#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 0.30 -0.07 1.12 5.36 -0.39 -5.01 117.98 119.29 1hdn s PHE 2 Ca 0.00 -0.11 0.03 0.00 -0.96 0.00 0.00 56.93 55.90 1hdn s PHE 2 Cb 0.00 -0.19 0.01 0.00 -0.34 0.00 0.00 43.02 42.49 1hdn s PHE 2 CO 0.00 -0.02 -0.17 -0.65 -1.46 0.00 0.00 175.22 172.92 1hdn s GLN 3 N -0.24 2.18 -0.04 10.12 -0.21 -1.26 -0.61 119.66 129.59 1hdn s GLN 3 Ca -0.00 -0.61 0.05 0.00 0.02 0.00 0.00 55.36 54.81 1hdn s GLN 3 Cb -0.02 -1.74 -0.01 0.00 1.00 0.00 0.00 33.01 32.24 1hdn s GLN 3 CO -0.00 0.13 -0.17 -1.14 -2.12 0.00 0.00 175.29 171.98 1hdn s GLN 4 N 0.42 1.69 -0.51 2.91 0.74 -0.64 -5.00 119.66 119.27 1hdn s GLN 4 Ca -0.14 -0.61 -0.00 0.00 0.05 0.00 0.00 55.36 54.66 1hdn s GLN 4 Cb -0.16 -1.51 0.13 0.00 1.10 0.00 0.00 33.01 32.58 1hdn s GLN 4 CO 0.05 0.28 0.29 -2.00 -0.55 0.00 0.00 175.29 173.35 1hdn s GLU 5 N -0.07 2.14 0.27 1.67 2.12 -1.26 -1.19 118.70 122.38 1hdn s GLU 5 Ca -0.01 -2.28 0.11 0.00 0.36 0.00 0.00 54.97 53.16 1hdn s GLU 5 Cb -0.10 -3.53 -0.05 0.00 0.26 0.00 0.00 34.13 30.70 1hdn s GLU 5 CO 0.01 -1.10 -0.19 0.14 -0.54 0.00 0.00 175.26 173.58 1hdn s VAL 6 N 0.33 2.37 0.18 3.70 -7.23 -1.13 -4.98 120.40 113.65 1hdn s VAL 6 Ca 0.14 -2.38 0.06 0.00 -1.81 0.00 0.00 61.98 57.99 1hdn s VAL 6 Cb -0.22 -2.26 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 1hdn s VAL 6 CO -0.04 -0.43 0.09 0.42 -0.31 0.00 0.00 175.10 174.84 1hdn s THR 7 N -2.57 4.20 -0.34 5.32 -4.23 -1.26 -0.51 115.64 116.25 1hdn s THR 7 Ca 0.29 -1.25 -0.11 0.00 -1.18 0.00 0.00 61.69 59.44 1hdn s THR 7 Cb -0.04 -3.15 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1hdn s THR 7 CO 0.14 -0.14 0.19 -0.63 -0.54 0.00 0.00 174.62 173.64 1hdn s ILE 8 N -1.80 4.77 -0.12 2.99 1.01 -0.69 -4.96 121.20 122.39 1hdn s ILE 8 Ca 0.30 -0.51 0.14 0.00 0.00 0.00 0.00 60.65 60.57 1hdn s ILE 8 Cb -0.09 -3.51 -0.24 0.00 0.01 0.00 0.00 42.46 38.63 1hdn s ILE 8 CO 0.22 -0.05 0.36 0.35 0.00 0.00 0.00 174.94 175.81 1hdn n THR 9 N 5.02 1.52 -1.75 2.92 -2.24 -1.26 -1.51 114.28 116.98 1hdn n THR 9 Ca -0.13 -0.81 -0.42 0.00 -2.27 0.00 0.00 64.05 60.43 1hdn n THR 9 Cb 0.48 -0.84 -0.01 0.00 -2.10 0.00 0.00 70.33 67.86 1hdn n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hdn n ALA 10 N -2.69 2.57 -0.18 6.98 0.00 -1.26 -4.75 120.51 121.18 1hdn n ALA 10 Ca -0.26 0.37 -0.01 0.00 0.00 0.00 0.00 53.44 53.54 1hdn n ALA 10 Cb 1.10 -2.46 0.07 0.00 0.00 0.00 0.00 19.45 18.16 1hdn n ALA 10 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1hdn h PRO 11 N 4.57 0.09 0.00 0.00 0.11 -1.97 -2.17 132.00 132.63 1hdn h PRO 11 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1hdn h PRO 11 Cb 1.23 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1hdn h PRO 11 CO 0.77 0.06 -1.31 0.27 -0.21 0.00 0.00 178.00 177.59 1hdn n ASN 12 N -5.28 0.51 0.00 -2.05 2.04 -1.26 -4.45 115.26 104.76 1hdn n ASN 12 Ca 0.07 -0.10 0.00 0.00 -0.44 0.00 0.00 54.58 54.11 1hdn n ASN 12 Cb 0.31 1.10 0.00 0.00 -2.53 0.00 0.00 39.78 38.66 1hdn n ASN 12 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1hdn n GLY 13 N 1.31 2.92 2.73 4.83 0.00 -0.82 -3.50 105.19 112.67 1hdn n GLY 13 Ca -0.00 0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 7.42 0.00 0.99 4.77 -0.99 -4.54 117.00 124.65 1hdn n LEU 14 Ca 0.00 -5.01 0.00 0.00 -0.03 0.00 0.00 56.01 50.97 1hdn n LEU 14 Cb 0.00 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 39.94 1hdn n LEU 14 CO 0.00 1.90 0.00 0.00 -1.33 0.00 0.00 177.39 177.96 1hdn n HIS 15 N -0.05 -2.04 -0.02 -1.77 1.44 -1.23 -4.04 115.22 107.51 1hdn n HIS 15 Ca 0.51 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 56.14 1hdn n HIS 15 Cb 0.27 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.35 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 -1.21 0.61 0.02 0.61 1.35 -1.90 0.31 112.91 112.70 1hdn h THR 16 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1hdn h THR 16 Cb 0.00 0.61 0.00 0.00 -1.73 0.00 0.00 68.15 67.03 1hdn h THR 16 CO 0.00 0.00 -0.01 -0.09 -0.25 0.00 0.00 175.52 175.17 1hdn h ARG 17 N -0.16 -0.02 -0.90 4.72 2.43 -1.97 -1.82 114.38 116.65 1hdn h ARG 17 Ca 0.10 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1hdn h ARG 17 Cb 0.31 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.80 1hdn h ARG 17 CO -0.26 0.45 0.59 -1.35 -1.51 0.00 0.00 179.97 177.89 1hdn h PRO 18 N -0.50 0.99 -0.26 0.20 0.11 -1.77 -1.96 132.00 128.80 1hdn h PRO 18 Ca -0.00 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.94 1hdn h PRO 18 Cb 0.48 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1hdn h PRO 18 CO 0.00 0.66 -0.30 0.00 -0.21 0.00 0.00 178.00 178.15 1hdn h ALA 19 N 1.51 0.99 0.00 -0.75 0.00 -0.49 -2.40 119.26 118.12 1hdn h ALA 19 Ca 0.39 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1hdn h ALA 19 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1hdn h ALA 19 CO -0.15 0.60 -0.27 0.00 0.00 0.00 0.00 179.25 179.43 1hdn h ALA 20 N 1.21 1.18 -0.46 0.00 0.00 -0.81 -0.29 119.26 120.09 1hdn h ALA 20 Ca 0.06 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 1hdn h ALA 20 Cb 0.76 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1hdn h ALA 20 CO 0.06 0.34 -0.25 0.37 0.00 0.00 0.00 179.25 179.77 1hdn h GLN 21 N 0.00 0.98 -0.22 0.00 4.15 -1.09 -2.10 115.11 116.83 1hdn h GLN 21 Ca -0.00 -0.44 -0.01 0.00 0.77 0.00 0.00 58.65 58.97 1hdn h GLN 21 Cb 0.64 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1hdn h GLN 21 CO 0.04 1.11 0.10 0.35 -1.93 0.00 0.00 178.83 178.49 1hdn h PHE 22 N 0.84 0.32 0.15 3.99 3.57 -0.93 -2.54 116.94 122.33 1hdn h PHE 22 Ca 0.10 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1hdn h PHE 22 Cb 0.83 