19 107.48 1hdn n GLY 13 Ca -0.06 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.47 5.23 0.00 0.99 4.77 0.70 -4.96 117.00 122.26 1hdn n LEU 14 Ca 0.00 -4.18 0.00 0.00 -0.03 0.00 0.00 56.01 51.80 1hdn n LEU 14 Cb 0.08 -1.68 0.00 0.00 -2.33 0.00 0.00 43.42 39.48 1hdn n LEU 14 CO 0.00 0.48 0.00 0.00 -1.33 0.00 0.00 177.39 176.54 1hdn n HIS 15 N 6.98 -2.11 -0.24 -1.77 1.44 -1.26 -4.35 115.22 113.91 1hdn n HIS 15 Ca 0.44 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 56.18 1hdn n HIS 15 Cb 0.44 0.00 0.16 0.00 0.12 0.00 0.00 29.99 30.71 1hdn n HIS 15 CO 0.00 0.00 0.00 1.79 -2.81 0.00 0.00 176.34 175.32 1hdn h THR 16 N -1.33 0.67 -0.08 0.61 1.35 -1.93 0.12 112.91 112.31 1hdn h THR 16 Ca 0.00 -0.14 -0.10 0.00 -0.55 0.00 0.00 66.41 65.62 1hdn h THR 16 Cb 0.00 0.23 0.00 0.00 -1.73 0.00 0.00 68.15 66.66 1hdn h THR 16 CO 0.00 0.07 -0.33 0.03 -0.25 0.00 0.00 175.52 175.04 1hdn h ARG 17 N 0.40 0.37 -0.53 4.72 2.47 -1.99 0.04 114.38 119.87 1hdn h ARG 17 Ca 0.38 -0.29 0.06 0.00 -1.26 0.00 0.00 59.98 58.87 1hdn h ARG 17 Cb 0.56 0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 28.88 1hdn h ARG 17 CO -0.39 0.92 0.24 -1.35 0.56 0.00 0.00 179.97 179.96 1hdn h PRO 18 N -0.10 0.46 -0.66 0.04 0.11 -1.83 -1.46 132.00 128.56 1hdn h PRO 18 Ca -0.02 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 66.13 1hdn h PRO 18 Cb 0.97 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 31.92 1hdn h PRO 18 CO 0.07 0.30 0.35 0.00 -0.21 0.00 0.00 178.00 178.51 1hdn h ALA 19 N 1.31 0.89 -0.62 -0.75 0.00 -0.75 0.18 119.26 119.52 1hdn h ALA 19 Ca 0.24 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1hdn h ALA 19 Cb 0.20 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1hdn h ALA 19 CO -0.20 0.01 0.25 0.00 0.00 0.00 0.00 179.25 179.31 1hdn h ALA 20 N 1.36 0.80 -0.48 0.00 0.00 -0.78 0.11 119.26 120.27 1hdn h ALA 20 Ca 0.30 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1hdn h ALA 20 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1hdn h ALA 20 CO -0.20 0.42 0.09 0.37 0.00 0.00 0.00 179.25 179.93 1hdn h GLN 21 N 0.86 0.79 -0.76 0.00 5.75 -0.63 -2.50 115.11 118.62 1hdn h GLN 21 Ca 0.21 -0.20 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1hdn h GLN 21 Cb 0.21 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.62 1hdn h GLN 21 CO -0.02 0.78 0.39 0.35 -2.65 0.00 0.00 178.83 177.68 1hdn h PHE 22 N 0.66 1.07 -0.50 3.99 3.04 -0.42 -1.81 116.94 122.98 1hdn h PHE 22 Ca 0.15 -0.04 0.09 0.00 3.98 0.00 0.00 57.97 62.14 1hdn h PHE 22 Cb 0.37 -0.34 -0.07 0.00 2.56 0.00 0.00 35.95 38.47 1hdn h PHE 22 CO 0.03 0.77 0.10 0.28 -2.02 0.00 0.00 178.31 177.46 1hdn h VAL 23 N 1.06 0.71 -0.27 1.41 2.07 -0.65 0.16 116.25 120.74 1hdn h VAL 23 Ca 0.26 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1hdn h VAL 23 Cb 0.08 