#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 1.95 0.00 2.03 5.36 -0.60 -4.99 117.98 121.74 1hdn s PHE 2 Ca 0.00 -0.49 0.05 0.00 -0.96 0.00 0.00 56.93 55.53 1hdn s PHE 2 Cb 0.00 -1.28 -0.01 0.00 -0.34 0.00 0.00 43.02 41.38 1hdn s PHE 2 CO 0.00 -0.12 -0.15 1.14 -1.46 0.00 0.00 175.22 174.62 1hdn s GLN 3 N -0.22 1.18 -0.08 10.12 -2.07 -1.26 -0.39 119.66 126.93 1hdn s GLN 3 Ca 0.01 -0.61 -0.00 0.00 -1.82 0.00 0.00 55.36 52.94 1hdn s GLN 3 Cb -0.11 -1.16 0.02 0.00 -1.09 0.00 0.00 33.01 30.68 1hdn s GLN 3 CO 0.01 0.31 -0.05 -0.65 -1.32 0.00 0.00 175.29 173.59 1hdn s GLN 4 N -0.57 1.12 -0.30 9.60 -0.21 -0.21 -4.99 119.66 124.10 1hdn s GLN 4 Ca 0.05 -0.13 -0.15 0.00 0.02 0.00 0.00 55.36 55.15 1hdn s GLN 4 Cb -0.06 -1.22 -0.03 0.00 1.00 0.00 0.00 33.01 32.70 1hdn s GLN 4 CO -0.00 -0.20 0.35 -2.00 -2.12 0.00 0.00 175.29 171.32 1hdn s GLU 5 N 1.49 3.83 -0.08 2.91 2.12 -1.26 -0.27 118.70 127.44 1hdn s GLU 5 Ca -0.01 -0.17 0.04 0.00 0.36 0.00 0.00 54.97 55.19 1hdn s GLU 5 Cb -0.13 -3.71 -0.01 0.00 0.26 0.00 0.00 34.13 30.53 1hdn s GLU 5 CO -0.04 -0.37 -0.21 0.14 -0.54 0.00 0.00 175.26 174.24 1hdn s VAL 6 N 2.03 2.37 -1.02 3.70 -7.23 -0.08 -4.94 120.40 115.23 1hdn s VAL 6 Ca 0.13 -0.94 -0.17 0.00 -1.81 0.00 0.00 61.98 59.19 1hdn s VAL 6 Cb -0.16 -1.91 0.14 0.00 0.56 0.00 0.00 36.38 35.02 1hdn s VAL 6 CO 0.11 0.56 1.23 -0.89 -0.31 0.00 0.00 175.10 175.80 1hdn s THR 7 N -0.05 4.84 -0.38 5.32 2.01 -1.26 -1.11 115.64 124.99 1hdn s THR 7 Ca -0.06 -1.94 -0.29 0.00 0.31 0.00 0.00 61.69 59.72 1hdn s THR 7 Cb -0.14 -4.82 0.01 0.00 0.01 0.00 0.00 72.50 67.56 1hdn s THR 7 CO 0.05 -1.54 1.27 -0.63 -0.69 0.00 0.00 174.62 173.07 1hdn s ILE 8 N 2.30 4.13 -0.39 1.82 -1.09 0.31 -4.87 121.20 123.40 1hdn s ILE 8 Ca 0.36 1.21 0.05 0.00 -2.23 0.00 0.00 60.65 60.03 1hdn s ILE 8 Cb -0.04 -4.32 0.46 0.00 -1.58 0.00 0.00 42.46 36.98 1hdn s ILE 8 CO -0.06 -0.71 1.42 0.35 -1.23 0.00 0.00 174.94 174.71 1hdn n THR 9 N 6.61 2.82 -2.50 2.92 -2.24 -1.26 -0.62 114.28 120.01 1hdn n THR 9 Ca 0.14 -3.83 -0.43 0.00 -2.27 0.00 0.00 64.05 57.67 1hdn n THR 9 Cb 0.48 -1.11 -0.02 0.00 -2.10 0.00 0.00 70.33 67.57 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 -3.65 3.56 0.24 6.98 0.00 -1.22 -4.72 121.76 122.95 1hdn s ALA 10 Ca 0.54 0.48 -0.07 0.00 0.00 0.00 0.00 51.96 52.92 1hdn s ALA 10 Cb 0.44 -3.54 0.43 0.00 0.00 0.00 0.00 23.12 20.45 1hdn s ALA 10 CO 0.02 -0.90 1.65 -1.35 0.00 0.00 0.00 175.76 175.18 1hdn h PRO 11 N 7.64 0.14 0.00 0.00 0.11 -1.93 -2.83 132.00 135.13 1hdn h PRO 11 Ca -0.29 -0.01 -0.39 0.00 0.11 0.00 0.00 66.00 65.42 1hdn h PRO 11 Cb 1.13 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1hdn h PRO 11 CO 0.92 0.09 -2.28 0.09 -0.21 0.00 0.00 178.00 176.62 1hdn n ASN 12 N -5.28 1.72 0.00 -2.05 5.03 -1.26 -4.81 115.26 108.61 1hdn n ASN 12 