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.43 1hdn h PHE 22 CO 0.05 0.32 -0.39 0.28 -2.23 0.00 0.00 178.31 176.35 1hdn h VAL 23 N 0.22 0.21 -0.85 1.41 2.07 -1.09 0.12 116.25 118.33 1hdn h VAL 23 Ca 0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.67 1hdn h VAL 23 Cb 0.13 0.21 -0.10 0.00 -1.52 0.00 0.00 31.29 30.00 1hdn h VAL 23 CO -0.01 0.00 -0.50 1.17 0.02 0.00 0.00 177.57 178.25 1hdn n LYS 24 N -5.46 -0.37 0.02 1.57 0.00 -0.79 -1.97 118.16 111.15 1hdn n LYS 24 Ca -0.07 1.43 -0.02 0.00 0.00 0.00 0.00 58.31 59.65 1hdn n LYS 24 Cb 0.37 -2.11 0.24 0.00 0.00 0.00 0.00 35.03 33.53 1hdn n LYS 24 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1hdn h GLU 25 N 0.00 0.48 -0.50 1.64 4.57 -1.05 -2.83 114.58 116.89 1hdn h GLU 25 Ca 0.14 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1hdn h GLU 25 Cb 0.35 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.87 1hdn h GLU 25 CO -0.80 0.63 0.27 0.00 -1.18 0.00 0.00 179.01 177.93 1hdn h ALA 26 N 1.39 0.65 -0.09 2.92 0.00 -0.49 -2.25 119.26 121.39 1hdn h ALA 26 Ca 0.08 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1hdn h ALA 26 Cb 0.54 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1hdn h ALA 26 CO 0.03 0.18 0.18 0.87 0.00 0.00 0.00 179.25 180.51 1hdn h LYS 27 N 0.67 0.00 -0.24 0.00 1.57 -1.13 -1.82 116.57 115.62 1hdn h LYS 27 Ca 0.18 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.86 1hdn h LYS 27 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1hdn h LYS 27 CO -0.03 0.00 -0.22 0.78 -0.57 0.00 0.00 179.45 179.41 1hdn h GLY 28 N 0.00 0.63 -2.58 3.86 0.00 -1.45 -3.46 103.07 100.07 1hdn h GLY 28 Ca 0.04 -0.63 -0.46 0.00 0.00 0.00 0.00 47.33 46.27 1hdn h GLY 28 CO -0.00 0.57 0.27 -1.36 0.00 0.00 0.00 176.54 176.02 1hdn s PHE 29 N -4.36 3.43 0.22 5.60 0.08 -0.69 -4.99 117.98 117.28 1hdn s PHE 29 Ca -0.13 1.54 -0.01 0.00 0.12 0.00 0.00 56.93 58.45 1hdn s PHE 29 Cb 0.07 -2.77 0.20 0.00 -0.57 0.00 0.00 43.02 39.95 1hdn s PHE 29 CO 0.80 0.04 1.56 1.79 -0.10 0.00 0.00 175.22 179.31 1hdn h THR 30 N 2.14 1.32 -2.91 0.64 1.35 -1.89 -3.45 112.91 110.12 1hdn h THR 30 Ca -0.48 -1.71 -0.58 0.00 -0.55 0.00 0.00 66.41 63.09 1hdn h THR 30 Cb 1.18 1.71 0.16 0.00 -1.73 0.00 0.00 68.15 69.48 1hdn h THR 30 CO 0.63 0.53 -0.31 -1.20 -0.25 0.00 0.00 175.52 174.92 1hdn n SER 31 N -3.98 -0.70 -4.45 5.36 7.64 -1.26 -4.91 113.62 111.31 1hdn n SER 31 Ca -0.02 0.79 -0.44 0.00 1.01 0.00 0.00 58.87 60.22 1hdn n SER 31 Cb 0.56 -1.19 -0.05 0.00 -1.01 0.00 0.00 64.21 62.51 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 -2.04 3.15 -0.38 1.43 2.56 -1.08 -4.88 118.70 117.47 1hdn s GLU 32 Ca 0.68 -0.81 -0.21 0.00 0.00 0.00 0.00 54.97 54.63 1hdn s GLU 32 Cb -0.48 -4.13 0.01 0.00 2.00 0.00 0.00 34.13 31.53 1hdn s GLU 32 CO 0.55 -1.39 0.64 0.42 -0.56 0.00 0.00 175.26 174.92 