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1hdn h VAL 23 CO -0.04 0.04 0.17 0.50 0.02 0.00 0.00 177.57 178.27 1hdn h LYS 24 N 0.23 0.37 -0.65 1.57 3.64 -0.93 0.19 116.57 120.99 1hdn h LYS 24 Ca 0.25 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 1hdn h LYS 24 Cb 0.34 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1hdn h LYS 24 CO -0.33 0.26 0.27 1.49 -2.27 0.00 0.00 179.45 178.87 1hdn h GLU 25 N 0.36 0.96 -0.61 1.90 4.57 -0.97 -1.73 114.58 119.07 1hdn h GLU 25 Ca 0.10 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.05 1hdn h GLU 25 Cb -0.02 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1hdn h GLU 25 CO -0.02 0.80 0.15 0.00 -1.18 0.00 0.00 179.01 178.76 1hdn h ALA 26 N 1.11 1.12 0.00 2.92 0.00 -0.51 -1.09 119.26 122.82 1hdn h ALA 26 Ca 0.22 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1hdn h ALA 26 Cb 0.19 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1hdn h ALA 26 CO -0.02 0.59 -0.04 0.87 0.00 0.00 0.00 179.25 180.65 1hdn h LYS 27 N 0.90 0.00 -0.52 0.00 1.79 -0.25 -3.19 116.57 115.31 1hdn h LYS 27 Ca 0.19 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.64 1hdn h LYS 27 Cb 0.32 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.95 1hdn h LYS 27 CO -0.00 0.04 0.23 0.78 -1.08 0.00 0.00 179.45 179.42 1hdn h GLY 28 N 0.15 0.82 -2.58 3.86 0.00 -0.29 -3.44 103.07 101.59 1hdn h GLY 28 Ca -0.00 -0.42 -0.46 0.00 0.00 0.00 0.00 47.33 46.44 1hdn h GLY 28 CO 0.01 0.40 0.36 -1.36 0.00 0.00 0.00 176.54 175.95 1hdn s PHE 29 N -5.64 3.41 0.16 5.60 0.08 -1.19 -5.01 117.98 115.38 1hdn s PHE 29 Ca -0.13 1.68 -0.08 0.00 0.12 0.00 0.00 56.93 58.52 1hdn s PHE 29 Cb 0.12 -2.96 0.01 0.00 -0.57 0.00 0.00 43.02 39.62 1hdn s PHE 29 CO 0.77 -0.19 1.47 1.79 -0.10 0.00 0.00 175.22 178.97 1hdn h THR 30 N 2.20 1.29 -4.15 0.64 1.35 -1.86 -3.45 112.91 108.94 1hdn h THR 30 Ca -0.48 -1.68 -0.53 0.00 -0.55 0.00 0.00 66.41 63.17 1hdn h THR 30 Cb 1.20 1.58 0.13 0.00 -1.73 0.00 0.00 68.15 69.33 1hdn h THR 30 CO 0.63 0.54 0.43 -0.94 -0.25 0.00 0.00 175.52 175.93 1hdn s SER 31 N -6.90 4.71 -0.48 5.36 1.04 -1.26 -4.93 113.70 111.23 1hdn s SER 31 Ca -0.10 2.33 -0.20 0.00 0.48 0.00 0.00 55.95 58.47 1hdn s SER 31 Cb 0.11 -2.59 0.04 0.00 0.10 0.00 0.00 66.02 63.68 1hdn s SER 31 CO 0.87 -1.91 0.67 -0.70 0.98 0.00 0.00 173.24 173.14 1hdn s GLU 32 N -3.69 3.21 -0.55 4.02 2.12 0.37 -4.89 118.70 119.29 1hdn s GLU 32 Ca 0.75 -0.60 -0.28 0.00 0.36 0.00 0.00 54.97 55.20 1hdn s GLU 32 Cb -0.29 -4.03 0.01 0.00 0.26 0.00 0.00 34.13 30.08 1hdn s GLU 32 CO 0.40 -1.16 1.47 0.42 -0.54 0.00 0.00 175.26 175.85 1hdn s ILE 33 N 2.86 3.73 -0.29 -3.70 -1.09 -1.26 -1.43 121.20 120.03 1hdn s ILE 33 Ca 0.20 0.62 -0.05 0.00 -2.23 0.00 0.00 60.65 59.18 1hdn s ILE 33 Cb -0.16 -4.35 0.02 0.00 -1.58 0.00 0.00 42.46 36.39 