Ca 0.13 0.30 0.00 0.00 0.87 0.00 0.00 54.58 55.88 1hdn n ASN 12 Cb 0.46 -0.71 0.00 0.00 -1.02 0.00 0.00 39.78 38.51 1hdn n ASN 12 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1hdn n GLY 13 N 1.49 -0.49 3.20 7.41 0.00 -1.20 -4.62 105.19 110.98 1hdn n GLY 13 Ca -0.46 -2.08 -0.44 0.00 0.00 0.00 0.00 46.02 43.04 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 5.87 0.00 0.99 4.32 0.16 -4.79 117.00 123.55 1hdn n LEU 14 Ca 0.00 -4.74 0.00 0.00 -0.02 0.00 0.00 56.01 51.25 1hdn n LEU 14 Cb 0.00 -1.50 0.00 0.00 -1.62 0.00 0.00 43.42 40.30 1hdn n LEU 14 CO 0.00 1.18 0.00 0.00 -1.22 0.00 0.00 177.39 177.35 1hdn n HIS 15 N 3.92 0.00 0.00 -1.77 1.44 -1.26 -4.49 115.22 113.06 1hdn n HIS 15 Ca 0.34 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.05 1hdn n HIS 15 Cb 0.39 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.50 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 0.00 -0.02 0.61 -2.24 -1.26 -0.08 114.28 111.29 1hdn n THR 16 Ca 0.00 1.42 -0.16 0.00 -2.27 0.00 0.00 64.05 63.04 1hdn n THR 16 Cb 0.00 -2.00 -0.09 0.00 -2.10 0.00 0.00 70.33 66.14 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 0.46 -0.71 -0.78 2.43 -1.97 -1.86 114.38 111.95 1hdn h ARG 17 Ca 0.00 -0.41 0.06 0.00 -0.81 0.00 0.00 59.98 58.82 1hdn h ARG 17 Cb 0.00 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.59 1hdn h ARG 17 CO 0.00 1.05 0.40 -1.35 -1.51 0.00 0.00 179.97 178.56 1hdn h PRO 18 N 0.02 0.70 -0.36 0.20 0.11 -1.80 0.66 132.00 131.53 1hdn h PRO 18 Ca -0.05 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 1hdn h PRO 18 Cb 1.18 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1hdn h PRO 18 CO 0.10 0.47 0.08 0.00 -0.21 0.00 0.00 178.00 178.44 1hdn h ALA 19 N 1.37 0.48 -0.84 -0.75 0.00 -0.55 -1.69 119.26 117.28 1hdn h ALA 19 Ca 0.32 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1hdn h ALA 19 Cb 0.21 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 1hdn h ALA 19 CO -0.19 0.15 0.51 0.00 0.00 0.00 0.00 179.25 179.72 1hdn h ALA 20 N 0.93 1.16 -0.45 0.00 0.00 -0.89 0.65 119.26 120.66 1hdn h ALA 20 Ca 0.11 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1hdn h ALA 20 Cb 0.31 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1hdn h ALA 20 CO 0.00 0.24 0.26 1.96 0.00 0.00 0.00 179.25 181.72 1hdn h GLN 21 N 0.93 0.52 -0.11 0.00 4.20 -0.64 0.15 115.11 120.16 1hdn h GLN 21 Ca 0.37 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 59.05 1hdn h GLN 21 Cb 0.19 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1hdn h GLN 21 CO -0.18 0.34 0.06 0.35 -0.67 0.00 0.00 178.83 178.73 1hdn h PHE 22 N 0.53 0.16 -0.59 2.96 3.57 -0.77 -2.60 116.94 120.21 1hdn h PHE 22 Ca 0.18 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.71 1hdn h PHE 22 Cb 0.01 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 1hdn