1hdn s ILE 33 N 3.07 4.86 0.09 -3.70 1.09 -1.26 -0.36 121.20 124.99 1hdn s ILE 33 Ca 0.19 0.44 -0.15 0.00 -1.10 0.00 0.00 60.65 60.02 1hdn s ILE 33 Cb -0.18 -4.12 -0.06 0.00 -1.06 0.00 0.00 42.46 37.03 1hdn s ILE 33 CO 0.12 -0.41 0.51 -0.89 -0.10 0.00 0.00 174.94 174.18 1hdn s THR 34 N 2.76 4.88 -0.30 2.92 2.01 0.32 0.24 115.64 128.47 1hdn s THR 34 Ca 0.24 0.90 0.02 0.00 0.31 0.00 0.00 61.69 63.16 1hdn s THR 34 Cb -0.14 -3.77 0.07 0.00 0.01 0.00 0.00 72.50 68.67 1hdn s THR 34 CO 0.16 0.40 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.77 1hdn s VAL 35 N -1.29 2.41 -0.56 3.82 1.01 0.12 -1.24 120.40 124.67 1hdn s VAL 35 Ca 0.32 -1.81 -0.01 0.00 0.00 0.00 0.00 61.98 60.47 1hdn s VAL 35 Cb -0.16 -2.53 0.15 0.00 0.00 0.00 0.00 36.38 33.84 1hdn s VAL 35 CO 0.18 -0.24 0.36 -0.89 0.00 0.00 0.00 175.10 174.51 1hdn s THR 36 N 1.07 3.41 -0.97 3.92 2.01 -0.77 -0.81 115.64 123.50 1hdn s THR 36 Ca -0.02 -2.86 -0.19 0.00 0.31 0.00 0.00 61.69 58.93 1hdn s THR 36 Cb -0.20 -3.27 0.12 0.00 0.01 0.00 0.00 72.50 69.16 1hdn s THR 36 CO -0.05 -0.83 1.22 -0.94 -0.69 0.00 0.00 174.62 173.33 1hdn s SER 37 N 0.72 6.64 -0.62 3.53 1.04 -0.43 -1.95 113.70 122.62 1hdn s SER 37 Ca 0.15 -2.01 -0.16 0.00 0.48 0.00 0.00 55.95 54.42 1hdn s SER 37 Cb -0.21 -2.43 0.02 0.00 0.10 0.00 0.00 66.02 63.49 1hdn s SER 37 CO -0.03 -1.13 0.64 0.59 0.98 0.00 0.00 173.24 174.29 1hdn n ASN 38 N 6.96 -6.01 0.00 7.02 4.13 -0.42 -2.62 115.26 124.31 1hdn n ASN 38 Ca 0.27 -0.32 0.00 0.00 1.68 0.00 0.00 54.58 56.21 1hdn n ASN 38 Cb 0.49 -2.80 0.00 0.00 -1.54 0.00 0.00 39.78 35.93 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 -0.96 2.41 3.49 7.41 0.00 -1.26 -4.92 105.19 111.35 1hdn n GLY 39 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 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 3.51 -0.21 1.61 1.02 -1.08 -5.00 119.74 119.60 1hdn s LYS 40 Ca 0.00 -1.36 -0.09 0.00 0.02 0.00 0.00 55.97 54.54 1hdn s LYS 40 Cb 0.00 -4.92 -0.05 0.00 -0.52 0.00 0.00 37.83 32.34 1hdn s LYS 40 CO 0.00 -1.93 0.11 -1.54 -0.92 0.00 0.00 175.35 171.06 1hdn s SER 41 N 4.07 5.90 -0.03 2.83 1.04 -1.26 -1.31 113.70 124.93 1hdn s SER 41 Ca 0.36 0.11 -0.07 0.00 0.48 0.00 0.00 55.95 56.83 1hdn s SER 41 Cb -0.05 -2.04 0.01 0.00 0.10 0.00 0.00 66.02 64.04 1hdn s SER 41 CO -0.06 0.13 0.16 0.00 0.98 0.00 0.00 173.24 174.45 1hdn s ALA 42 N 0.63 -0.38 0.17 5.32 0.00 0.01 -4.98 121.76 122.53 1hdn s ALA 42 Ca 0.06 0.19 -0.34 0.00 0.00 0.00 0.00 51.96 51.87 1hdn s ALA 42 Cb -0.12 -0.09 -0.14 0.00 0.00 0.00 0.00 23.12 22.76 1hdn s ALA 42 CO 0.01 -0.14 1.56 0.45 0.00 0.00 0.00 175.76 177.64 1hdn n SER 43 N 2.24 3.07 -0.06 0.00 2.88 -1.26 0.14 113.62 120.62 1hdn n SER 43 Ca -0.17 1.09 0.22 0.00 -1.33 0.00 0.00 58.87 58.67 1hdn n SER 43 Cb 0.57 -1.43 0.68 0.00 -0.75 0.00 0.00 64.21 63.28 