#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 -0.03 -0.11 1.12 5.36 -0.87 -4.96 117.98 118.49 1hdn s PHE 2 Ca 0.00 0.21 0.03 0.00 -0.96 0.00 0.00 56.93 56.21 1hdn s PHE 2 Cb 0.00 -0.16 0.01 0.00 -0.34 0.00 0.00 43.02 42.53 1hdn s PHE 2 CO 0.00 -0.10 -0.19 -1.14 -1.46 0.00 0.00 175.22 172.33 1hdn s GLN 3 N 0.93 2.62 -0.12 10.12 -0.44 -1.26 -1.68 119.66 129.84 1hdn s GLN 3 Ca -0.08 -0.72 0.01 0.00 -2.50 0.00 0.00 55.36 52.07 1hdn s GLN 3 Cb -0.11 -2.09 0.02 0.00 -1.64 0.00 0.00 33.01 29.19 1hdn s GLN 3 CO -0.03 0.04 -0.12 -1.14 0.50 0.00 0.00 175.29 174.53 1hdn s GLN 4 N 0.70 2.00 -0.65 1.67 0.74 -0.96 -4.98 119.66 118.17 1hdn s GLN 4 Ca -0.12 -0.46 -0.28 0.00 0.05 0.00 0.00 55.36 54.56 1hdn s GLN 4 Cb -0.16 -1.83 0.03 0.00 1.10 0.00 0.00 33.01 32.15 1hdn s GLN 4 CO 0.02 -0.17 1.26 -1.21 -0.55 0.00 0.00 175.29 174.65 1hdn s GLU 5 N 1.33 3.34 -0.09 1.67 2.02 -1.26 -2.33 118.70 123.37 1hdn s GLU 5 Ca -0.00 0.06 0.01 0.00 0.02 0.00 0.00 54.97 55.05 1hdn s GLU 5 Cb -0.14 -4.10 -0.02 0.00 0.10 0.00 0.00 34.13 29.97 1hdn s GLU 5 CO -0.06 -1.93 -0.10 0.08 0.02 0.00 0.00 175.26 173.27 1hdn s VAL 6 N 5.47 3.38 -0.19 2.63 1.01 -0.63 -4.98 120.40 127.08 1hdn s VAL 6 Ca 0.41 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 1hdn s VAL 6 Cb -0.08 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 1hdn s VAL 6 CO 0.21 0.56 0.08 -0.89 0.00 0.00 0.00 175.10 175.05 1hdn s THR 7 N -0.28 4.86 -0.78 3.92 2.01 -1.26 0.07 115.64 124.18 1hdn s THR 7 Ca 0.03 -0.01 -0.15 0.00 0.31 0.00 0.00 61.69 61.87 1hdn s THR 7 Cb -0.13 -3.21 0.18 0.00 0.01 0.00 0.00 72.50 69.36 1hdn s THR 7 CO 0.03 0.44 0.78 -0.63 -0.69 0.00 0.00 174.62 174.54 1hdn s ILE 8 N 0.50 5.35 -0.16 1.82 1.01 -0.65 -4.90 121.20 124.18 1hdn s ILE 8 Ca 0.04 -2.06 0.17 0.00 0.00 0.00 0.00 60.65 58.79 1hdn s ILE 8 Cb -0.13 -4.50 -0.03 0.00 0.01 0.00 0.00 42.46 37.81 1hdn s ILE 8 CO 0.01 -1.09 1.10 0.00 0.00 0.00 0.00 174.94 174.96 1hdn h THR 9 N 5.20 0.57 -2.38 2.92 1.03 -1.86 0.87 112.91 119.26 1hdn h THR 9 Ca 0.02 -1.94 -0.61 0.00 -0.01 0.00 0.00 66.41 63.87 1hdn h THR 9 Cb 1.05 2.12 0.08 0.00 -1.07 0.00 0.00 68.15 70.33 1hdn h THR 9 CO 0.88 0.32 0.53 0.00 -0.01 0.00 0.00 175.52 177.24 1hdn n ALA 10 N -2.30 0.50 -0.09 0.00 0.00 -1.26 -3.82 120.51 113.54 1hdn n ALA 10 Ca -0.04 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.76 1hdn n ALA 10 Cb 0.76 -2.20 -0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 4.16 0.33 -0.85 0.00 0.11 -1.94 -1.41 132.00 132.38 1hdn h PRO 11 Ca -0.45 -0.02 0.14 0.00 0.11 0.00 0.00 66.00 65.79 1hdn h PRO 11 Cb 1.30 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 1hdn h PRO 11 CO 0.75 0.22 0.56 -2.95 -0.21 0.00 0.00 178.00 176.37 1hdn h ASN 12 N 0.34 0.58 -0.45 -2.05 -1.07 -1.99 -3.39 115.58 107.55 1hdn h ASN 12 Ca 0.13 0.03 0.00 0.00 0.07 0.00 