#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 1.46 -0.00 2.03 5.36 0.85 -5.02 117.98 122.66 1hdn s PHE 2 Ca 0.00 -0.86 0.07 0.00 -0.96 0.00 0.00 56.93 55.18 1hdn s PHE 2 Cb 0.00 -1.21 -0.02 0.00 -0.34 0.00 0.00 43.02 41.45 1hdn s PHE 2 CO 0.00 -0.55 -0.21 1.14 -1.46 0.00 0.00 175.22 174.13 1hdn s GLN 3 N 1.71 1.67 -0.00 10.12 -2.07 -1.26 0.29 119.66 130.12 1hdn s GLN 3 Ca 0.02 -0.80 0.02 0.00 -1.82 0.00 0.00 55.36 52.78 1hdn s GLN 3 Cb -0.14 -1.65 -0.00 0.00 -1.09 0.00 0.00 33.01 30.13 1hdn s GLN 3 CO -0.08 0.45 -0.06 -0.65 -1.32 0.00 0.00 175.29 173.64 1hdn s GLN 4 N -0.63 0.46 -0.24 9.60 -0.21 -0.50 -5.00 119.66 123.13 1hdn s GLN 4 Ca 0.08 -0.20 -0.25 0.00 0.02 0.00 0.00 55.36 55.02 1hdn s GLN 4 Cb -0.08 -0.44 -0.00 0.00 1.00 0.00 0.00 33.01 33.48 1hdn s GLN 4 CO -0.00 0.12 0.83 -2.00 -2.12 0.00 0.00 175.29 172.11 1hdn s GLU 5 N -0.11 4.18 -0.13 2.91 2.12 -1.26 -1.03 118.70 125.38 1hdn s GLU 5 Ca 0.02 0.94 0.00 0.00 0.36 0.00 0.00 54.97 56.30 1hdn s GLU 5 Cb -0.02 -3.64 0.02 0.00 0.26 0.00 0.00 34.13 30.74 1hdn s GLU 5 CO -0.00 -0.52 -0.12 0.08 -0.54 0.00 0.00 175.26 174.16 1hdn s VAL 6 N 2.84 1.39 -0.04 3.70 1.01 -0.49 -4.97 120.40 123.84 1hdn s VAL 6 Ca 0.35 -0.53 -0.26 0.00 0.00 0.00 0.00 61.98 61.53 1hdn s VAL 6 Cb -0.15 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 1hdn s VAL 6 CO 0.07 0.43 0.83 -0.89 0.00 0.00 0.00 175.10 175.54 1hdn s THR 7 N 1.41 4.96 -0.26 3.92 2.01 -1.26 -0.39 115.64 126.03 1hdn s THR 7 Ca 0.02 1.73 -0.07 0.00 0.31 0.00 0.00 61.69 63.68 1hdn s THR 7 Cb -0.13 -4.17 -0.01 0.00 0.01 0.00 0.00 72.50 68.20 1hdn s THR 7 CO -0.08 0.20 0.06 -0.63 -0.69 0.00 0.00 174.62 173.48 1hdn s ILE 8 N 0.96 4.05 -1.10 1.82 -1.09 0.58 -4.98 121.20 121.44 1hdn s ILE 8 Ca 0.44 -0.43 0.10 0.00 -2.23 0.00 0.00 60.65 58.53 1hdn s ILE 8 Cb -0.19 -2.97 0.04 0.00 -1.58 0.00 0.00 42.46 37.77 1hdn s ILE 8 CO 0.22 0.24 0.73 0.35 -1.23 0.00 0.00 174.94 175.26 1hdn n THR 9 N 4.89 0.00 -1.87 2.92 -2.24 -1.25 -0.89 114.28 115.84 1hdn n THR 9 Ca -0.16 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.75 1hdn n THR 9 Cb 0.50 1.17 -0.03 0.00 -2.10 0.00 0.00 70.33 69.87 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 -1.07 3.62 0.19 6.98 0.00 -1.26 -4.37 121.76 125.86 1hdn s ALA 10 Ca 0.10 1.13 -0.11 0.00 0.00 0.00 0.00 51.96 53.08 1hdn s ALA 10 Cb 0.08 -3.77 0.17 0.00 0.00 0.00 0.00 23.12 19.60 1hdn s ALA 10 CO 0.18 -1.40 1.81 -1.00 0.00 0.00 0.00 175.76 175.36 1hdn h PRO 11 N 9.64 0.64 -0.21 0.00 0.13 -1.96 -2.28 132.00 137.96 1hdn h PRO 11 Ca -0.44 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 64.54 1hdn h PRO 11 Cb 1.20 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1hdn h PRO 11 CO 0.94 0.43 -0.37 -2.95 -0.23 0.00 0.00 178.00 175.82 1hdn h ASN 12 N 0.66 0.49 -3.68 1.44 7.08 -1.95 -3.39 115.58 116.22 1hdn h