1hdn n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1hdn h ALA 44 N 5.76 2.54 0.00 -1.46 0.00 -0.50 -0.95 119.26 124.65 1hdn h ALA 44 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1hdn h ALA 44 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1hdn h ALA 44 CO 0.88 -0.72 0.00 1.63 0.00 0.00 0.00 179.25 181.04 1hdn n LYS 45 N -4.37 0.27 -3.40 0.00 5.02 -1.26 -3.93 118.16 110.50 1hdn n LYS 45 Ca 0.12 0.09 -0.44 0.00 -2.02 0.00 0.00 58.31 56.06 1hdn n LYS 45 Cb 0.68 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.12 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 -2.61 6.08 0.00 4.39 0.15 -0.36 -4.90 113.70 116.44 1hdn s SER 46 Ca 0.19 -1.49 0.00 0.00 0.70 0.00 0.00 55.95 55.35 1hdn s SER 46 Cb 0.14 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 62.29 1hdn s SER 46 CO 0.33 -0.69 0.85 -0.11 1.20 0.00 0.00 173.24 174.81 1hdn n LEU 47 N 5.17 0.00 -0.27 3.45 7.94 -1.26 -1.76 117.00 130.28 1hdn n LEU 47 Ca -0.12 0.85 0.04 0.00 -1.11 0.00 0.00 56.01 55.67 1hdn n LEU 47 Cb 0.43 -0.35 0.14 0.00 0.53 0.00 0.00 43.42 44.17 1hdn n LEU 47 CO 0.48 -0.35 0.77 0.15 -1.11 0.00 0.00 177.39 177.33 1hdn h PHE 48 N 0.00 -0.20 -0.23 1.96 3.57 -1.99 -1.00 116.94 119.05 1hdn h PHE 48 Ca 0.00 0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.62 1hdn h PHE 48 Cb 0.00 0.21 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 1hdn h PHE 48 CO -0.28 -0.29 -0.20 0.87 -2.23 0.00 0.00 178.31 176.17 1hdn h LYS 49 N 0.05 -0.20 -0.15 1.11 1.79 -1.89 -2.24 116.57 115.04 1hdn h LYS 49 Ca 0.41 0.01 -0.17 0.00 -2.18 0.00 0.00 60.65 58.72 1hdn h LYS 49 Cb 0.69 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.38 1hdn h LYS 49 CO -0.74 -0.13 -0.61 -0.07 -1.08 0.00 0.00 179.45 176.82 1hdn h LEU 50 N -0.21 0.58 -1.62 2.94 4.07 -0.36 0.64 115.31 121.35 1hdn h LEU 50 Ca 0.13 -0.33 -0.03 0.00 0.08 0.00 0.00 57.88 57.73 1hdn h LEU 50 Cb 0.41 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1hdn h LEU 50 CO -0.35 1.06 -0.09 1.56 -1.08 0.00 0.00 178.44 179.54 1hdn h GLN 51 N 0.38 0.13 0.11 1.13 4.20 -1.31 -2.87 115.11 116.88 1hdn h GLN 51 Ca -0.01 -0.02 -0.31 0.00 0.06 0.00 0.00 58.65 58.38 1hdn h GLN 51 Cb 1.17 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 1hdn h GLN 51 CO 0.11 0.23 -1.55 1.79 -0.67 0.00 0.00 178.83 178.75 1hdn h THR 52 N 0.13 1.13 -2.72 -0.54 1.35 -0.89 -3.43 112.91 107.92 1hdn h THR 52 Ca 0.03 -2.78 -0.54 0.00 -0.55 0.00 0.00 66.41 62.56 1hdn h THR 52 Cb 0.24 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 1hdn h THR 52 CO 0.01 0.81 0.99 -0.22 -0.25 0.00 0.00 175.52 176.85 1hdn s LEU 53 N -6.92 4.33 -0.55 3.87 2.96 0.17 -4.92 118.68 117.62 1hdn s LEU 53 Ca -0.09 2.26 -0.26 0.00 -0.22 0.00 0.00 54.13 55.81 1hdn s LEU 53 Cb 0.07 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.16 1hdn