0.00 56.30 56.54 1hdn h ASN 12 Cb 0.04 -0.08 0.00 0.00 -2.07 0.00 0.00 38.32 36.21 1hdn h ASN 12 CO -0.09 0.30 0.00 0.61 0.07 0.00 0.00 177.43 178.32 1hdn n GLY 13 N -1.46 0.10 2.57 9.14 0.00 -0.54 -4.42 105.19 110.58 1hdn n GLY 13 Ca 0.16 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 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 4.42 0.00 0.99 4.77 -0.49 -4.89 117.00 121.80 1hdn n LEU 14 Ca 0.00 -5.41 -0.15 0.00 -0.03 0.00 0.00 56.01 50.41 1hdn n LEU 14 Cb 0.00 -0.79 0.12 0.00 -2.33 0.00 0.00 43.42 40.42 1hdn n LEU 14 CO 0.00 2.00 0.37 0.00 -1.33 0.00 0.00 177.39 178.43 1hdn n HIS 15 N 0.87 -3.66 -0.32 -1.77 1.44 -1.23 -3.99 115.22 106.55 1hdn n HIS 15 Ca 0.29 -0.55 0.30 0.00 -2.01 0.00 0.00 57.72 55.76 1hdn n HIS 15 Cb 0.39 -0.56 0.56 0.00 0.12 0.00 0.00 29.99 30.50 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 -1.86 0.02 -0.01 0.61 1.35 -1.94 0.27 112.91 111.35 1hdn h THR 16 Ca -0.22 -0.01 -0.04 0.00 -0.55 0.00 0.00 66.41 65.60 1hdn h THR 16 Cb 0.63 -0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.05 1hdn h THR 16 CO 0.14 0.00 -0.15 0.03 -0.25 0.00 0.00 175.52 175.29 1hdn h ARG 17 N 0.02 0.11 -0.43 4.72 2.47 -2.00 -0.07 114.38 119.21 1hdn h ARG 17 Ca 0.82 -0.12 0.07 0.00 -1.26 0.00 0.00 59.98 59.50 1hdn h ARG 17 Cb 2.14 0.03 -0.06 0.00 -1.65 0.00 0.00 29.97 30.43 1hdn h ARG 17 CO -0.77 0.85 0.08 -1.35 0.56 0.00 0.00 179.97 179.34 1hdn h PRO 18 N -0.58 0.21 -0.89 0.04 0.11 -1.69 -3.11 132.00 126.10 1hdn h PRO 18 Ca -0.02 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 66.18 1hdn h PRO 18 Cb 0.90 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 31.89 1hdn h PRO 18 CO 0.03 0.14 0.53 0.00 -0.21 0.00 0.00 178.00 178.49 1hdn h ALA 19 N 1.33 1.28 -0.13 -0.75 0.00 -0.45 0.36 119.26 120.89 1hdn h ALA 19 Ca 0.21 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1hdn h ALA 19 Cb 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1hdn h ALA 19 CO -0.27 0.17 -0.08 0.00 0.00 0.00 0.00 179.25 179.07 1hdn h ALA 20 N 1.47 1.64 0.19 0.00 0.00 -0.95 -1.07 119.26 120.55 1hdn h ALA 20 Ca 0.42 -0.15 -0.31 0.00 0.00 0.00 0.00 54.91 54.88 1hdn h ALA 20 Cb 0.37 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.11 1hdn h ALA 20 CO -0.24 0.27 -1.41 1.96 0.00 0.00 0.00 179.25 179.83 1hdn h GLN 21 N 0.19 0.40 -0.46 0.00 1.08 -1.11 -3.30 115.11 111.90 1hdn h GLN 21 Ca 0.04 -0.68 0.04 0.00 -1.45 0.00 0.00 58.65 56.60 1hdn h GLN 21 Cb 0.26 0.25 -0.04 0.00 -0.05 0.00 0.00 27.48 27.90 1hdn h GLN 21 CO 0.01 1.32 0.22 0.35 -0.95 0.00 0.00 178.83 179.78 1hdn h PHE 22 N 0.11 0.40 -0.69 2.96 3.57 -0.76 -2.97 116.94 119.56 1hdn h PHE 22 Ca -0.21 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.37 1hdn h PHE 22 Cb 2.08 -0.11 -0.09 0.00 2.79 0.00 0.00 35.95 40.61 1hdn h PHE 22 CO 0.10 0.19 -0.52 0.28 -2.23 0.00 0.00 