1hdn s ILE 33 CO 0.16 -1.10 0.05 -0.89 -1.23 0.00 0.00 174.94 171.92 1hdn s THR 34 N 6.35 3.66 -0.50 2.92 2.01 -0.39 -0.81 115.64 128.88 1hdn s THR 34 Ca 0.55 -0.84 -0.13 0.00 0.31 0.00 0.00 61.69 61.58 1hdn s THR 34 Cb -0.12 -2.91 0.12 0.00 0.01 0.00 0.00 72.50 69.60 1hdn s THR 34 CO 0.25 0.07 0.42 -0.69 -0.69 0.00 0.00 174.62 173.99 1hdn s VAL 35 N 1.44 4.84 -0.76 3.82 1.01 0.08 -1.43 120.40 129.40 1hdn s VAL 35 Ca 0.01 -1.53 -0.23 0.00 0.00 0.00 0.00 61.98 60.24 1hdn s VAL 35 Cb -0.17 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 32.19 1hdn s VAL 35 CO 0.01 -0.78 1.09 -0.89 0.00 0.00 0.00 175.10 174.53 1hdn s THR 36 N 1.52 4.27 -0.68 3.92 2.01 -0.36 -1.06 115.64 125.26 1hdn s THR 36 Ca 0.04 -0.52 -0.27 0.00 0.31 0.00 0.00 61.69 61.25 1hdn s THR 36 Cb -0.28 -4.78 0.01 0.00 0.01 0.00 0.00 72.50 67.47 1hdn s THR 36 CO 0.02 -1.58 1.46 -0.55 -0.69 0.00 0.00 174.62 173.28 1hdn s SER 37 N 3.81 5.91 0.00 3.53 0.15 -0.87 -1.47 113.70 124.76 1hdn s SER 37 Ca 0.28 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1hdn s SER 37 Cb -0.11 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 1hdn s SER 37 CO 0.05 -1.98 0.00 -0.46 1.20 0.00 0.00 173.24 172.05 1hdn n ASN 38 N 10.34 0.00 0.00 5.45 6.94 0.32 -1.29 115.26 137.03 1hdn n ASN 38 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.65 1hdn n ASN 38 Cb 0.50 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.92 1hdn n ASN 38 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1hdn n GLY 39 N 0.00 2.88 3.48 4.83 0.00 -1.26 -5.03 105.19 110.08 1hdn n GLY 39 Ca 0.00 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 44.81 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 3.45 -0.37 1.61 1.02 -0.41 -5.05 119.74 120.00 1hdn s LYS 40 Ca 0.00 -0.65 -0.29 0.00 0.02 0.00 0.00 55.97 55.05 1hdn s LYS 40 Cb 0.00 -3.64 0.00 0.00 -0.52 0.00 0.00 37.83 33.67 1hdn s LYS 40 CO 0.00 -0.40 1.40 -1.12 -0.92 0.00 0.00 175.35 174.31 1hdn s SER 41 N 1.66 6.43 -0.27 2.83 0.01 -1.26 -2.04 113.70 121.06 1hdn s SER 41 Ca 0.05 1.00 -0.01 0.00 1.31 0.00 0.00 55.95 58.30 1hdn s SER 41 Cb -0.17 -2.54 0.04 0.00 0.21 0.00 0.00 66.02 63.56 1hdn s SER 41 CO 0.08 -1.32 -0.05 0.00 0.41 0.00 0.00 173.24 172.35 1hdn s ALA 42 N 5.13 2.70 -0.20 1.44 0.00 -0.22 -4.96 121.76 125.65 1hdn s ALA 42 Ca 0.61 -1.62 -0.29 0.00 0.00 0.00 0.00 51.96 50.66 1hdn s ALA 42 Cb -0.15 -1.74 -0.03 0.00 0.00 0.00 0.00 23.12 21.20 1hdn s ALA 42 CO 0.30 -1.03 1.67 0.45 0.00 0.00 0.00 175.76 177.15 1hdn s SER 43 N 1.26 6.34 0.28 0.00 0.15 -1.26 -0.74 113.70 119.72 1hdn s SER 43 Ca -0.03 1.72 0.23 0.00 0.70 0.00 0.00 55.95 58.57 1hdn s SER 43 Cb -0.18 -2.53 1.04 0.00 -1.71 0.00 0.00 66.02 62.64 1hdn s SER 43 CO -0.04 -1.28 1.69 0.00 1.20 0.00 0.00 173.24 174.81 1hdn n ALA 44 N 8.54 1.43 1.75 5.45 0.00 