h PHE 22 CO -0.07 0.22 0.33 0.28 -2.23 0.00 0.00 178.31 176.84 1hdn h VAL 23 N 0.06 1.00 -0.16 1.41 2.07 -0.72 0.18 116.25 120.09 1hdn h VAL 23 Ca 0.04 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.39 1hdn h VAL 23 Cb 0.12 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 1hdn h VAL 23 CO -0.00 0.12 -0.15 0.50 0.02 0.00 0.00 177.57 178.05 1hdn h LYS 24 N 0.64 -0.17 -0.37 1.57 3.11 -0.79 0.18 116.57 120.74 1hdn h LYS 24 Ca 0.25 0.01 -0.16 0.00 -2.81 0.00 0.00 60.65 57.95 1hdn h LYS 24 Cb 0.11 0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.37 1hdn h LYS 24 CO -0.14 -0.11 -0.38 1.49 -2.81 0.00 0.00 179.45 177.49 1hdn h GLU 25 N -0.18 0.88 -0.61 1.90 4.57 -1.18 -2.35 114.58 117.62 1hdn h GLU 25 Ca 0.11 -0.46 0.07 0.00 -1.18 0.00 0.00 59.36 57.89 1hdn h GLU 25 Cb 0.33 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.88 1hdn h GLU 25 CO -0.27 1.11 0.30 0.00 -1.18 0.00 0.00 179.01 178.97 1hdn h ALA 26 N 0.83 0.80 0.00 2.92 0.00 -0.75 -0.91 119.26 122.16 1hdn h ALA 26 Ca 0.06 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1hdn h ALA 26 Cb 0.96 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1hdn h ALA 26 CO 0.09 -0.07 -0.07 0.87 0.00 0.00 0.00 179.25 180.07 1hdn h LYS 27 N 0.55 0.00 -0.26 0.00 1.79 -0.50 -2.24 116.57 115.91 1hdn h LYS 27 Ca 0.28 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.70 1hdn h LYS 27 Cb 0.24 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.88 1hdn h LYS 27 CO -0.22 0.07 -0.08 0.78 -1.08 0.00 0.00 179.45 178.92 1hdn h GLY 28 N 0.22 0.45 -4.33 3.86 0.00 -0.61 -3.44 103.07 99.22 1hdn h GLY 28 Ca -0.00 -0.28 -0.54 0.00 0.00 0.00 0.00 47.33 46.50 1hdn h GLY 28 CO 0.01 0.26 0.12 -1.36 0.00 0.00 0.00 176.54 175.57 1hdn s PHE 29 N -4.81 3.86 -0.01 5.60 0.08 -0.84 -5.01 117.98 116.85 1hdn s PHE 29 Ca -0.07 1.51 -0.22 0.00 0.12 0.00 0.00 56.93 58.28 1hdn s PHE 29 Cb 0.15 -2.70 -0.21 0.00 -0.57 0.00 0.00 43.02 39.69 1hdn s PHE 29 CO 0.76 0.51 1.13 1.79 -0.10 0.00 0.00 175.22 179.31 1hdn h THR 30 N 3.47 1.45 -3.16 0.64 1.35 -1.86 -3.46 112.91 111.34 1hdn h THR 30 Ca -0.47 -1.85 -0.58 0.00 -0.55 0.00 0.00 66.41 62.96 1hdn h THR 30 Cb 1.21 2.49 0.13 0.00 -1.73 0.00 0.00 68.15 70.25 1hdn h THR 30 CO 0.66 0.52 0.20 -1.20 -0.25 0.00 0.00 175.52 175.45 1hdn n SER 31 N -4.41 1.37 -4.69 5.36 7.64 -1.26 -4.95 113.62 112.67 1hdn n SER 31 Ca -0.09 1.02 -0.38 0.00 1.01 0.00 0.00 58.87 60.43 1hdn n SER 31 Cb 0.53 -1.37 -0.07 0.00 -1.01 0.00 0.00 64.21 62.29 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 -2.10 4.25 -0.31 1.43 2.56 -1.01 -4.96 118.70 118.55 1hdn s GLU 32 Ca 0.64 0.35 -0.11 0.00 0.00 0.00 0.00 54.97 55.85 1hdn s GLU 32 Cb -0.54 -3.50 -0.03 0.00 2.00 0.00 0.00 34.13 32.07 1hdn s GLU 32 CO 0.56 0.02 0.19 0.42 -0.56 0.00 0.00 175.26 175.90 1hdn s ILE 33 N 1.09 