178.31 176.13 1hdn h VAL 23 N 0.43 0.00 -0.86 1.41 2.07 -1.30 -2.16 116.25 115.84 1hdn h VAL 23 Ca 0.20 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.90 1hdn h VAL 23 Cb 0.13 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.74 1hdn h VAL 23 CO -0.16 0.00 -0.22 0.50 0.02 0.00 0.00 177.57 177.72 1hdn h LYS 24 N -0.14 -0.00 -0.13 1.57 3.64 -1.60 -1.61 116.57 118.30 1hdn h LYS 24 Ca 0.11 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1hdn h LYS 24 Cb 0.43 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1hdn h LYS 24 CO -0.72 -0.00 0.00 1.49 -2.27 0.00 0.00 179.45 177.95 1hdn h GLU 25 N -0.00 0.23 -0.15 1.90 4.57 -1.45 -3.26 114.58 116.42 1hdn h GLU 25 Ca 0.41 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.50 1hdn h GLU 25 Cb 0.63 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 1hdn h GLU 25 CO -0.89 0.47 0.01 0.00 -1.18 0.00 0.00 179.01 177.41 1hdn h ALA 26 N 0.76 1.75 -0.32 2.92 0.00 -0.77 -3.21 119.26 120.39 1hdn h ALA 26 Ca 0.04 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.93 1hdn h ALA 26 Cb 0.36 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 1hdn h ALA 26 CO 0.01 0.20 -0.23 0.87 0.00 0.00 0.00 179.25 180.09 1hdn h LYS 27 N 0.21 -0.20 0.00 0.00 1.79 -1.36 -2.85 116.57 114.16 1hdn h LYS 27 Ca 0.05 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.52 1hdn h LYS 27 Cb 0.13 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1hdn h LYS 27 CO 0.00 -0.13 -0.08 0.78 -1.08 0.00 0.00 179.45 178.94 1hdn h GLY 28 N -0.20 0.00 -6.75 3.86 0.00 -1.74 -3.41 103.07 94.82 1hdn h GLY 28 Ca 0.16 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.92 1hdn h GLY 28 CO -0.44 0.00 1.20 -1.36 0.00 0.00 0.00 176.54 175.94 1hdn s PHE 29 N -4.61 2.01 0.35 5.60 0.08 -1.08 -4.88 117.98 115.46 1hdn s PHE 29 Ca -0.04 0.62 0.13 0.00 0.12 0.00 0.00 56.93 57.76 1hdn s PHE 29 Cb 0.15 -4.16 0.97 0.00 -0.57 0.00 0.00 43.02 39.41 1hdn s PHE 29 CO 0.62 -2.69 1.75 1.15 -0.10 0.00 0.00 175.22 175.95 1hdn h THR 30 N 6.63 0.54 -3.94 0.64 2.02 -1.85 -3.42 112.91 113.51 1hdn h THR 30 Ca -0.32 -0.17 -0.54 0.00 0.77 0.00 0.00 66.41 66.15 1hdn h THR 30 Cb 1.15 -0.02 0.10 0.00 -1.74 0.00 0.00 68.15 67.65 1hdn h THR 30 CO 1.04 0.09 0.76 -0.44 0.37 0.00 0.00 175.52 177.34 1hdn s SER 31 N -5.23 6.33 -0.59 4.18 0.01 -1.26 -4.92 113.70 112.21 1hdn s SER 31 Ca -0.10 3.01 -0.20 0.00 1.31 0.00 0.00 55.95 59.97 1hdn s SER 31 Cb 0.26 -2.67 0.08 0.00 0.21 0.00 0.00 66.02 63.91 1hdn s SER 31 CO 0.80 -0.88 0.78 -0.70 0.41 0.00 0.00 173.24 173.65 1hdn s GLU 32 N -2.11 3.10 -1.14 12.44 2.12 -0.79 -4.91 118.70 127.40 1hdn s GLU 32 Ca 0.53 -1.02 -0.22 0.00 0.36 0.00 0.00 54.97 54.62 1hdn s GLU 32 Cb -0.46 -4.21 -0.05 0.00 0.26 0.00 0.00 34.13 29.67 1hdn s GLU 32 CO 0.62 -1.55 1.89 0.42 -0.54 0.00 0.00 175.26 176.09 1hdn s ILE 33 N 3.17 3.63 -0.54 -3.70 -1.09 -1.26 -1.26 121.20 120.14 1hdn s ILE 33 Ca 0.17 -0.96 -0.28 0.00 -2.23 0.00 0.00 60.65 57.35 1hdn s ILE 33 Cb -0.20 -4.58 0.00 0.00 -1.58 0.00 0.00 42.46 36.10 1hdn s ILE 33 CO 0.09 -1.17 1.57 -0.89 -1.23 0.00 0.00 174.94 173.31 1hdn s THR 34 N 9.62 3.64 -0.98 2.92 2.01 -0.62 -1.54 115.64 130.70 1hdn s THR 34 Ca 0.66 0.54 -0.13 0.00 0.31 0.00 0.00 61.69 63.07 1hdn s THR 34 Cb -0.01 -4.22 0.23 0.00 0.01 0.00 0.00 72.50 68.51 1hdn s THR 34 CO 0.09 -1.01 0.99 -0.69 -0.69 0.00 0.00 174.62 173.31 1hdn s VAL 35 N 6.84 5.63 -0.74 3.82 1.01 0.34 -0.23 120.40 137.07 1hdn s VAL 35 Ca 0.59 -2.75 -0.22 0.00 0.00 0.00 0.00 61.98 59.60 1hdn s VAL 35 Cb -0.13 -4.59 0.07 0.00 0.00 0.00 0.00 36.38 31.74 1hdn s VAL 35 CO 0.25 -1.18 1.06 -0.89 0.00 0.00 0.00 175.10 174.34 1hdn s THR 36 N -0.00 4.29 -0.85 3.92 2.01 -0.97 -1.89 115.64 122.14 1hdn s THR 36 Ca 0.26 -0.49 -0.25 0.00 0.31 0.00 0.00 61.69 61.52 1hdn s THR 36 Cb -0.09 -4.75 -0.04 0.00 0.01 0.00 0.00 72.50 67.63 1hdn s THR 36 CO -0.08 -1.55 1.89 -0.55 -0.69 0.00 0.00 174.62 173.65 1hdn s SER 37 N 3.77 5.25 0.00 3.53 0.15 -1.14 -0.61 113.70 124.64 1hdn s SER 37 Ca 0.27 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.41 1hdn s SER 37 Cb -0.13 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1hdn s SER 37 CO 0.06 -2.59 0.00 -0.46 1.20 0.00 0.00 173.24 171.45 1hdn n ASN 38 N 13.40 0.00 0.00 5.45 0.23 0.17 -2.88 115.26 131.63 1hdn n ASN 38 Ca 0.35 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.40 1hdn n ASN 38 Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 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 0.14 2.03 3.85 4.83 0.00 -1.26 -5.01 105.19 109.77 1hdn n GLY 39 Ca 0.00 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 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 3.80 -0.02 1.61 3.01 -1.14 -5.06 119.74 121.94 1hdn s LYS 40 Ca 0.00 0.28 -0.30 0.00 -1.01 0.00 0.00 55.97 54.94 1hdn s LYS 40 Cb 0.00 -3.21 -0.03 0.00 -1.01 0.00 0.00 37.83 33.58 1hdn s LYS 40 CO 0.00 0.71 1.04 -1.12 0.51 0.00 0.00 175.35 176.50 1hdn s SER 41 N -1.08 7.26 0.40 2.83 0.01 -1.26 -2.90 113.70 118.97 1hdn s SER 41 Ca 0.22 1.71 0.07 0.00 1.31 0.00 0.00 55.95 59.26 1hdn s SER 41 Cb -0.16 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.44 1hdn s SER 41 CO 0.11 -0.37 0.07 0.00 0.41 0.00 0.00 173.24 173.46 1hdn s ALA 42 N 1.35 3.31 -0.07 1.44 0.00 -0.80 -4.97 121.76 122.02 1hdn s ALA 42 Ca 0.53 -2.21 0.01 0.00 0.00 0.00 0.00 51.96 50.28 1hdn s ALA 42 Cb -0.22 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 22.86 1hdn s ALA 42 CO 0.25 -0.12 -0.06 0.45 0.00 0.00 0.00 175.76 176.29 1hdn s SER 43 N -3.78 1.44 0.49 0.00 0.15 -1.26 -0.51 113.70 110.24 1hdn s SER 43 Ca 0.37 -0.18 0.14 0.00 0.70 0.00 0.00 55.95 56.98 1hdn s SER 43 Cb 0.07 -0.59 1.17 0.00 -1.71 0.00 