0.01 -1.42 120.51 136.27 1hdn n ALA 44 Ca 0.19 0.13 0.01 0.00 0.00 0.00 0.00 53.44 53.77 1hdn n ALA 44 Cb 0.45 -1.36 0.03 0.00 0.00 0.00 0.00 19.45 18.57 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 -2.24 1.16 -4.11 0.00 5.02 -1.23 -4.11 118.16 112.65 1hdn n LYS 45 Ca 0.01 -0.24 -0.21 0.00 -2.02 0.00 0.00 58.31 55.85 1hdn n LYS 45 Cb 0.16 -1.07 -0.17 0.00 -0.02 0.00 0.00 35.03 33.93 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 -0.96 1.19 0.01 4.39 0.15 -0.51 -4.95 113.70 113.02 1hdn s SER 46 Ca 0.04 -0.14 -0.03 0.00 0.70 0.00 0.00 55.95 56.52 1hdn s SER 46 Cb 0.02 -0.50 -0.01 0.00 -1.71 0.00 0.00 66.02 63.83 1hdn s SER 46 CO 0.03 -0.08 1.05 0.25 1.20 0.00 0.00 173.24 175.69 1hdn h LEU 47 N 7.42 -0.15 -0.70 3.45 5.85 -1.84 -1.27 115.31 128.08 1hdn h LEU 47 Ca -0.34 0.02 0.13 0.00 0.84 0.00 0.00 57.88 58.53 1hdn h LEU 47 Cb 1.15 0.06 -0.09 0.00 0.37 0.00 0.00 40.66 42.15 1hdn h LEU 47 CO 0.43 -0.04 0.24 -0.26 -0.34 0.00 0.00 178.44 178.48 1hdn h PHE 48 N -0.05 0.41 0.20 1.25 0.04 -1.97 -1.70 116.94 115.12 1hdn h PHE 48 Ca 0.00 0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.80 1hdn h PHE 48 Cb 0.06 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.13 1hdn h PHE 48 CO -0.50 0.04 -0.10 0.87 -0.60 0.00 0.00 178.31 178.02 1hdn h LYS 49 N 0.39 -0.26 -0.30 1.51 1.57 -1.77 -2.53 116.57 115.17 1hdn h LYS 49 Ca 0.38 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.16 1hdn h LYS 49 Cb 0.57 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1hdn h LYS 49 CO -0.40 0.01 0.13 1.25 -0.57 0.00 0.00 179.45 179.87 1hdn h LEU 50 N -0.52 0.41 -1.71 2.94 5.85 -0.99 -3.17 115.31 118.11 1hdn h LEU 50 Ca -0.03 -0.15 0.09 0.00 0.84 0.00 0.00 57.88 58.63 1hdn h LEU 50 Cb 0.39 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1hdn h LEU 50 CO 0.05 0.45 0.35 1.56 -0.34 0.00 0.00 178.44 180.51 1hdn h GLN 51 N 0.34 0.32 0.00 1.25 4.20 -1.28 -1.90 115.11 118.03 1hdn h GLN 51 Ca 0.10 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1hdn h GLN 51 Cb 0.16 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1hdn h GLN 51 CO -0.01 0.21 0.00 -2.37 -0.67 0.00 0.00 178.83 175.99 1hdn n THR 52 N -4.46 0.03 -5.15 -0.54 5.66 -0.96 -4.78 114.28 104.07 1hdn n THR 52 Ca 0.08 0.01 -0.31 0.00 -3.05 0.00 0.00 64.05 60.77 1hdn n THR 52 Cb 0.35 -0.53 -0.15 0.00 -1.55 0.00 0.00 70.33 68.45 1hdn n THR 52 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1hdn s LEU 53 N -2.22 2.27 -0.18 1.09 2.01 -0.72 -5.10 118.68 115.82 1hdn s LEU 53 Ca 0.38 -0.40 -0.29 0.00 0.01 0.00 0.00 54.13 53.83 1hdn s LEU 53 Cb 0.20 -1.40 -0.02 0.00 0.01 0.00 0.00 46.19 44.98 1hdn s LEU 53 CO 0.38 0.32 1.38 -0.83 1.01 0.00 0.00 176.35 178.62 1hdn s GLY 54 N -0.71 1.51 -0.63 -3.19 0.00 -1.26 -4.98 107.32 98.05 1hdn s GLY 54 Ca 0.11 0.46 