s LEU 53 CO 0.85 -0.85 2.14 -0.83 -1.32 0.00 0.00 176.35 176.33 1hdn s GLY 54 N 2.61 -0.12 -0.50 7.98 0.00 -1.26 -4.92 107.32 111.12 1hdn s GLY 54 Ca 0.70 -0.30 0.03 0.00 0.00 0.00 0.00 44.72 45.15 1hdn s GLY 54 CO 0.29 3.78 0.28 1.08 0.00 0.00 0.00 173.10 178.53 1hdn s LEU 55 N 10.64 3.49 0.00 0.66 1.43 -1.26 -4.90 118.68 128.73 1hdn s LEU 55 Ca 0.83 -2.93 0.00 0.00 -1.03 0.00 0.00 54.13 51.00 1hdn s LEU 55 Cb -0.15 -1.31 0.00 0.00 0.03 0.00 0.00 46.19 44.77 1hdn s LEU 55 CO 0.23 -0.23 0.00 1.07 0.23 0.00 0.00 176.35 177.66 1hdn n THR 56 N 3.17 0.00 -1.65 5.49 5.66 -1.26 -2.36 114.28 123.33 1hdn n THR 56 Ca 0.09 0.00 -0.47 0.00 -3.05 0.00 0.00 64.05 60.63 1hdn n THR 56 Cb 0.34 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.08 1hdn n THR 56 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1hdn n GLN 57 N 0.00 2.22 0.00 1.09 7.27 -1.23 -1.72 117.38 125.02 1hdn n GLN 57 Ca 0.00 0.79 0.00 0.00 0.07 0.00 0.00 57.00 57.86 1hdn n GLN 57 Cb 0.00 -2.77 0.00 0.00 2.41 0.00 0.00 30.24 29.88 1hdn n GLN 57 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1hdn n GLY 58 N 4.73 2.42 3.76 1.69 0.00 -0.57 -5.03 105.19 112.19 1hdn n GLY 58 Ca 0.24 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.52 2.91 -0.25 2.61 2.01 -0.70 -4.81 115.64 114.89 1hdn s THR 59 Ca 0.00 0.84 -0.00 0.00 0.31 0.00 0.00 61.69 62.83 1hdn s THR 59 Cb 0.00 -3.53 0.03 0.00 0.01 0.00 0.00 72.50 69.01 1hdn s THR 59 CO 0.00 0.17 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.32 1hdn s VAL 60 N -0.62 2.63 -0.52 3.82 1.01 -1.26 -1.70 120.40 123.76 1hdn s VAL 60 Ca 0.52 -1.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.28 1hdn s VAL 60 Cb -0.39 -2.36 0.14 0.00 0.00 0.00 0.00 36.38 33.77 1hdn s VAL 60 CO 0.46 0.17 0.36 0.54 0.00 0.00 0.00 175.10 176.64 1hdn s VAL 61 N 1.27 3.93 -0.59 2.92 0.11 0.34 -1.31 120.40 127.06 1hdn s VAL 61 Ca -0.01 -2.21 -0.27 0.00 -2.93 0.00 0.00 61.98 56.55 1hdn s VAL 61 Cb -0.17 -3.59 -0.01 0.00 -1.53 0.00 0.00 36.38 31.08 1hdn s VAL 61 CO -0.05 -0.80 1.70 -0.89 -3.33 0.00 0.00 175.10 171.73 1hdn s THR 62 N 0.85 3.49 -0.39 5.04 2.01 -0.82 -2.83 115.64 122.98 1hdn s THR 62 Ca 0.10 0.33 -0.18 0.00 0.31 0.00 0.00 61.69 62.25 1hdn s THR 62 Cb -0.23 -4.13 0.01 0.00 0.01 0.00 0.00 72.50 68.17 1hdn s THR 62 CO -0.03 -1.03 0.51 -0.63 -0.69 0.00 0.00 174.62 172.75 1hdn s ILE 63 N 7.94 5.00 -0.39 1.82 1.01 -0.33 -1.85 121.20 134.40 1hdn s ILE 63 Ca 0.62 0.09 0.03 0.00 0.00 0.00 0.00 60.65 61.39 1hdn s ILE 63 Cb -0.13 -4.03 0.11 0.00 0.01 0.00 0.00 42.46 38.43 1hdn s ILE 63 CO 0.22 -0.35 0.14 -0.55 0.00 0.00 0.00 174.94 174.40 1hdn s SER 64 N 1.83 4.35 -0.28 3.58 0.15 -0.37 -1.63 113.70 121.32 1hdn s SER 64 Ca 0.17 -2.34 -0.08 0.00 0.70 0.00 0.00 55.95 54.40 1hdn s SER 64 Cb -0.16 -1.39 -0.02 0.00 -1.71 0.00 0.00 66.02 