0.00 66.02 64.96 1hdn s SER 43 CO 0.20 -0.08 2.13 0.00 1.20 0.00 0.00 173.24 176.69 1hdn h ALA 44 N 7.53 1.93 -0.12 5.45 0.00 -1.61 -1.93 119.26 130.50 1hdn h ALA 44 Ca -0.32 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.40 1hdn h ALA 44 Cb 1.15 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1hdn h ALA 44 CO 0.42 0.07 -0.68 0.87 0.00 0.00 0.00 179.25 179.93 1hdn h LYS 45 N 0.13 0.51 -4.57 0.00 1.57 -1.85 -3.32 116.57 109.04 1hdn h LYS 45 Ca 0.04 -0.38 -0.72 0.00 -1.87 0.00 0.00 60.65 57.72 1hdn h LYS 45 Cb -0.01 0.07 -0.21 0.00 0.08 0.00 0.00 32.23 32.16 1hdn h LYS 45 CO -0.01 1.01 -0.07 0.45 -0.57 0.00 0.00 179.45 180.26 1hdn s SER 46 N -6.98 6.19 0.02 0.86 0.15 -0.73 -4.85 113.70 108.36 1hdn s SER 46 Ca -0.07 -1.32 -0.04 0.00 0.70 0.00 0.00 55.95 55.22 1hdn s SER 46 Cb 0.10 -2.25 -0.01 0.00 -1.71 0.00 0.00 66.02 62.15 1hdn s SER 46 CO 0.85 -0.90 1.07 0.25 1.20 0.00 0.00 173.24 175.71 1hdn h LEU 47 N 9.42 -0.25 -0.67 3.45 5.85 -1.82 -0.65 115.31 130.64 1hdn h LEU 47 Ca -0.29 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.43 1hdn h LEU 47 Cb 1.10 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1hdn h LEU 47 CO 1.00 -0.05 0.27 -0.26 -0.34 0.00 0.00 178.44 179.07 1hdn h PHE 48 N -0.04 1.02 -0.95 1.25 0.04 -1.94 -0.60 116.94 115.73 1hdn h PHE 48 Ca 0.01 -0.08 0.09 0.00 2.80 0.00 0.00 57.97 60.80 1hdn h PHE 48 Cb 0.07 -0.31 -0.07 0.00 2.20 0.00 0.00 35.95 37.84 1hdn h PHE 48 CO -0.70 0.79 0.59 -0.22 -0.60 0.00 0.00 178.31 178.17 1hdn h LYS 49 N 0.95 0.98 -0.12 1.51 3.64 -1.87 -0.42 116.57 121.24 1hdn h LYS 49 Ca 0.23 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1hdn h LYS 49 Cb 0.20 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1hdn h LYS 49 CO -0.02 0.65 -0.05 1.25 -2.27 0.00 0.00 179.45 179.01 1hdn h LEU 50 N 1.01 0.26 -2.13 5.20 5.85 -0.59 -3.30 115.31 121.60 1hdn h LEU 50 Ca 0.44 -0.40 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1hdn h LEU 50 Cb 0.32 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 1hdn h LEU 50 CO -0.22 0.60 -0.07 1.56 -0.34 0.00 0.00 178.44 179.96 1hdn h GLN 51 N -0.09 0.00 0.00 1.25 4.20 -0.73 -2.48 115.11 117.26 1hdn h GLN 51 Ca 0.03 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.58 1hdn h GLN 51 Cb 0.49 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1hdn h GLN 51 CO 0.02 0.07 -0.78 0.00 -0.67 0.00 0.00 178.83 177.47 1hdn h THR 52 N 0.00 1.36 -3.93 -0.54 1.03 -1.16 -3.47 112.91 106.20 1hdn h THR 52 Ca -0.00 -2.86 -0.46 0.00 -0.01 0.00 0.00 66.41 63.08 1hdn h THR 52 Cb 0.24 2.63 0.08 0.00 -1.07 0.00 0.00 68.15 70.03 1hdn h THR 52 CO 0.01 0.76 0.26 -0.76 -0.01 0.00 0.00 175.52 175.78 1hdn s LEU 53 N -6.66 2.84 -0.26 0.00 2.01 -0.94 -5.04 118.68 110.63 1hdn s LEU 53 Ca 0.02 0.59 -0.29 0.00 0.01 0.00 0.00 54.13 54.46 1hdn s LEU 53 Cb 0.09 -3.25 0.00 0.00 