5.09 -0.28 -3.70 -1.09 -1.26 -2.72 121.20 118.33 1hdn s ILE 33 Ca 0.23 -0.11 -0.10 0.00 -2.23 0.00 0.00 60.65 58.44 1hdn s ILE 33 Cb -0.15 -3.53 -0.04 0.00 -1.58 0.00 0.00 42.46 37.17 1hdn s ILE 33 CO 0.09 0.12 0.16 -0.89 -1.23 0.00 0.00 174.94 173.19 1hdn s THR 34 N 1.71 4.95 -0.52 2.92 2.01 0.27 -3.14 115.64 123.83 1hdn s THR 34 Ca 0.06 -0.02 -0.13 0.00 0.31 0.00 0.00 61.69 61.92 1hdn s THR 34 Cb -0.17 -3.38 0.13 0.00 0.01 0.00 0.00 72.50 69.10 1hdn s THR 34 CO 0.09 0.24 0.44 -0.69 -0.69 0.00 0.00 174.62 174.01 1hdn s VAL 35 N 1.70 4.77 -0.27 3.82 1.01 -0.24 -0.74 120.40 130.45 1hdn s VAL 35 Ca 0.07 -1.69 -0.03 0.00 0.00 0.00 0.00 61.98 60.33 1hdn s VAL 35 Cb -0.16 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 32.16 1hdn s VAL 35 CO 0.08 -0.84 -0.02 -0.89 0.00 0.00 0.00 175.10 173.44 1hdn s THR 36 N 1.42 3.10 -0.22 3.92 2.01 0.15 -0.13 115.64 125.89 1hdn s THR 36 Ca 0.05 -1.06 0.02 0.00 0.31 0.00 0.00 61.69 61.01 1hdn s THR 36 Cb -0.27 -2.63 0.04 0.00 0.01 0.00 0.00 72.50 69.64 1hdn s THR 36 CO 0.01 0.10 -0.15 -0.55 -0.69 0.00 0.00 174.62 173.33 1hdn s SER 37 N 1.34 3.80 -0.65 3.53 0.15 -0.70 -0.44 113.70 120.73 1hdn s SER 37 Ca -0.01 -1.02 -0.00 0.00 0.70 0.00 0.00 55.95 55.62 1hdn s SER 37 Cb -0.18 -1.52 0.00 0.00 -1.71 0.00 0.00 66.02 62.62 1hdn s SER 37 CO -0.02 -0.09 0.47 -0.46 1.20 0.00 0.00 173.24 174.33 1hdn n ASN 38 N 4.53 -3.72 0.00 5.45 0.23 -1.26 -1.15 115.26 119.34 1hdn n ASN 38 Ca -0.18 -0.77 0.00 0.00 -0.53 0.00 0.00 54.58 53.10 1hdn n ASN 38 Cb 0.46 -1.24 0.00 0.00 -2.08 0.00 0.00 39.78 36.92 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 -1.40 2.04 3.56 4.83 0.00 -1.26 -4.98 105.19 107.99 1hdn n GLY 39 Ca -0.26 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 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 3.26 -0.35 1.61 -0.14 -0.30 -4.99 119.74 118.83 1hdn s LYS 40 Ca 0.00 0.03 -0.25 0.00 -1.36 0.00 0.00 55.97 54.39 1hdn s LYS 40 Cb 0.00 -4.14 0.01 0.00 -1.68 0.00 0.00 37.83 32.02 1hdn s LYS 40 CO 0.00 -2.03 0.88 -1.54 -0.76 0.00 0.00 175.35 171.90 1hdn s SER 41 N 3.89 6.68 -0.08 2.83 1.04 -1.26 -1.72 113.70 125.07 1hdn s SER 41 Ca 0.41 0.61 -0.00 0.00 0.48 0.00 0.00 55.95 57.45 1hdn s SER 41 Cb -0.08 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 1hdn s SER 41 CO 0.19 -0.78 -0.06 0.00 0.98 0.00 0.00 173.24 173.58 1hdn s ALA 42 N 3.29 3.02 -0.60 5.32 0.00 0.82 -4.97 121.76 128.65 1hdn s ALA 42 Ca 0.36 -0.87 -0.21 0.00 0.00 0.00 0.00 51.96 51.24 1hdn s ALA 42 Cb -0.13 -1.30 0.07 0.00 0.00 0.00 0.00 23.12 21.76 1hdn s ALA 42 CO 0.16 0.53 0.84 0.45 0.00 0.00 0.00 175.76 177.75 1hdn s SER 43 N -0.66 6.22 0.30 0.00 0.15 -1.26 -1.08 113.70 117.36 1hdn s SER 43 Ca 0.10 -0.94 0.06 0.00 0.70 0.00 0.00 55.95 55.86 1hdn s SER 43 Cb -0.11 -2.37 0.73 0.00 -1.71 0.00 0.00 66.02 62.55 1hdn s SER 43 CO 0.02 -1.23 1.77 0.00 1.20 0.00 0.00 173.24 175.00 1hdn h ALA 44 N 9.34 1.65 0.00 5.45 0.00 -1.87 -2.03 119.26 131.79 1hdn h ALA 44 Ca -0.28 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1hdn h ALA 44 Cb 1.