0.01 0.00 0.00 0.00 0.00 44.72 45.30 1hdn s GLY 54 CO -0.00 2.67 0.42 1.08 0.00 0.00 0.00 173.10 177.27 1hdn s LEU 55 N 4.00 4.86 0.00 0.66 1.02 -1.26 -4.91 118.68 123.05 1hdn s LEU 55 Ca 0.60 -3.19 0.00 0.00 0.02 0.00 0.00 54.13 51.56 1hdn s LEU 55 Cb -0.23 -1.74 0.00 0.00 0.02 0.00 0.00 46.19 44.24 1hdn s LEU 55 CO 0.21 -0.25 0.00 1.07 0.02 0.00 0.00 176.35 177.40 1hdn n THR 56 N 2.94 0.00 -3.08 5.49 5.66 -1.26 -0.21 114.28 123.82 1hdn n THR 56 Ca 0.10 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.71 1hdn n THR 56 Cb 0.35 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.08 1hdn n THR 56 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 1hdn s GLN 57 N 4.24 4.42 0.00 1.09 0.74 -0.73 -0.98 119.66 128.43 1hdn s GLN 57 Ca 0.00 0.92 0.00 0.00 0.05 0.00 0.00 55.36 56.33 1hdn s GLN 57 Cb 0.00 -3.35 0.00 0.00 1.10 0.00 0.00 33.01 30.76 1hdn s GLN 57 CO 0.00 0.32 0.00 0.41 -0.55 0.00 0.00 175.29 175.47 1hdn n GLY 58 N 2.41 1.63 0.00 2.59 0.00 -0.95 -4.86 105.19 106.02 1hdn n GLY 58 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1hdn n GLY 58 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hdn n THR 59 N 0.00 0.00 -3.44 2.61 -2.24 -1.11 -3.83 114.28 106.26 1hdn n THR 59 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1hdn n THR 59 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 1hdn n THR 59 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1hdn s VAL 60 N 0.00 5.21 -0.21 2.28 1.01 -1.26 -1.39 120.40 126.04 1hdn s VAL 60 Ca 0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 1hdn s VAL 60 Cb 0.00 -3.99 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 1hdn s VAL 60 CO 0.00 -0.42 -0.08 0.68 0.00 0.00 0.00 175.10 175.29 1hdn s VAL 61 N 1.66 3.08 -0.45 2.92 -7.23 0.12 -0.52 120.40 119.97 1hdn s VAL 61 Ca 0.04 -0.61 -0.12 0.00 -1.81 0.00 0.00 61.98 59.49 1hdn s VAL 61 Cb -0.21 -2.39 0.08 0.00 0.56 0.00 0.00 36.38 34.42 1hdn s VAL 61 CO 0.08 0.44 0.33 0.42 -0.31 0.00 0.00 175.10 176.06 1hdn s THR 62 N 1.43 4.64 -0.61 5.32 -4.23 -0.54 -0.97 115.64 120.68 1hdn s THR 62 Ca 0.05 -1.32 -0.23 0.00 -1.18 0.00 0.00 61.69 59.01 1hdn s THR 62 Cb -0.14 -3.84 0.05 0.00 1.34 0.00 0.00 72.50 69.92 1hdn s THR 62 CO -0.05 -0.58 0.96 -0.63 -0.54 0.00 0.00 174.62 173.78 1hdn s ILE 63 N 1.51 4.34 -0.42 2.99 1.09 -0.81 -1.22 121.20 128.68 1hdn s ILE 63 Ca 0.04 -0.01 -0.14 0.00 -1.10 0.00 0.00 60.65 59.43 1hdn s ILE 63 Cb -0.24 -4.61 0.03 0.00 -1.06 0.00 0.00 42.46 36.58 1hdn s ILE 63 CO 0.03 -1.29 0.30 -0.55 -0.10 0.00 0.00 174.94 173.33 1hdn s SER 64 N 3.24 6.02 -0.65 3.58 0.15 -0.51 -1.64 113.70 123.88 1hdn s SER 64 Ca 0.27 -1.03 -0.18 0.00 0.70 0.00 0.00 55.95 55.71 1hdn s SER 64 Cb -0.14 -2.13 0.13 0.00 -1.71 0.00 0.00 66.02 62.16 1hdn s SER 64 CO 0.15 -0.48 0.73 0.00 1.20 0.00 0.00 