#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 1.89 -0.05 1.12 5.36 0.03 -5.00 117.98 121.34 1hdn s PHE 2 Ca 0.00 -0.70 0.01 0.00 -0.96 0.00 0.00 56.93 55.28 1hdn s PHE 2 Cb 0.00 -1.31 0.02 0.00 -0.34 0.00 0.00 43.02 41.40 1hdn s PHE 2 CO 0.00 -0.30 -0.03 1.14 -1.46 0.00 0.00 175.22 174.57 1hdn s GLN 3 N 0.41 0.71 -0.09 10.12 -2.07 -1.26 -0.32 119.66 127.16 1hdn s GLN 3 Ca -0.14 -0.04 0.02 0.00 -1.82 0.00 0.00 55.36 53.38 1hdn s GLN 3 Cb -0.16 -0.80 0.01 0.00 -1.09 0.00 0.00 33.01 30.98 1hdn s GLN 3 CO 0.05 -0.12 -0.15 -0.65 -1.32 0.00 0.00 175.29 173.09 1hdn s GLN 4 N 1.08 2.16 0.07 9.60 -1.52 -0.63 -4.99 119.66 125.43 1hdn s GLN 4 Ca -0.09 -0.55 -0.25 0.00 -1.95 0.00 0.00 55.36 52.52 1hdn s GLN 4 Cb -0.14 -1.77 -0.06 0.00 -0.22 0.00 0.00 33.01 30.82 1hdn s GLN 4 CO -0.01 0.01 0.77 -2.00 -0.25 0.00 0.00 175.29 173.81 1hdn s GLU 5 N 0.77 4.51 0.01 2.91 2.12 -1.26 -0.63 118.70 127.13 1hdn s GLU 5 Ca -0.11 1.09 0.06 0.00 0.36 0.00 0.00 54.97 56.36 1hdn s GLU 5 Cb -0.16 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.88 1hdn s GLU 5 CO 0.02 0.35 -0.17 0.08 -0.54 0.00 0.00 175.26 175.00 1hdn s VAL 6 N -0.32 1.38 -0.12 3.70 1.01 0.88 -4.96 120.40 121.97 1hdn s VAL 6 Ca 0.38 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 1hdn s VAL 6 Cb -0.21 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1hdn s VAL 6 CO 0.24 0.26 0.02 -0.89 0.00 0.00 0.00 175.10 174.73 1hdn s THR 7 N -0.59 4.45 -0.10 3.92 2.01 -1.26 -2.30 115.64 121.76 1hdn s THR 7 Ca 0.06 -0.18 -0.03 0.00 0.31 0.00 0.00 61.69 61.85 1hdn s THR 7 Cb -0.07 -2.91 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 1hdn s THR 7 CO 0.00 0.56 0.02 -0.63 -0.69 0.00 0.00 174.62 173.89 1hdn s ILE 8 N -0.49 4.48 -0.21 1.82 -1.09 -1.26 -4.91 121.20 119.55 1hdn s ILE 8 Ca 0.09 -0.18 0.05 0.00 -2.23 0.00 0.00 60.65 58.38 1hdn s ILE 8 Cb -0.12 -2.90 -0.16 0.00 -1.58 0.00 0.00 42.46 37.70 1hdn s ILE 8 CO 0.02 0.60 -0.13 0.35 -1.23 0.00 0.00 174.94 174.55 1hdn n THR 9 N 2.24 1.23 -1.66 2.92 -2.24 -1.26 -3.98 114.28 111.53 1hdn n THR 9 Ca -0.19 -0.54 -0.54 0.00 -2.27 0.00 0.00 64.05 60.51 1hdn n THR 9 Cb 0.54 -1.09 -0.06 0.00 -2.10 0.00 0.00 70.33 67.61 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 -3.01 -0.36 0.05 6.98 0.00 -1.26 -4.75 120.51 118.16 1hdn n ALA 10 Ca -0.36 0.43 -0.11 0.00 0.00 0.00 0.00 53.44 53.41 1hdn n ALA 10 Cb 0.95 -2.19 -0.04 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 6.24 -0.22 -0.58 0.00 0.11 -1.99 -2.21 132.00 133.35 1hdn h PRO 11 Ca -0.47 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1hdn h PRO 11 Cb 1.32 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.45 1hdn h PRO 11 CO 0.88 -0.15 0.21 -2.95 -0.21 0.00 0.00 178.00 175.79 1hdn h ASN 12 N -0.23 0.82 0.00 -2.05 -1.07 -1.97 -3.42 115.58 107.67 1hdn h ASN 12 Ca 0.05 -0.18 0.00 0.00 0.07 0.00 0.00 56.30 56.24 1hdn h ASN 12 Cb 0.30 -0.21 0.00 0.00 -2.07 0.00 0.00 38.32 36.33 1hdn h ASN 12 CO -0.15 0.78 0.00 0.61 0.07 0.00 0.00 177.43 178.74 1hdn n GLY 13 N -0.78 -0.77 3.53 9.14 0.00 -0.83 -4.62 105.19 110.87 1hdn n GLY 13 Ca 0.03 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 1hdn n GLY 13 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hdn s LEU 14 N 0.00 4.34 0.00 0.99 1.02 0.72 -4.95 118.68 120.81 1hdn s LEU 14 Ca 0.00 -2.65 0.00 0.00 0.02 0.00 0.00 54.13 51.50 1hdn