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1hdn h ALA 44 CO 1.11 -0.06 0.00 1.63 0.00 0.00 0.00 179.25 181.93 1hdn n LYS 45 N -4.78 0.08 -3.90 0.00 5.02 -1.26 -4.38 118.16 108.93 1hdn n LYS 45 Ca 0.23 0.48 -0.35 0.00 -2.02 0.00 0.00 58.31 56.65 1hdn n LYS 45 Cb 0.57 -1.70 -0.13 0.00 -0.02 0.00 0.00 35.03 33.74 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 -3.53 4.71 0.21 4.39 0.15 -0.77 -4.89 113.70 113.98 1hdn s SER 46 Ca 0.01 -0.28 -0.10 0.00 0.70 0.00 0.00 55.95 56.28 1hdn s SER 46 Cb 0.05 -1.82 0.28 0.00 -1.71 0.00 0.00 66.02 62.82 1hdn s SER 46 CO 0.18 -0.00 1.73 0.25 1.20 0.00 0.00 173.24 176.60 1hdn h LEU 47 N 8.00 0.17 0.20 3.45 5.85 -1.84 0.12 115.31 131.26 1hdn h LEU 47 Ca -0.39 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1hdn h LEU 47 Cb 1.17 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 1hdn h LEU 47 CO 0.60 0.10 -0.20 0.15 -0.34 0.00 0.00 178.44 178.75 1hdn h PHE 48 N 0.37 -0.52 -0.07 1.25 3.57 -1.95 -0.42 116.94 119.18 1hdn h PHE 48 Ca 0.30 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.73 1hdn h PHE 48 Cb 0.39 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1hdn h PHE 48 CO -0.18 -0.30 -0.33 0.87 -2.23 0.00 0.00 178.31 176.14 1hdn h LYS 49 N -0.43 0.14 0.34 1.11 1.57 -1.59 0.51 116.57 118.23 1hdn h LYS 49 Ca -0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1hdn h LYS 49 Cb 0.40 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1hdn h LYS 49 CO -0.05 0.46 -0.16 1.25 -0.57 0.00 0.00 179.45 180.38 1hdn h LEU 50 N 0.13 -0.39 -1.66 2.94 5.85 -0.67 -3.35 115.31 118.16 1hdn h LEU 50 Ca 0.02 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 1hdn h LEU 50 Cb 0.65 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1hdn h LEU 50 CO 0.05 -0.00 -0.14 1.56 -0.34 0.00 0.00 178.44 179.56 1hdn h GLN 51 N -0.84 0.04 0.00 1.25 4.20 -0.79 -1.29 115.11 117.69 1hdn h GLN 51 Ca -0.05 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1hdn h GLN 51 Cb 0.53 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1hdn h GLN 51 CO 0.08 0.18 0.00 0.00 -0.67 0.00 0.00 178.83 178.42 1hdn h THR 52 N 0.04 0.00 -3.33 -0.54 1.03 -1.03 -3.41 112.91 105.67 1hdn h THR 52 Ca 0.01 -0.12 -0.59 0.00 -0.01 0.00 0.00 66.41 65.70 1hdn h THR 52 Cb 0.28 0.83 -0.11 0.00 -1.07 0.00 0.00 68.15 68.08 1hdn h THR 52 CO 0.02 0.00 -0.34 -0.22 -0.01 0.00 0.00 175.52 174.97 1hdn s LEU 53 N -5.08 4.22 -0.98 0.00 2.96 -0.49 -5.04 118.68 114.28 1hdn s LEU 53 Ca -0.01 0.46 -0.24 0.00 -0.22 0.00 0.00 54.13 54.12 1hdn s LEU 53 Cb 0.09 -2.35 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 