ASN 12 Ca 0.25 -0.20 0.00 0.00 -3.08 0.00 0.00 56.30 53.27 1hdn h ASN 12 Cb 0.10 -0.13 -0.00 0.00 -2.08 0.00 0.00 38.32 36.20 1hdn h ASN 12 CO -0.14 0.82 -0.00 0.61 -2.08 0.00 0.00 177.43 176.64 1hdn n GLY 13 N -0.14 -1.99 3.11 9.14 0.00 -0.90 -4.53 105.19 109.88 1hdn n GLY 13 Ca -0.01 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 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 5.93 -4.97 0.99 4.32 -0.49 -4.89 117.00 117.89 1hdn n LEU 14 Ca 0.00 -4.00 -0.18 0.00 -0.02 0.00 0.00 56.01 51.81 1hdn n LEU 14 Cb 0.00 -1.69 -0.00 0.00 -1.62 0.00 0.00 43.42 40.11 1hdn n LEU 14 CO 0.00 0.62 0.10 -1.38 -1.22 0.00 0.00 177.39 175.51 1hdn s HIS 15 N 3.82 2.78 0.00 -1.77 -3.43 -1.26 -4.23 115.29 111.20 1hdn s HIS 15 Ca 0.51 -0.43 0.00 0.00 -0.80 0.00 0.00 55.06 54.34 1hdn s HIS 15 Cb 0.10 -2.32 0.00 0.00 -1.43 0.00 0.00 32.58 28.93 1hdn s HIS 15 CO -0.01 -0.33 0.00 0.25 -2.00 0.00 0.00 174.74 172.65 1hdn n THR 16 N -1.76 0.00 0.03 -5.38 -2.24 -1.26 -0.72 114.28 102.95 1hdn n THR 16 Ca 0.07 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.66 1hdn n THR 16 Cb 0.60 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.70 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 0.00 0.36 -0.69 -0.78 2.43 -1.98 -1.21 114.38 112.51 1hdn h ARG 17 Ca 0.00 -0.49 0.15 0.00 -0.81 0.00 0.00 59.98 58.83 1hdn h ARG 17 Cb 0.00 0.16 -0.11 0.00 -0.42 0.00 0.00 29.97 29.60 1hdn h ARG 17 CO 0.00 1.18 0.09 -1.35 -1.51 0.00 0.00 179.97 178.38 1hdn h PRO 18 N -0.23 0.19 0.47 0.20 0.11 -1.79 0.15 132.00 131.10 1hdn h PRO 18 Ca -0.11 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.96 1hdn h PRO 18 Cb 1.50 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.57 1hdn h PRO 18 CO 0.14 0.12 -0.23 0.00 -0.21 0.00 0.00 178.00 177.83 1hdn h ALA 19 N 1.60 -0.63 -0.94 -0.75 0.00 -0.92 -2.80 119.26 114.82 1hdn h ALA 19 Ca 0.38 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.25 1hdn h ALA 19 Cb 0.64 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.60 1hdn h ALA 19 CO -0.54 -0.83 0.58 0.00 0.00 0.00 0.00 179.25 178.46 1hdn h ALA 20 N -0.15 1.40 0.17 0.00 0.00 -0.75 -1.20 119.26 118.73 1hdn h ALA 20 Ca -0.06 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1hdn h ALA 20 Cb 0.50 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1hdn h ALA 20 CO 0.11 0.18 -0.21 1.96 0.00 0.00 0.00 179.25 181.29 1hdn h GLN 21 N 0.93 -0.41 -0.21 0.00 4.20 -0.63 0.84 115.11 119.84 1hdn h GLN 21 Ca 0.46 0.03 -0.00 0.00 0.06 0.00 0.00 58.65 59.20 1hdn h GLN 21 Cb 0.44 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1hdn h GLN 21 CO -0.26 -0.27 0.12 0.35 -0.67 0.00 0.00 178.83 178.10 1hdn h PHE 22 N -0.42 0.28 0.06 2.96 3.57 -1.16 -1.46 116.94 120.76 1hdn h PHE 22 Ca 0.01 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.52 1hdn h PHE 22 Cb 0.41 