173.24 174.84 1hdn s ALA 65 N 1.63 3.53 -0.57 5.45 0.00 0.13 -1.26 121.76 130.67 1hdn s ALA 65 Ca 0.04 -2.47 -0.19 0.00 0.00 0.00 0.00 51.96 49.34 1hdn s ALA 65 Cb -0.20 -3.54 0.10 0.00 0.00 0.00 0.00 23.12 19.47 1hdn s ALA 65 CO 0.08 -2.36 0.67 -1.83 0.00 0.00 0.00 175.76 172.32 1hdn s GLU 66 N 2.20 3.05 0.00 0.00 -1.05 -0.51 -2.48 118.70 119.91 1hdn s GLU 66 Ca 0.13 -1.29 0.00 0.00 -0.15 0.00 0.00 54.97 53.66 1hdn s GLU 66 Cb -0.21 -4.24 0.00 0.00 -0.44 0.00 0.00 34.13 29.24 1hdn s GLU 66 CO 0.02 -1.47 0.00 0.41 0.95 0.00 0.00 175.26 175.17 1hdn n GLY 67 N 5.26 -1.17 0.33 -3.83 0.00 -1.26 -0.48 105.19 104.05 1hdn n GLY 67 Ca -0.09 -1.44 -0.17 0.00 0.00 0.00 0.00 46.02 44.32 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 1.91 -0.78 -1.35 1.61 3.07 -1.91 -3.22 114.58 113.91 1hdn h GLU 68 Ca 0.00 0.05 -0.04 0.00 -0.50 0.00 0.00 59.36 58.88 1hdn h GLU 68 Cb 0.00 0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.07 1hdn h GLU 68 CO 0.00 -0.52 0.05 -0.40 -1.40 0.00 0.00 179.01 176.74 1hdn n ASP 69 N -5.44 3.96 -0.32 1.42 5.68 -1.26 -4.63 116.55 115.97 1hdn n ASP 69 Ca -0.13 -2.25 0.04 0.00 -0.50 0.00 0.00 54.79 51.95 1hdn n ASP 69 Cb 0.33 -0.74 0.12 0.00 -1.14 0.00 0.00 41.12 39.68 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 0.44 -0.00 0.29 0.11 4.11 -1.82 -0.83 114.58 116.88 1hdn h GLU 70 Ca 0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.46 1hdn h GLU 70 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1hdn h GLU 70 CO 0.08 -0.00 -0.14 -0.56 0.07 0.00 0.00 179.01 178.46 1hdn h GLN 71 N -0.00 -0.38 -0.20 1.06 -0.00 -1.91 -3.07 115.11 110.61 1hdn h GLN 71 Ca 0.43 0.03 -0.09 0.00 -0.00 0.00 0.00 58.65 59.01 1hdn h GLN 71 Cb 0.66 0.09 -0.01 0.00 -0.00 0.00 0.00 27.48 28.21 1hdn h GLN 71 CO -0.93 -0.03 -0.28 0.87 -0.00 0.00 0.00 178.83 178.46 1hdn h LYS 72 N -0.87 0.39 0.18 0.06 1.57 -1.80 -1.55 116.57 114.56 1hdn h LYS 72 Ca -0.04 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1hdn h LYS 72 Cb 0.52 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1hdn h LYS 72 CO 0.07 0.64 -0.33 0.00 -0.57 0.00 0.00 179.45 179.26 1hdn h ALA 73 N 1.36 -0.61 -0.36 3.86 0.00 -1.24 -2.20 119.26 120.07 1hdn h ALA 73 Ca 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1hdn h ALA 73 Cb 0.68 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1hdn h ALA 73 CO 0.05 -0.89 0.11 0.28 0.00 0.00 0.00 179.25 178.79 1hdn h VAL 74 N -0.60 1.21 -0.11 0.00 2.07 -1.36 -2.93 116.25 114.53 1hdn h VAL 74 Ca 0.01 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 66.89 1hdn h VAL 74 Cb 0.60 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.30 1hdn h VAL 74 CO -0.15 0.24 -0.28 -0.08 0.02 0.00 0.00 177.57 177.31 1hdn h GLU 75 N 0.42 -0.35 -0.79 1.57 4.81 -1.18 0.23 114.58 119.30 1hdn h GLU 75 Ca 0.11 