1hdn s LEU 53 CO 0.33 0.08 1.87 -0.83 -1.32 0.00 0.00 176.35 176.48 1hdn s GLY 54 N 0.57 0.37 -0.83 7.98 0.00 -1.26 -4.92 107.32 109.23 1hdn s GLY 54 Ca 0.15 -1.76 -0.15 0.00 0.00 0.00 0.00 44.72 42.96 1hdn s GLY 54 CO 0.04 3.36 0.81 1.08 0.00 0.00 0.00 173.10 178.39 1hdn s LEU 55 N 9.34 6.44 0.00 0.66 1.43 -1.26 -4.91 118.68 130.38 1hdn s LEU 55 Ca 0.66 -2.52 0.00 0.00 -1.03 0.00 0.00 54.13 51.24 1hdn s LEU 55 Cb -0.04 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.93 1hdn s LEU 55 CO 0.01 -0.67 0.00 1.07 0.23 0.00 0.00 176.35 176.98 1hdn n THR 56 N 4.30 0.00 -3.00 5.49 5.66 -1.26 -0.66 114.28 124.80 1hdn n THR 56 Ca 0.14 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.72 1hdn n THR 56 Cb 0.47 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.19 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 3.20 3.78 0.00 1.09 -2.07 -1.07 -3.44 119.66 121.15 1hdn s GLN 57 Ca 0.00 0.29 0.00 0.00 -1.82 0.00 0.00 55.36 53.83 1hdn s GLN 57 Cb 0.00 -3.79 0.00 0.00 -1.09 0.00 0.00 33.01 28.13 1hdn s GLN 57 CO 0.00 -0.77 0.00 0.41 -1.32 0.00 0.00 175.29 173.61 1hdn n GLY 58 N 4.50 0.97 3.12 2.60 0.00 0.21 -4.94 105.19 111.66 1hdn n GLY 58 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.92 2.89 -0.57 2.61 2.01 -0.11 -4.96 115.64 115.59 1hdn s THR 59 Ca 0.00 -1.80 -0.25 0.00 0.31 0.00 0.00 61.69 59.96 1hdn s THR 59 Cb 0.00 -2.85 0.04 0.00 0.01 0.00 0.00 72.50 69.70 1hdn s THR 59 CO 0.00 -0.38 0.99 0.54 -0.69 0.00 0.00 174.62 175.08 1hdn s VAL 60 N 1.14 4.31 -0.13 3.82 0.11 -1.26 -0.53 120.40 127.86 1hdn s VAL 60 Ca 0.02 0.31 0.02 0.00 -2.93 0.00 0.00 61.98 59.39 1hdn s VAL 60 Cb -0.21 -4.59 0.01 0.00 -1.53 0.00 0.00 36.38 30.07 1hdn s VAL 60 CO -0.04 -1.20 -0.18 0.54 -3.33 0.00 0.00 175.10 170.89 1hdn s VAL 61 N 4.15 1.80 -0.35 2.04 0.11 -0.27 -4.22 120.40 123.66 1hdn s VAL 61 Ca 0.31 -0.81 -0.24 0.00 -2.93 0.00 0.00 61.98 58.31 1hdn s VAL 61 Cb -0.12 -1.62 0.01 0.00 -1.53 0.00 0.00 36.38 33.12 1hdn s VAL 61 CO 0.19 0.50 0.85 -0.89 -3.33 0.00 0.00 175.10 172.42 1hdn s THR 62 N 1.02 4.69 -0.50 5.04 2.01 0.42 -0.90 115.64 127.42 1hdn s THR 62 Ca -0.04 1.12 -0.17 0.00 0.31 0.00 0.00 61.69 62.91 1hdn s THR 62 Cb -0.15 -4.24 0.08 0.00 0.01 0.00 0.00 72.50 68.20 1hdn s THR 62 CO -0.04 -0.42 0.49 -0.63 -0.69 0.00 0.00 174.62 173.33 1hdn s ILE 63 N 3.21 5.12 -0.11 1.82 -1.09 0.63 -0.67 121.20 130.11 1hdn s ILE 63 Ca 0.35 -1.02 0.02 0.00 -2.23 0.00 0.00 60.65 57.77 1hdn s ILE 63 Cb -0.13 -4.23 -0.01 0.00 -1.58 0.00 0.00 42.46 36.51 1hdn s ILE 63 CO 0.16 -0.72 -0.17 -0.55 -1.23 0.00 0.00 174.94 172.43 1hdn s SER 64 N 2.88 3.67 -0.01 3.58 0.15 0.08 -1.05 113.70 123.00 1hdn s SER 64 Ca 0.07 -0.41 0.08 0.00 0.70 0.00 0.00 55.95 56.39 1hdn s SER 64 Cb -0.24 -1.49 -0.02 0.00 -1.71 0.00 0.00 66.02 62.56 1hdn