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1hdn h PHE 22 CO -0.17 0.24 -0.13 0.28 -2.23 0.00 0.00 178.31 176.30 1hdn h VAL 23 N 0.25 0.70 -0.24 1.41 2.07 -1.16 -0.40 116.25 118.87 1hdn h VAL 23 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1hdn h VAL 23 Cb 0.04 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1hdn h VAL 23 CO -0.01 0.00 0.15 0.50 0.02 0.00 0.00 177.57 178.23 1hdn h LYS 24 N -0.24 0.32 -0.59 1.57 3.11 -0.60 0.13 116.57 120.27 1hdn h LYS 24 Ca 0.03 -0.02 -0.03 0.00 -2.81 0.00 0.00 60.65 57.82 1hdn h LYS 24 Cb 0.27 -0.07 -0.03 0.00 -1.00 0.00 0.00 32.23 31.41 1hdn h LYS 24 CO -0.09 0.23 0.27 1.49 -2.81 0.00 0.00 179.45 178.55 1hdn h GLU 25 N 0.31 0.86 -0.67 1.90 4.57 -1.07 -1.22 114.58 119.26 1hdn h GLU 25 Ca 0.09 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1hdn h GLU 25 Cb -0.01 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.40 1hdn h GLU 25 CO -0.02 0.71 0.41 0.00 -1.18 0.00 0.00 179.01 178.93 1hdn h ALA 26 N 1.11 0.85 0.00 2.92 0.00 -0.95 -0.99 119.26 122.20 1hdn h ALA 26 Ca 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1hdn h ALA 26 Cb 0.14 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1hdn h ALA 26 CO -0.02 0.32 -0.02 0.87 0.00 0.00 0.00 179.25 180.40 1hdn h LYS 27 N 0.91 0.00 0.01 0.00 1.79 -0.32 -2.35 116.57 116.61 1hdn h LYS 27 Ca 0.24 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.51 1hdn h LYS 27 Cb -0.04 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.59 1hdn h LYS 27 CO -0.05 0.02 -0.94 0.78 -1.08 0.00 0.00 179.45 178.18 1hdn h GLY 28 N 0.21 0.05 -5.69 3.86 0.00 0.02 -3.46 103.07 98.06 1hdn h GLY 28 Ca -0.00 -0.10 -0.58 0.00 0.00 0.00 0.00 47.33 46.64 1hdn h GLY 28 CO 0.00 0.09 0.17 -1.36 0.00 0.00 0.00 176.54 175.44 1hdn s PHE 29 N -2.90 3.42 -1.57 5.60 0.08 -0.89 -4.95 117.98 116.77 1hdn s PHE 29 Ca -0.00 1.05 0.17 0.00 0.12 0.00 0.00 56.93 58.27 1hdn s PHE 29 Cb 0.10 -2.84 0.92 0.00 -0.57 0.00 0.00 43.02 40.63 1hdn s PHE 29 CO 0.82 -0.14 1.50 0.25 -0.10 0.00 0.00 175.22 177.55 1hdn n THR 30 N 4.53 0.37 -3.52 0.64 -2.24 -1.26 -4.73 114.28 108.07 1hdn n THR 30 Ca -0.00 0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.52 1hdn n THR 30 Cb 0.50 -0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 67.86 1hdn n THR 30 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1hdn s SER 31 N -2.43 6.68 -0.04 3.42 0.01 -1.26 -4.75 113.70 115.32 1hdn s SER 31 Ca 0.19 0.86 -0.23 0.00 1.31 0.00 0.00 55.95 58.07 1hdn s SER 31 Cb 0.12 -2.20 -0.04 0.00 0.21 0.00 0.00 66.02 64.10 1hdn s SER 31 CO 0.25 0.14 0.70 -0.70 0.41 0.00 0.00 173.24 174.04 1hdn s GLU 32 N -1.97 4.43 -0.19 12.44 2.56 0.50 -4.91 118.70 131.57 1hdn s GLU 32 Ca 0.35 0.89 0.01 0.00 0.00 0.00 0.00 54.97 56.22 1hdn s GLU 32 Cb -0.14 -3.42 0.03 0.00 2.00 0.00 0.00 34.13 32.59 1hdn s GLU 32 CO 0.19 0.13 -0.18 0.42 -0.56 0.00 0.00 175.26 175.26 1hdn s ILE 33 N 0.57 1.98 -0.19 -3.70 -1.09 -1.26 -1.80 121.20 115.71 1hdn s ILE 33 Ca 0.37 -0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 57.78 1hdn s ILE 33 Cb -0.18 -1.85 -0.01 0.00 -1.58 0.00 0.00 42.46 38.84 1hdn s ILE 33 CO 0.19 0.44 -0.09 -0.89 -1.23 0.00 0.00 174.94 173.36 1hdn s THR 34 N 1.30 3.12 -0.83 2.92 2.01 0.97 -1.91 115.64 123.23 1hdn s THR 34 Ca 0.03 -0.60 -0.15 0.00 0.31 0.00 0.00 61.69 61.29 1hdn s THR 34 Cb -0.14 -2.38 0.21 0.00 0.01 0.00 0.00 72.50 70.20 1hdn s THR 34 CO -0.11 0.47 0.79 -0.69 -0.69 0.00 0.00 174.62 174.39 1hdn s VAL 35 N 1.09 5.52 -0.38 3.82 1.01 0.84 -0.75 120.40 131.55 1hdn s VAL 35 Ca 0.00 -2.35 -0.16 0.00 0.00 0.00 0.00 61.98 59.48 1hdn s VAL 35 Cb -0.15 -4.49 0.00 0.00 0.00 0.00 0.00 36.38 31.74 1hdn s VAL 35 CO -0.02 -1.07 0.37 -0.89 0.00 0.00 0.00 175.10 173.50 1hdn s THR 36 N 0.46 5.16 -0.47 3.92 2.01 -1.08 -0.85 115.64 124.78 1hdn s THR 36 Ca 0.19 -0.19 -0.04 0.00 0.31 0.00 0.00 61.69 61.96 1hdn s THR 36 Cb -0.10 -3.90 0.12 0.00 0.01 0.00 0.00 72.50 68.63 1hdn s THR 36 CO -0.08 -0.23 0.29 -0.55 -0.69 0.00 0.00 174.62 173.36 1hdn s SER 37 N 1.75 5.37 -1.00 3.53 0.15 0.29 -2.25 113.70 121.54 1hdn s SER 37 Ca 0.11 -2.18 -0.18 0.00 0.70 0.00 0.00 55.95 54.40 1hdn s SER 37 Cb -0.17 -1.88 0.02 0.00 -1.71 0.00 0.00 66.02 62.29 1hdn s SER 37 CO 0.12 -0.54 0.62 -0.46 1.20 0.00 0.00 173.24 174.18 1hdn n ASN 38 N 4.43 -4.28 0.00 5.45 0.23 -1.26 -1.19 115.26 118.64 1hdn n ASN 38 Ca -0.01 -1.12 0.00 0.00 -0.53 0.00 0.00 54.58 52.92 1hdn n ASN 38 Cb 0.41 -1.53 0.00 0.00 -2.08 0.00 0.00 39.78 36.57 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 -1.85 2.31 3.62 4.83 0.00 -1.26 -4.99 105.19 107.84 1hdn n GLY 39 Ca -0.21 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 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 3.48 -0.42 1.61 -0.14 -0.33 -4.95 119.74 118.99 1hdn s LYS 40 Ca 0.00 1.99 -0.09 0.00 -1.36 0.00 0.00 55.97 56.51 1hdn s LYS 40 Cb 0.00 -4.25 0.08 0.00 -1.68 0.00 0.00 37.83 31.98 1hdn s LYS 40 CO 0.00 -1.70 0.25 -1.54 -0.76 0.00 0.00 175.35 171.61 1hdn s SER 41 N 6.48 5.62 0.06 2.83 1.04 -1.26 -0.55 113.70 127.91 1hdn s SER 41 Ca 0.90 -1.52 -0.11 0.00 0.48 0.00 0.00 55.95 55.71 1hdn s SER 41 Cb -0.32 -1.98 -0.06 0.00 0.10 0.00 0.00 66.02 63.77 1hdn s SER 41 CO 0.35 -0.53 0.39 0.00 0.98 0.00 0.00 173.24 174.43 1hdn s ALA 42 N 1.41 3.73 -0.12 5.32 0.00 -0.03 -4.91 121.76 127.17 1hdn s ALA 42 Ca 0.03 -0.36 -0.29 0.00 0.00 0.00 0.00 51.96 51.34 1hdn s ALA 42 Cb -0.23 -2.