62.74 1hdn s SER 64 CO 0.15 -0.33 0.11 0.00 1.20 0.00 0.00 173.24 174.37 1hdn s ALA 65 N 0.67 3.23 -0.58 5.45 0.00 0.22 -0.53 121.76 130.22 1hdn s ALA 65 Ca 0.13 -1.26 0.04 0.00 0.00 0.00 0.00 51.96 50.87 1hdn s ALA 65 Cb -0.21 -2.24 0.14 0.00 0.00 0.00 0.00 23.12 20.81 1hdn s ALA 65 CO -0.08 -0.70 0.33 -1.83 0.00 0.00 0.00 175.76 173.48 1hdn s GLU 66 N 1.61 2.12 0.00 0.00 -1.05 0.51 -1.26 118.70 120.63 1hdn s GLU 66 Ca 0.05 -2.85 0.00 0.00 -0.15 0.00 0.00 54.97 52.03 1hdn s GLU 66 Cb -0.16 -3.34 0.00 0.00 -0.44 0.00 0.00 34.13 30.19 1hdn s GLU 66 CO 0.05 -1.17 0.00 0.41 0.95 0.00 0.00 175.26 175.51 1hdn n GLY 67 N 2.75 0.94 0.32 -3.83 0.00 -1.26 -2.63 105.19 101.48 1hdn n GLY 67 Ca 0.10 -0.72 0.04 0.00 0.00 0.00 0.00 46.02 45.43 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 0.00 0.64 -1.26 1.61 3.07 -1.96 -3.19 114.58 113.49 1hdn h GLU 68 Ca 0.00 -0.04 -0.68 0.00 -0.50 0.00 0.00 59.36 58.14 1hdn h GLU 68 Cb 0.00 -0.14 -0.32 0.00 -0.84 0.00 0.00 28.75 27.45 1hdn h GLU 68 CO 0.00 0.42 0.55 -0.40 -1.40 0.00 0.00 179.01 178.18 1hdn n ASP 69 N -4.46 7.02 0.23 1.42 5.68 -1.26 -4.81 116.55 120.36 1hdn n ASP 69 Ca 0.05 -3.79 -0.13 0.00 -0.50 0.00 0.00 54.79 50.41 1hdn n ASP 69 Cb 0.07 -0.87 -0.07 0.00 -1.14 0.00 0.00 41.12 39.11 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 2.33 -0.72 -0.42 0.11 -0.00 -1.82 -0.46 114.58 113.60 1hdn h GLU 70 Ca 0.54 0.05 -0.02 0.00 -0.00 0.00 0.00 59.36 59.93 1hdn h GLU 70 Cb 0.72 0.16 -0.02 0.00 -0.00 0.00 0.00 28.75 29.62 1hdn h GLU 70 CO 1.37 -0.48 0.19 1.96 -0.00 0.00 0.00 179.01 182.06 1hdn h GLN 71 N -0.74 0.62 -0.54 1.06 4.20 -1.90 -2.97 115.11 114.84 1hdn h GLN 71 Ca -0.05 -0.10 0.11 0.00 0.06 0.00 0.00 58.65 58.67 1hdn h GLN 71 Cb 0.63 -0.11 -0.10 0.00 0.30 0.00 0.00 27.48 28.20 1hdn h GLN 71 CO -0.01 0.55 -0.14 -0.22 -0.67 0.00 0.00 178.83 178.33 1hdn h LYS 72 N 0.54 -0.01 0.52 1.46 3.64 -1.92 -1.12 116.57 119.68 1hdn h LYS 72 Ca 0.14 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1hdn h LYS 72 Cb 0.15 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1hdn h LYS 72 CO -0.02 -0.01 -0.25 0.00 -2.27 0.00 0.00 179.45 176.91 1hdn h ALA 73 N 1.52 -0.70 -0.61 5.00 0.00 -1.06 -2.81 119.26 120.60 1hdn h ALA 73 Ca 0.26 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1hdn h ALA 73 Cb 0.40 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1hdn h ALA 73 CO -0.56 -0.83 0.26 0.28 0.00 0.00 0.00 179.25 178.40 1hdn h VAL 74 N -0.82 1.21 -0.37 0.00 2.07 -1.40 -1.51 116.25 115.43 1hdn h VAL 74 Ca -0.07 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 66.82 1hdn h VAL 74 Cb 0.59 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1hdn h VAL 74 CO 0.12 0.26 0.20 -0.08 0.02 0.00 0.00 177.57 178.09 1hdn h GLU 75 N 0.87 0.40 -0.02 1.57 4.81 -1.12 0.27 114.58 121.36 1hdn h GLU 75 Ca 0.21 -0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.25 1hdn h GLU 75 Cb 0.