0.01 0.00 0.00 46.19 43.04 1hdn s LEU 53 CO 0.78 -1.55 1.21 -0.83 1.01 0.00 0.00 176.35 176.98 1hdn s GLY 54 N -4.48 1.53 -0.54 -3.19 0.00 -1.26 -4.96 107.32 94.41 1hdn s GLY 54 Ca 0.59 0.17 0.06 0.00 0.00 0.00 0.00 44.72 45.54 1hdn s GLY 54 CO 0.46 2.45 0.90 1.04 0.00 0.00 0.00 173.10 177.94 1hdn n LEU 55 N 7.04 3.78 0.00 0.66 4.77 -1.26 -4.82 117.00 127.17 1hdn n LEU 55 Ca 0.14 -5.55 0.00 0.00 -0.03 0.00 0.00 56.01 50.57 1hdn n LEU 55 Cb 0.46 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1hdn n LEU 55 CO 0.59 2.33 0.00 1.07 -1.33 0.00 0.00 177.39 180.05 1hdn n THR 56 N -0.09 0.00 -1.47 -5.08 5.66 -1.26 -1.39 114.28 110.65 1hdn n THR 56 Ca 0.30 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.85 1hdn n THR 56 Cb 0.44 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.13 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 0.66 0.00 1.09 7.27 -1.16 -1.57 117.38 123.68 1hdn n GLN 57 Ca 0.00 0.11 0.00 0.00 0.07 0.00 0.00 57.00 57.18 1hdn n GLN 57 Cb 0.00 -2.34 0.00 0.00 2.41 0.00 0.00 30.24 30.31 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 6.49 3.03 3.69 1.69 0.00 0.28 -4.99 105.19 115.37 1hdn n GLY 58 Ca 0.49 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.08 1hdn n GLY 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hdn s THR 59 N -2.80 3.59 -0.25 2.61 -4.23 -0.61 -4.63 115.64 109.32 1hdn s THR 59 Ca 0.00 0.98 -0.13 0.00 -1.18 0.00 0.00 61.69 61.37 1hdn s THR 59 Cb 0.00 -3.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 1hdn s THR 59 CO 0.00 -0.00 0.27 -0.69 -0.54 0.00 0.00 174.62 173.65 1hdn s VAL 60 N 2.44 5.27 -0.45 2.29 1.01 -1.26 -1.64 120.40 128.06 1hdn s VAL 60 Ca 0.66 0.38 -0.11 0.00 0.00 0.00 0.00 61.98 62.91 1hdn s VAL 60 Cb -0.33 -3.60 0.09 0.00 0.00 0.00 0.00 36.38 32.54 1hdn s VAL 60 CO 0.27 0.26 0.32 0.68 0.00 0.00 0.00 175.10 176.63 1hdn s VAL 61 N 1.54 4.48 -1.04 2.92 -7.23 0.11 -0.65 120.40 120.51 1hdn s VAL 61 Ca 0.11 -1.44 -0.21 0.00 -1.81 0.00 0.00 61.98 58.64 1hdn s VAL 61 Cb -0.15 -3.78 0.08 0.00 0.56 0.00 0.00 36.38 33.09 1hdn s VAL 61 CO 0.08 -0.61 1.40 0.42 -0.31 0.00 0.00 175.10 176.08 1hdn s THR 62 N 1.46 4.24 -0.81 5.32 -4.23 0.22 -1.61 115.64 120.23 1hdn s THR 62 Ca 0.04 -1.25 -0.25 0.00 -1.18 0.00 0.00 61.69 59.05 1hdn s THR 62 Cb -0.24 -4.99 -0.02 0.00 1.34 0.00 0.00 72.50 68.59 1hdn s THR 62 CO 0.02 -1.81 1.79 -0.63 -0.54 0.00 0.00 174.62 173.45 1hdn s ILE 63 N 4.04 3.51 -0.97 2.99 1.01 -0.99 -2.30 121.20 128.49 1hdn s ILE 63 Ca 0.43 -0.16 -0.10 0.00 0.00 0.00 0.00 60.65 60.82 1hdn s ILE 63 Cb -0.01 -4.22 0.25 0.00 0.01 0.00 0.00 42.46 38.49 1hdn s ILE 63 CO -0.07 -1.16 0.93 -0.55 0.00 0.00 0.00 174.94 174.09 1hdn s SER 64 N 7.23 6.93 -0.69 3.58 0.15 0.68 -2.26 113.70 129.31 1hdn s SER 64 Ca 0.62 -3.25 -0.27 0.00 0.70 0.00 0.00 55.95 53.75 1hdn s SER 64 Cb -0.08 -2.17 0.02 0.00 -1.71 0.00 0.00 66.02 62.08 1hdn s SER 64 CO 0.06 -0.38 1.44 0.00 1.20 0.00 0.00 173.24 175.56 1hdn s ALA 65 N -0.71 2.60 -0.07 5.45 0.00 -0.68 -1.60 121.76 126.77 1hdn s ALA 65 Ca 0.25 -1.13 -0.14 0.00 0.00 0.00 0.00 51.96 50.94 1hdn s ALA 65 Cb -0.10 -4.26 -0.05 0.00 0.00 0.00 0.00 23.12 18.71 1hdn s ALA 65 CO -0.09 -3.42 0.36 -1.83 0.00 0.00 0.00 175.76 170.79 1hdn s GLU 66 N 6.06 4.00 0.00 0.00 -1.05 -0.39 -2.06 118.70 125.27 1hdn s GLU 66 Ca 0.45 0.29 0.00 0.00 -0.15 0.00 0.00 54.97 55.56 1hdn s GLU 66 Cb -0.09 -3.29 0.00 0.00 -0.44 0.00 0.00 34.13 30.30 1hdn s GLU 66 CO 0.17 0.52 0.00 0.41 0.95 0.00 0.00 175.26 177.32 1hdn n GLY 67 N 2.39 0.22 0.24 -3.83 0.00 -1.26 -1.89 105.19 101.06 1hdn n GLY 67 Ca -0.13 -1.86 0.10 0.00 0.00 0.00 0.00 46.02 44.13 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 0.00 -0.02 1.61 5.08 -1.94 -2.80 114.58 116.52 1hdn h GLU 68 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1hdn h GLU 68 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1hdn h GLU 68 CO 0.00 0.19 -0.11 -0.25 -1.00 0.00 0.00 179.01 177.84 1hdn n ASP 69 N -3.63 2.04 0.00 1.42 8.00 -1.26 -4.92 116.55 118.21 1hdn n ASP 69 Ca -0.01 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 53.97 1hdn n ASP 69 Cb 0.32 0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 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 0.52 0.00 -0.03 -1.24 0.28 -1.06 -1.34 120.64 117.77 1hdn n GLU 70 Ca 0.08 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.94 1hdn n GLU 70 Cb 0.37 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.14 1hdn n GLU 70 CO 0.00 0.00 0.00 -0.56 -0.16 0.00 0.00 177.13 176.41 1hdn h GLN 71 N 0.00 0.16 -0.60 3.44 -0.00 -1.90 -2.86 115.11 113.35 1hdn h GLN 71 Ca 0.00 -0.12 0.12 0.00 -0.00 0.00 0.00 58.65 58.64 1hdn h GLN 71 Cb 0.00 0.03 -0.04 0.00 -0.00 0.00 0.00 27.48 27.47 1hdn h GLN 71 CO 0.00 0.78 0.41 0.87 -0.00 0.00 0.00 178.83 180.88 1hdn h LYS 72 N -0.43 0.30 0.35 0.06 1.57 -1.74 -2.01 116.57 114.68 1hdn h LYS 72 Ca -0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1hdn h LYS 72 Cb 0.80 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1hdn h LYS 72 CO 0.03 0.20 -0.17 0.00 -0.57 0.00 0.00 179.45 178.94 1hdn h ALA 73 N 1.70 -0.67 -0.91 3.86 0.00 -1.13 -3.18 119.26 118.94 1hdn h ALA 73 Ca 0.28 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.20 1hdn h ALA 73 Cb 0.69 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 1hdn h ALA 73 CO -0.07 -0.63 0.55 0.28 0.00 0.00 0.00 179.25 179.37 1hdn h VAL 74 N -0.76 0.92 -0.42 0.00 2.07 -1.34 -2.60 116.25 114.13 1hdn h VAL 74 Ca -0.05 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.21 1hdn h VAL 74 Cb 0.36 -0.05 -0.08 0.00 -1.52 0.00 0.00 31.29 30.00 1hdn h VAL 74 CO 0.08 0.16 -0.52 -0.08 0.02 0.00 0.00 177.57 177.23 1hdn h GLU 