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 1hdn s ALA 42 CO 0.02 0.55 1.01 0.45 0.00 0.00 0.00 175.76 177.79 1hdn s SER 43 N -1.61 7.23 0.58 0.00 0.15 -1.26 -0.11 113.70 118.67 1hdn s SER 43 Ca 0.31 1.52 0.27 0.00 0.70 0.00 0.00 55.95 58.74 1hdn s SER 43 Cb -0.14 -2.55 1.65 0.00 -1.71 0.00 0.00 66.02 63.26 1hdn s SER 43 CO 0.17 -0.47 2.17 0.00 1.20 0.00 0.00 173.24 176.31 1hdn h ALA 44 N 7.13 1.76 -0.14 5.45 0.00 -1.76 -3.26 119.26 128.44 1hdn h ALA 44 Ca -0.30 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1hdn h ALA 44 Cb 1.14 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1hdn h ALA 44 CO 0.87 -0.15 0.07 1.63 0.00 0.00 0.00 179.25 181.68 1hdn n LYS 45 N -3.97 1.29 -3.63 0.00 5.02 -1.26 -4.22 118.16 111.38 1hdn n LYS 45 Ca -0.01 -0.46 -0.16 0.00 -2.02 0.00 0.00 58.31 55.66 1hdn n LYS 45 Cb 0.20 -1.29 -0.14 0.00 -0.02 0.00 0.00 35.03 33.78 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 0.46 0.69 0.17 4.39 0.15 -1.23 -4.89 113.70 113.43 1hdn s SER 46 Ca 0.09 0.35 -0.15 0.00 0.70 0.00 0.00 55.95 56.94 1hdn s SER 46 Cb 0.07 0.48 0.10 0.00 -1.71 0.00 0.00 66.02 64.95 1hdn s SER 46 CO 0.02 -0.26 1.76 0.25 1.20 0.00 0.00 173.24 176.21 1hdn h LEU 47 N 8.32 0.20 -0.16 3.45 5.85 -1.92 -1.49 115.31 129.57 1hdn h LEU 47 Ca -0.14 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.66 1hdn h LEU 47 Cb 1.12 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.12 1hdn h LEU 47 CO 0.16 0.15 -0.14 0.15 -0.34 0.00 0.00 178.44 178.43 1hdn h PHE 48 N 0.34 -0.34 -0.73 1.25 3.57 -1.97 -1.00 116.94 118.05 1hdn h PHE 48 Ca 0.19 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.75 1hdn h PHE 48 Cb 0.15 0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 1hdn h PHE 48 CO -0.14 -0.20 0.45 0.87 -2.23 0.00 0.00 178.31 177.06 1hdn h LYS 49 N -0.15 0.85 0.21 1.11 1.57 -1.74 0.13 116.57 118.54 1hdn h LYS 49 Ca 0.10 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1hdn h LYS 49 Cb 0.30 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1hdn h LYS 49 CO -0.25 0.56 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.02 1hdn h LEU 50 N 0.87 -0.23 -1.50 2.94 4.07 -1.03 -2.87 115.31 117.56 1hdn h LEU 50 Ca 0.30 -0.14 -0.05 0.00 0.08 0.00 0.00 57.88 58.07 1hdn h LEU 50 Cb 0.05 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1hdn h LEU 50 CO -0.12 0.00 -0.25 1.56 -1.08 0.00 0.00 178.44 178.55 1hdn h GLN 51 N -0.47 0.00 0.00 1.13 4.20 -0.84 -1.65 115.11 117.47 1hdn h GLN 51 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1hdn h GLN 51 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1hdn h GLN 51 CO 0.05 0.25 0.00 0.00 -0.67 0.00 0.00 178.83 178.46 1hdn h THR 52 N 0.00 0.00 -3.33 -0.54 1.03 -0.80 -3.46 112.91 105.82 1hdn h THR 52 Ca -0.00 -0.48 -0.67 0.00 -0.01 0.00 0.00 66.41 65.25 1hdn h THR 52 Cb 0.52 1.46 -0.16 0.00 -1.07 0.00 0.00 68.15 68.90 1hdn h THR 52 CO 0.03 0.00 -0.63 -0.22 -0.01 0.00 0.00 175.52 174.70 1hdn s LEU 53 N -4.61 3.53 -0.81 0.00 2.96 -0.62 -5.02 118.68 114.10 1hdn s LEU 53 Ca 0.10 0.09 -0.22 0.00 -0.22 0.00 0.00 54.13 53.87 1hdn s LEU 53 Cb 0.12 -1.82 -0.15 0.00 0.50 0.00 