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1hdn h GLU 75 CO -0.02 0.26 -0.75 1.25 -0.73 0.00 0.00 179.01 179.03 1hdn h HIS 76 N 0.41 0.22 -0.05 0.92 2.76 -1.19 -0.50 115.15 117.73 1hdn h HIS 76 Ca 0.15 -0.10 -0.22 0.00 -2.20 0.00 0.00 60.37 58.00 1hdn h HIS 76 Cb 0.03 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 28.97 1hdn h HIS 76 CO -0.09 0.84 -0.87 -0.07 -1.30 0.00 0.00 177.93 176.44 1hdn h LEU 77 N 0.10 0.64 -0.77 0.26 3.38 -0.78 -2.03 115.31 116.12 1hdn h LEU 77 Ca -0.02 -0.47 -0.08 0.00 0.09 0.00 0.00 57.88 57.39 1hdn h LEU 77 Cb 1.31 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 1hdn h LEU 77 CO 0.11 1.26 0.04 0.58 0.09 0.00 0.00 178.44 180.51 1hdn h VAL 78 N 0.32 1.26 -0.23 1.22 2.07 -0.22 0.29 116.25 120.96 1hdn h VAL 78 Ca -0.07 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.44 1hdn h VAL 78 Cb 1.49 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.96 1hdn h VAL 78 CO 0.16 0.38 -0.50 0.50 0.02 0.00 0.00 177.57 178.14 1hdn h LYS 79 N 0.90 -0.47 -0.26 1.57 3.64 -1.09 -1.52 116.57 119.34 1hdn h LYS 79 Ca 0.17 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1hdn h LYS 79 Cb 0.48 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1hdn h LYS 79 CO 0.02 -0.31 0.11 -0.07 -2.27 0.00 0.00 179.45 176.93 1hdn h LEU 80 N -0.49 0.15 -0.72 5.20 4.07 -1.07 -1.73 115.31 120.73 1hdn h LEU 80 Ca 0.07 0.02 0.13 0.00 0.08 0.00 0.00 57.88 58.18 1hdn h LEU 80 Cb 0.64 -0.01 -0.09 0.00 1.08 0.00 0.00 40.66 42.28 1hdn h LEU 80 CO -0.48 0.12 0.28 -0.03 -1.08 0.00 0.00 178.44 177.26 1hdn h MET 81 N 0.25 0.43 0.00 1.13 4.05 -0.33 -1.83 114.93 118.63 1hdn h MET 81 Ca 0.11 -0.03 -0.09 0.00 -0.28 0.00 0.00 59.70 59.41 1hdn h MET 81 Cb 0.05 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.74 1hdn h MET 81 CO -0.09 0.28 -0.43 0.00 0.23 0.00 0.00 176.91 176.90 1hdn h ALA 82 N 1.52 0.82 0.00 0.39 0.00 -0.77 -3.29 119.26 117.93 1hdn h ALA 82 Ca 0.39 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1hdn h ALA 82 Cb 0.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1hdn h ALA 82 CO -0.38 0.54 -0.57 0.93 0.00 0.00 0.00 179.25 179.77 1hdn h GLU 83 N 0.00 0.00 -6.06 0.00 5.08 -0.78 -3.49 114.58 109.34 1hdn h GLU 83 Ca -0.00 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.75 1hdn h GLU 83 Cb 1.15 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.35 1hdn h GLU 83 CO 0.06 0.16 -0.22 -0.51 -1.00 0.00 0.00 179.01 177.50 1hdn s LEU 84 N -6.00 4.41 0.00 1.33 1.43 -0.74 -5.08 118.68 114.03 1hdn s LEU 84 Ca 0.03 0.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.01 1hdn s LEU 84 Cb 0.07 -2.77 0.00 0.00 0.03 0.00 0.00 46.19 43.52 1hdn s LEU 84 CO 0.74 0.25 0.00 -0.62 0.23 0.00 0.00 176.35 176.95