s SER 64 CO 0.07 0.17 -0.25 0.00 1.20 0.00 0.00 173.24 174.44 1hdn s ALA 65 N 0.29 2.25 -0.06 5.45 0.00 0.47 -0.56 121.76 129.59 1hdn s ALA 65 Ca -0.13 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.71 1hdn s ALA 65 Cb -0.16 -0.58 0.01 0.00 0.00 0.00 0.00 23.12 22.39 1hdn s ALA 65 CO 0.07 0.54 -0.12 -1.83 0.00 0.00 0.00 175.76 174.41 1hdn s GLU 66 N -0.79 1.68 0.00 0.00 -1.05 -1.10 -1.55 118.70 115.88 1hdn s GLU 66 Ca 0.11 -0.41 0.00 0.00 -0.15 0.00 0.00 54.97 54.52 1hdn s GLU 66 Cb -0.10 -1.39 0.00 0.00 -0.44 0.00 0.00 34.13 32.20 1hdn s GLU 66 CO 0.00 0.03 0.00 0.41 0.95 0.00 0.00 175.26 176.65 1hdn n GLY 67 N 3.82 0.57 0.00 -3.83 0.00 -1.26 -2.42 105.19 102.07 1hdn n GLY 67 Ca -0.23 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.82 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 -1.46 1.61 1.02 -1.26 -3.20 120.64 117.35 1hdn n GLU 68 Ca 0.00 0.81 -0.29 0.00 -0.02 0.00 0.00 57.16 57.66 1hdn n GLU 68 Cb 0.00 -1.44 -0.00 0.00 -0.02 0.00 0.00 31.44 29.98 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 -2.51 6.86 0.01 1.62 8.00 -1.26 -4.81 116.55 124.46 1hdn n ASP 69 Ca 0.00 -3.39 -0.15 0.00 0.71 0.00 0.00 54.79 51.96 1hdn n ASP 69 Cb 0.00 -1.13 -0.09 0.00 -0.02 0.00 0.00 41.12 39.87 1hdn n ASP 69 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1hdn h GLU 70 N 2.60 -0.56 -0.52 -1.24 4.11 -1.89 0.11 114.58 117.19 1hdn h GLU 70 Ca 0.44 0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.89 1hdn h GLU 70 Cb 0.61 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1hdn h GLU 70 CO 1.07 -0.37 0.24 1.96 0.07 0.00 0.00 179.01 181.98 1hdn h GLN 71 N -0.58 0.76 0.21 1.06 4.20 -1.91 -3.08 115.11 115.77 1hdn h GLN 71 Ca 0.02 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1hdn h GLN 71 Cb 0.66 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1hdn h GLN 71 CO -0.39 0.64 -0.10 -0.22 -0.67 0.00 0.00 178.83 178.09 1hdn h LYS 72 N 0.70 -0.27 -0.97 1.46 3.64 -1.83 -0.79 116.57 118.52 1hdn h LYS 72 Ca 0.18 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.70 1hdn h LYS 72 Cb 0.13 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 31.93 1hdn h LYS 72 CO -0.02 -0.04 0.60 0.00 -2.27 0.00 0.00 179.45 177.72 1hdn h ALA 73 N 0.30 1.46 0.54 5.00 0.00 -0.80 0.18 119.26 125.93 1hdn h ALA 73 Ca -0.03 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1hdn h ALA 73 Cb 0.35 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.96 1hdn h ALA 73 CO 0.05 0.18 -0.26 0.28 0.00 0.00 0.00 179.25 179.50 1hdn h VAL 74 N 0.94 0.00 -0.48 0.00 2.07 -1.42 -2.82 116.25 114.54 1hdn h VAL 74 Ca 0.49 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 67.85 1hdn h VAL 74 Cb 0.50 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.17 1hdn h VAL 74 CO -0.27 0.00 -0.27 -0.08 0.02 0.00 0.00 177.57 176.96 1hdn h