0.00 46.19 44.84 1hdn s LEU 53 CO 0.59 0.32 1.92 0.61 -1.32 0.00 0.00 176.35 178.47 1hdn n GLY 54 N 2.50 2.39 2.94 7.98 0.00 -1.26 -4.83 105.19 114.91 1hdn n GLY 54 Ca -0.18 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 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 8.21 6.44 0.00 0.99 4.32 -1.26 -4.88 117.00 130.83 1hdn n LEU 55 Ca 0.49 -4.37 0.00 0.00 -0.02 0.00 0.00 56.01 52.11 1hdn n LEU 55 Cb 0.41 -1.58 0.00 0.00 -1.62 0.00 0.00 43.42 40.63 1hdn n LEU 55 CO 1.00 1.10 0.00 1.07 -1.22 0.00 0.00 177.39 179.35 1hdn n THR 56 N 4.39 0.00 -1.89 -5.08 5.66 -1.26 -1.39 114.28 114.71 1hdn n THR 56 Ca 0.45 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 61.06 1hdn n THR 56 Cb 0.39 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.14 1hdn n THR 56 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hdn s GLN 57 N 1.24 2.65 0.00 1.09 -2.07 -0.98 -3.01 119.66 118.59 1hdn s GLN 57 Ca 0.00 1.04 0.00 0.00 -1.82 0.00 0.00 55.36 54.58 1hdn s GLN 57 Cb 0.00 -4.40 0.00 0.00 -1.09 0.00 0.00 33.01 27.52 1hdn s GLN 57 CO 0.00 -2.67 0.00 0.41 -1.32 0.00 0.00 175.29 171.71 1hdn n GLY 58 N 5.73 0.97 3.40 2.60 0.00 -0.29 -4.96 105.19 112.63 1hdn n GLY 58 Ca 0.26 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.66 4.38 -0.39 2.61 2.01 -0.07 -4.96 115.64 116.56 1hdn s THR 59 Ca 0.00 -0.57 -0.18 0.00 0.31 0.00 0.00 61.69 61.26 1hdn s THR 59 Cb 0.00 -3.27 0.01 0.00 0.01 0.00 0.00 72.50 69.25 1hdn s THR 59 CO 0.00 0.04 0.48 0.54 -0.69 0.00 0.00 174.62 174.99 1hdn s VAL 60 N 1.57 5.04 -0.22 3.82 0.11 -1.26 -0.30 120.40 129.14 1hdn s VAL 60 Ca 0.04 -0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 1hdn s VAL 60 Cb -0.17 -4.02 0.05 0.00 -1.53 0.00 0.00 36.38 30.71 1hdn s VAL 60 CO 0.05 -0.35 -0.11 0.54 -3.33 0.00 0.00 175.10 171.90 1hdn s VAL 61 N 2.30 1.85 -0.75 2.04 0.11 0.47 -4.61 120.40 121.81 1hdn s VAL 61 Ca 0.15 -1.25 -0.26 0.00 -2.93 0.00 0.00 61.98 57.69 1hdn s VAL 61 Cb -0.16 -1.94 0.02 0.00 -1.53 0.00 0.00 36.38 32.78 1hdn s VAL 61 CO 0.14 0.10 1.40 -0.89 -3.33 0.00 0.00 175.10 172.52 1hdn s THR 62 N 1.28 3.68 -0.49 5.04 2.01 -0.95 -1.39 115.64 124.82 1hdn s THR 62 Ca -0.04 0.25 -0.28 0.00 0.31 0.00 0.00 61.69 61.93 1hdn s THR 62 Cb -0.18 -4.77 0.01 0.00 0.01 0.00 0.00 72.50 67.58 1hdn s THR 62 CO -0.07 -1.71 1.37 -0.63 -0.69 0.00 0.00 174.62 172.89 1hdn s ILE 63 N 6.25 3.90 -0.13 1.82 -1.09 -0.20 -2.65 121.20 129.11 1hdn s ILE 63 Ca 0.41 0.86 -0.06 0.00 -2.23 0.00 0.00 60.65 59.63 1hdn s ILE 63 Cb -0.08 -4.37 -0.04 0.00 -1.58 0.00 0.00 42.46 36.39 1hdn s ILE 63 CO 0.13 -0.98 0.11 -0.55 -1.23 0.00 0.00 174.94 172.42 1hdn s SER 64 N 3.92 6.14 0.03 3.58 0.15 0.07 -1.41 113.70 126.17 1hdn s SER 64 Ca 0.55 0.37 0.04 0.00 0.70 0.00 0.00 55.95 57.61 1hdn s SER 64 Cb -0.11 -1.97 -0.02 0.00 -1.71 0.00 0.00 66.02 62.21 1hdn s SER 64 