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1hdn h GLU 75 Cb 0.26 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1hdn h GLU 75 CO -0.00 -0.23 0.33 1.25 -0.73 0.00 0.00 179.01 179.63 1hdn h HIS 76 N -0.36 1.19 -0.41 0.92 2.76 -1.41 -1.56 115.15 116.27 1hdn h HIS 76 Ca 0.09 -0.08 -0.11 0.00 -2.20 0.00 0.00 60.37 58.07 1hdn h HIS 76 Cb 0.51 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.09 1hdn h HIS 76 CO -0.37 0.89 -0.18 -0.07 -1.30 0.00 0.00 177.93 176.90 1hdn h LEU 77 N 1.14 0.80 -0.36 0.26 3.38 -1.19 -2.35 115.31 116.98 1hdn h LEU 77 Ca 0.27 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1hdn h LEU 77 Cb 0.19 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1hdn h LEU 77 CO -0.03 0.97 0.20 0.58 0.09 0.00 0.00 178.44 180.26 1hdn h VAL 78 N 0.70 1.14 -0.43 1.22 2.07 -0.20 -0.27 116.25 120.48 1hdn h VAL 78 Ca 0.10 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.36 1hdn h VAL 78 Cb 0.69 0.72 -0.09 0.00 -1.52 0.00 0.00 31.29 31.08 1hdn h VAL 78 CO 0.05 0.14 -0.28 0.50 0.02 0.00 0.00 177.57 178.00 1hdn h LYS 79 N 0.46 -0.19 -0.36 1.57 3.64 -1.14 -0.80 116.57 119.74 1hdn h LYS 79 Ca 0.13 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1hdn h LYS 79 Cb 0.05 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1hdn h LYS 79 CO -0.02 -0.13 0.19 -0.07 -2.27 0.00 0.00 179.45 177.15 1hdn h LEU 80 N -0.20 0.46 -0.34 5.20 3.38 -1.15 -0.72 115.31 121.95 1hdn h LEU 80 Ca 0.19 -0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.13 1hdn h LEU 80 Cb 0.51 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 1hdn h LEU 80 CO -0.55 0.43 -0.14 0.24 0.09 0.00 0.00 178.44 178.52 1hdn h MET 81 N 0.46 -0.08 -0.31 1.13 2.86 -0.79 -1.72 114.93 116.49 1hdn h MET 81 Ca 0.13 0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.67 1hdn h MET 81 Cb 0.08 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1hdn h MET 81 CO -0.02 -0.05 -0.22 0.00 1.06 0.00 0.00 176.91 177.68 1hdn h ALA 82 N 1.20 1.04 0.00 6.32 0.00 -0.78 -2.72 119.26 124.32 1hdn h ALA 82 Ca 0.17 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1hdn h ALA 82 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1hdn h ALA 82 CO -0.39 0.58 -0.23 1.05 0.00 0.00 0.00 179.25 180.26 1hdn h GLU 83 N 0.52 0.00 -1.61 0.00 4.11 -0.98 -3.37 114.58 113.25 1hdn h GLU 83 Ca 0.08 0.00 -0.68 0.00 0.07 0.00 0.00 59.36 58.83 1hdn h GLU 83 Cb 0.67 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 29.58 1hdn h GLU 83 CO 0.05 0.00 0.26 1.28 0.07 0.00 0.00 179.01 180.67 1hdn n LEU 84 N -2.76 6.36 0.00 3.06 4.77 -0.66 -5.09 117.00 122.67 1hdn n LEU 84 Ca 0.04 -4.90 0.00 0.00 -0.03 0.00 0.00 56.01 51.12 1hdn n LEU 84 Cb 0.50 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1hdn n LEU 84 CO 0.34 1.92 0.19 1.21 -1.33 0.00 0.00 177.39 179.73