75 N 0.90 -0.33 -0.17 1.57 4.81 -1.44 0.57 114.58 120.49 1hdn h GLU 75 Ca 0.44 0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.63 1hdn h GLU 75 Cb 0.41 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 1hdn h GLU 75 CO -0.25 -0.22 -0.14 1.25 -0.73 0.00 0.00 179.01 178.92 1hdn h HIS 76 N -0.34 0.48 -0.50 0.92 2.76 -1.48 -0.73 115.15 116.25 1hdn h HIS 76 Ca 0.07 -0.13 -0.01 0.00 -2.20 0.00 0.00 60.37 58.09 1hdn h HIS 76 Cb 0.54 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 1hdn h HIS 76 CO -0.74 0.75 0.26 -0.07 -1.30 0.00 0.00 177.93 176.83 1hdn h LEU 77 N 0.06 0.62 0.01 0.26 3.38 -1.14 0.76 115.31 119.26 1hdn h LEU 77 Ca 0.03 -0.05 -0.17 0.00 0.09 0.00 0.00 57.88 57.78 1hdn h LEU 77 Cb 0.66 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1hdn h LEU 77 CO 0.04 0.52 -0.69 0.58 0.09 0.00 0.00 178.44 178.98 1hdn h VAL 78 N 0.70 1.41 -0.63 1.22 2.07 -0.82 -2.47 116.25 117.73 1hdn h VAL 78 Ca 0.18 -2.13 0.13 0.00 0.82 0.00 0.00 66.70 65.70 1hdn h VAL 78 Cb 0.05 2.59 -0.11 0.00 -1.52 0.00 0.00 31.29 32.30 1hdn h VAL 78 CO -0.03 0.62 -0.01 0.50 0.02 0.00 0.00 177.57 178.68 1hdn h LYS 79 N -0.03 0.10 0.90 1.57 3.64 -0.68 -0.60 116.57 121.47 1hdn h LYS 79 Ca -0.09 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 1hdn h LYS 79 Cb 1.39 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 33.20 1hdn h LYS 79 CO 0.13 0.07 -0.45 -0.07 -2.27 0.00 0.00 179.45 176.87 1hdn h LEU 80 N 0.11 -1.07 -1.80 5.20 3.38 -0.90 -3.09 115.31 117.14 1hdn h LEU 80 Ca 0.33 0.04 0.24 0.00 0.09 0.00 0.00 57.88 58.58 1hdn h LEU 80 Cb 0.54 0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1hdn h LEU 80 CO -0.55 -0.75 0.75 0.24 0.09 0.00 0.00 178.44 178.22 1hdn h MET 81 N -1.23 0.00 0.00 1.13 2.86 -1.12 -1.98 114.93 114.59 1hdn h MET 81 Ca -0.12 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1hdn h MET 81 Cb 0.95 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.61 1hdn h MET 81 CO 0.19 0.00 -0.08 0.00 1.06 0.00 0.00 176.91 178.08 1hdn h ALA 82 N 1.27 1.26 -1.06 6.32 0.00 -1.02 -3.09 119.26 122.94 1hdn h ALA 82 Ca 0.39 -0.07 -0.52 0.00 0.00 0.00 0.00 54.91 54.70 1hdn h ALA 82 Cb 1.88 -0.01 -0.42 0.00 0.00 0.00 0.00 17.79 19.24 1hdn h ALA 82 CO -0.00 0.10 -0.84 -0.85 0.00 0.00 0.00 179.25 177.66 1hdn n GLU 83 N -3.55 3.18 0.00 0.00 0.28 -0.74 -4.86 120.64 114.93 1hdn n GLU 83 Ca -0.02 -4.18 0.00 0.00 -0.16 0.00 0.00 57.16 52.80 1hdn n GLU 83 Cb 0.20 -2.12 0.00 0.00 1.43 0.00 0.00 31.44 30.95 1hdn n GLU 83 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1hdn n LEU 84 N -0.55 0.00 0.00 -1.84 4.77 -1.17 -5.12 117.00 113.10 1hdn n LEU 84 Ca 0.36 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.43 1hdn n LEU 84 Cb 0.81 0.00 0.54 0.00 -2.33 0.00 0.00 43.42 42.45 1hdn n LEU 84 CO 0.33 0.00 0.74 -0.62 -1.33 0.00 0.00 177.39 176.51