CO 0.29 0.37 -0.12 0.00 1.20 0.00 0.00 173.24 174.98 1hdn s ALA 65 N -0.79 1.01 -0.04 5.45 0.00 0.15 -0.02 121.76 127.51 1hdn s ALA 65 Ca 0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 1hdn s ALA 65 Cb -0.12 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.85 1hdn s ALA 65 CO 0.03 0.19 0.12 -1.83 0.00 0.00 0.00 175.76 174.27 1hdn s GLU 66 N -0.92 0.15 0.00 0.00 -1.05 -0.75 -0.11 118.70 116.03 1hdn s GLU 66 Ca 0.01 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 54.99 1hdn s GLU 66 Cb -0.07 0.07 0.00 0.00 -0.44 0.00 0.00 34.13 33.69 1hdn s GLU 66 CO 0.01 -0.02 0.00 0.41 0.95 0.00 0.00 175.26 176.61 1hdn n GLY 67 N 2.99 0.35 0.19 -3.83 0.00 -1.26 -0.37 105.19 103.26 1hdn n GLY 67 Ca -0.13 -1.73 -0.07 0.00 0.00 0.00 0.00 46.02 44.09 1hdn n GLY 67 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1hdn h GLU 68 N 0.00 -0.39 -0.70 1.61 4.81 -1.95 -3.01 114.58 114.96 1hdn h GLU 68 Ca 0.00 0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 1hdn h GLU 68 Cb 0.00 0.09 -0.09 0.00 0.63 0.00 0.00 28.75 29.37 1hdn h GLU 68 CO 0.00 -0.26 0.20 -0.25 -0.73 0.00 0.00 179.01 177.97 1hdn n ASP 69 N -3.50 5.13 -0.26 1.04 8.00 -1.26 -4.90 116.55 120.80 1hdn n ASP 69 Ca -0.05 -3.15 -0.06 0.00 0.71 0.00 0.00 54.79 52.24 1hdn n ASP 69 Cb 0.18 -0.73 -0.05 0.00 -0.02 0.00 0.00 41.12 40.49 1hdn n ASP 69 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1hdn n GLU 70 N 0.07 -0.26 0.27 -1.24 0.28 -1.14 -0.72 120.64 117.90 1hdn n GLU 70 Ca 0.38 0.93 -0.16 0.00 -0.16 0.00 0.00 57.16 58.15 1hdn n GLU 70 Cb 1.35 -1.37 -0.08 0.00 1.43 0.00 0.00 31.44 32.76 1hdn n GLU 70 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 1hdn h GLN 71 N 0.00 -0.61 -0.72 3.44 4.15 -1.90 -2.88 115.11 116.59 1hdn h GLN 71 Ca 0.11 0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.60 1hdn h GLN 71 Cb 0.26 0.14 -0.04 0.00 0.21 0.00 0.00 27.48 28.05 1hdn h GLN 71 CO -0.58 -0.41 0.45 -0.22 -1.93 0.00 0.00 178.83 176.15 1hdn h LYS 72 N -0.64 0.87 -0.25 1.69 3.64 -1.61 -1.40 116.57 118.86 1hdn h LYS 72 Ca -0.06 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.32 1hdn h LYS 72 Cb 0.49 -0.20 -0.07 0.00 -0.41 0.00 0.00 32.23 32.05 1hdn h LYS 72 CO 0.11 0.57 -0.20 0.00 -2.27 0.00 0.00 179.45 177.66 1hdn h ALA 73 N 1.30 -0.05 -0.25 5.00 0.00 -0.79 -1.20 119.26 123.27 1hdn h ALA 73 Ca 0.29 0.09 -0.19 0.00 0.00 0.00 0.00 54.91 55.10 1hdn h ALA 73 Cb 0.01 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1hdn h ALA 73 CO -0.10 -0.62 -0.58 0.28 0.00 0.00 0.00 179.25 178.22 1hdn h VAL 74 N -0.20 1.28 -0.43 0.00 2.07 -1.27 -2.44 116.25 115.27 1hdn h VAL 74 Ca 0.14 -1.78 0.09 0.00 0.82 0.00 0.00 66.70 65.97 1hdn h VAL 74 Cb 0.41 1.71 -0.09 0.00 -1.52 0.00 0.00 31.29 31.80 1hdn h VAL 74 CO -0.37 0.57 -0.16 -0.08 0.02 0.00 0.00 177.57 177.55 1hdn h GLU 75 N 0.60 -0.07 0.29 