GLU 75 N -0.97 -0.16 -0.52 1.57 4.81 -0.68 0.85 114.58 119.47 1hdn h GLU 75 Ca -0.07 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 1hdn h GLU 75 Cb 0.55 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 1hdn h GLU 75 CO 0.12 -0.11 -0.05 1.25 -0.73 0.00 0.00 179.01 179.50 1hdn h HIS 76 N -0.17 1.04 -0.30 0.92 2.76 -0.79 0.16 115.15 118.77 1hdn h HIS 76 Ca 0.21 -0.20 -0.12 0.00 -2.20 0.00 0.00 60.37 58.07 1hdn h HIS 76 Cb 0.51 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.19 1hdn h HIS 76 CO -0.53 0.97 -0.30 -0.07 -1.30 0.00 0.00 177.93 176.70 1hdn h LEU 77 N 0.81 0.64 -0.38 0.26 3.38 -1.13 -0.99 115.31 117.90 1hdn h LEU 77 Ca 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1hdn h LEU 77 Cb 0.59 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1hdn h LEU 77 CO 0.04 0.90 0.14 0.58 0.09 0.00 0.00 178.44 180.19 1hdn h VAL 78 N 0.53 1.20 -0.16 1.22 2.07 -0.48 0.34 116.25 120.98 1hdn h VAL 78 Ca 0.07 -0.61 0.05 0.00 0.82 0.00 0.00 66.70 67.02 1hdn h VAL 78 Cb 0.78 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 31.38 1hdn h VAL 78 CO 0.06 0.22 -0.25 0.50 0.02 0.00 0.00 177.57 178.12 1hdn h LYS 79 N 0.47 -0.29 0.06 1.57 3.64 -0.58 0.56 116.57 121.99 1hdn h LYS 79 Ca 0.13 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 1hdn h LYS 79 Cb 0.20 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 1hdn h LYS 79 CO -0.01 -0.20 -0.34 1.25 -2.27 0.00 0.00 179.45 177.88 1hdn h LEU 80 N -0.31 -1.00 -0.30 5.20 6.46 -1.06 -2.60 115.31 121.71 1hdn h LEU 80 Ca 0.11 0.12 0.04 0.00 -0.12 0.00 0.00 57.88 58.03 1hdn h LEU 80 Cb 0.47 0.39 -0.04 0.00 -0.73 0.00 0.00 40.66 40.75 1hdn h LEU 80 CO -0.33 -0.41 0.05 -0.03 -0.62 0.00 0.00 178.44 177.09 1hdn h MET 81 N -0.53 0.15 0.00 1.25 4.05 -0.56 -2.62 114.93 116.66 1hdn h MET 81 Ca 0.04 -0.01 -0.07 0.00 -0.28 0.00 0.00 59.70 59.38 1hdn h MET 81 Cb 0.59 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 1hdn h MET 81 CO -0.24 0.10 -0.34 0.00 0.23 0.00 0.00 176.91 176.66 1hdn h ALA 82 N 1.23 1.35 -0.64 0.39 0.00 -0.76 -3.13 119.26 117.68 1hdn h ALA 82 Ca 0.14 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1hdn h ALA 82 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1hdn h ALA 82 CO -0.19 0.43 0.00 0.39 0.00 0.00 0.00 179.25 179.88 1hdn n GLU 83 N -4.00 3.65 -2.83 0.00 1.02 -0.99 -5.01 120.64 112.47 1hdn n GLU 83 Ca -0.02 -2.80 -0.37 0.00 -0.02 0.00 0.00 57.16 53.96 1hdn n GLU 83 Cb 0.40 -1.88 -0.06 0.00 -0.02 0.00 0.00 31.44 29.87 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 -1.77 4.35 0.00 -4.62 1.43 -1.14 -5.05 118.68 111.87 1hdn s LEU 84 Ca 0.50 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 55.38 1hdn s LEU 84 Cb 0.32 -3.94 0.00 0.00 0.03 0.00 0.00 46.19 42.60 1hdn s LEU 84 CO 0.25 -0.05 0.09 1.21 0.23 0.00 0.00 176.35 178.08