1.57 4.81 -0.95 0.21 114.58 121.04 1hdn h GLU 75 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1hdn h GLU 75 Cb 1.18 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 1hdn h GLU 75 CO 0.12 -0.04 -0.17 1.25 -0.73 0.00 0.00 179.01 179.44 1hdn h HIS 76 N -0.07 -0.45 -0.65 0.92 2.76 -1.20 -2.70 115.15 113.76 1hdn h HIS 76 Ca 0.21 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.44 1hdn h HIS 76 Cb 0.39 0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.47 1hdn h HIS 76 CO -0.42 -0.27 0.43 -0.07 -1.30 0.00 0.00 177.93 176.30 1hdn h LEU 77 N -0.44 0.58 -0.21 0.26 3.38 -0.83 -0.57 115.31 117.47 1hdn h LEU 77 Ca -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1hdn h LEU 77 Cb 0.37 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1hdn h LEU 77 CO 0.03 0.38 -0.03 0.58 0.09 0.00 0.00 178.44 179.49 1hdn h VAL 78 N 0.66 1.28 -0.22 1.22 2.07 -0.42 0.18 116.25 121.01 1hdn h VAL 78 Ca 0.28 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1hdn h VAL 78 Cb 0.27 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1hdn h VAL 78 CO -0.09 0.30 0.09 0.50 0.02 0.00 0.00 177.57 178.39 1hdn h LYS 79 N 0.12 0.20 -0.34 1.57 3.64 -1.13 -2.89 116.57 117.75 1hdn h LYS 79 Ca 0.05 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.50 1hdn h LYS 79 Cb 0.46 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.17 1hdn h LYS 79 CO 0.02 0.13 -0.15 1.25 -2.27 0.00 0.00 179.45 178.43 1hdn h LEU 80 N 0.20 -0.50 -1.99 5.20 5.85 -1.04 -0.53 115.31 122.49 1hdn h LEU 80 Ca 0.09 0.12 0.15 0.00 0.84 0.00 0.00 57.88 59.09 1hdn h LEU 80 Cb 0.05 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1hdn h LEU 80 CO -0.08 -0.18 0.46 0.24 -0.34 0.00 0.00 178.44 178.53 1hdn h MET 81 N -0.09 0.00 0.00 1.25 2.86 -0.79 -1.47 114.93 116.69 1hdn h MET 81 Ca 0.17 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.55 1hdn h MET 81 Cb 0.35 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.96 1hdn h MET 81 CO -0.40 0.00 -1.78 0.00 1.06 0.00 0.00 176.91 175.79 1hdn n ALA 82 N -2.48 1.69 0.25 6.32 0.00 -0.33 -4.35 120.51 121.60 1hdn n ALA 82 Ca 0.10 -0.81 0.12 0.00 0.00 0.00 0.00 53.44 52.85 1hdn n ALA 82 Cb 0.67 -0.73 0.58 0.00 0.00 0.00 0.00 19.45 19.97 1hdn n ALA 82 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1hdn h GLU 83 N 0.00 0.00 -6.99 0.00 5.08 -0.13 -3.47 114.58 109.07 1hdn h GLU 83 Ca -0.29 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.53 1hdn h GLU 83 Cb 1.89 0.00 0.11 0.00 0.50 0.00 0.00 28.75 31.24 1hdn h GLU 83 CO 0.05 0.15 0.64 -0.51 -1.00 0.00 0.00 179.01 178.34 1hdn s LEU 84 N -6.74 4.08 0.00 1.33 1.43 -1.06 -5.09 118.68 112.63 1hdn s LEU 84 Ca -0.00 2.76 0.12 0.00 -1.03 0.00 0.00 54.13 55.97 1hdn s LEU 84 Cb 0.11 -4.02 0.09 0.00 0.03 0.00 0.00 46.19 42.40 1hdn s LEU 84 CO 0.60 -1.13 0.88 -0.62 0.23 0.00 0.00 176.35 176.30