s LEU 14 Cb 0.00 -2.50 0.00 0.00 0.02 0.00 0.00 46.19 43.71 1hdn s LEU 14 CO 0.00 -1.00 0.00 0.00 0.02 0.00 0.00 176.35 175.37 1hdn n HIS 15 N 7.25 -3.27 -0.33 0.29 1.44 -1.26 -4.48 115.22 114.87 1hdn n HIS 15 Ca 0.43 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 56.16 1hdn n HIS 15 Cb 0.45 0.00 0.07 0.00 0.12 0.00 0.00 29.99 30.63 1hdn n HIS 15 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 1hdn n THR 16 N -2.01 -0.42 0.01 0.61 -1.04 -1.26 -0.57 114.28 109.59 1hdn n THR 16 Ca 0.00 2.02 -0.13 0.00 -2.04 0.00 0.00 64.05 63.91 1hdn n THR 16 Cb 0.00 -2.73 -0.10 0.00 -1.82 0.00 0.00 70.33 65.69 1hdn n THR 16 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1hdn h ARG 17 N 0.00 -0.06 -0.56 -2.82 2.43 -1.97 0.29 114.38 111.69 1hdn h ARG 17 Ca 0.35 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.48 1hdn h ARG 17 Cb 0.57 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1hdn h ARG 17 CO -0.88 0.42 0.18 -1.35 -1.51 0.00 0.00 179.97 176.83 1hdn h PRO 18 N -0.56 0.86 -0.57 0.20 0.11 -1.81 -3.15 132.00 127.08 1hdn h PRO 18 Ca -0.01 -0.18 0.06 0.00 0.11 0.00 0.00 66.00 65.98 1hdn h PRO 18 Cb 0.50 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 31.43 1hdn h PRO 18 CO 0.01 0.77 0.28 0.00 -0.21 0.00 0.00 178.00 178.85 1hdn h ALA 19 N 1.04 0.74 -0.89 -0.75 0.00 -0.77 -0.61 119.26 118.03 1hdn h ALA 19 Ca 0.18 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.25 1hdn h ALA 19 Cb 0.27 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1hdn h ALA 19 CO -0.01 -0.08 0.51 0.00 0.00 0.00 0.00 179.25 179.68 1hdn h ALA 20 N 1.33 1.33 -0.07 0.00 0.00 -0.91 0.13 119.26 121.07 1hdn h ALA 20 Ca 0.26 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1hdn h ALA 20 Cb 0.21 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1hdn h ALA 20 CO -0.20 0.07 -0.10 0.37 0.00 0.00 0.00 179.25 179.40 1hdn h GLN 21 N 0.80 0.18 -1.00 0.00 4.15 -1.32 -2.81 115.11 115.11 1hdn h GLN 21 Ca 0.45 -0.11 0.06 0.00 0.77 0.00 0.00 58.65 59.83 1hdn h GLN 21 Cb 0.51 0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.14 1hdn h GLN 21 CO -0.29 0.67 0.65 0.35 -1.93 0.00 0.00 178.83 178.27 1hdn h PHE 22 N -0.28 1.20 0.15 3.99 3.04 -0.47 -0.53 116.94 124.05 1hdn h PHE 22 Ca 0.01 0.03 0.01 0.00 3.98 0.00 0.00 57.97 62.00 1hdn h PHE 22 Cb 0.65 -0.40 -0.02 0.00 2.56 0.00 0.00 35.95 38.74 1hdn h PHE 22 CO 0.10 0.64 -0.22 0.28 -2.02 0.00 0.00 178.31 177.09 1hdn h VAL 23 N 1.19 0.51 -0.47 1.41 2.07 -0.79 -0.02 116.25 120.14 1hdn h VAL 23 Ca 0.43 0.00 0.05 0.00 0.82 0.00 0.00 66.70 68.00 1hdn h VAL 23 Cb 0.14 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 1hdn h VAL 23 CO -0.17 0.00 0.21 0.11 0.02 0.00 0.00 177.57 177.75 1hdn h LYS 24 N -0.44 0.41 -0.10 1.57 1.57 -1.00 0.23 116.57 118.81 1hdn h LYS 24 Ca 0.02 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1hdn h LYS 24 Cb 0.44 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1hdn h LYS 24 CO -0.10 0.27 0.06 1.49 -0.57 0.00 0.00 179.45 180.60 1hdn h GLU 25 N 0.42 0.13 -0.97 3.15 4.57 -1.02 -2.55 114.58 118.32 1hdn h GLU 25 Ca 0.21 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.46 1hdn h GLU 25 Cb 0.16 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 28.65 1hdn h GLU 25 CO -0.18 0.15 0.61 0.00 -1.18 0.00 0.00 179.01 178.41 1hdn h ALA 26 N 0.98 1.38 -0.70 2.92 0.00 -0.82 -1.05 119.26 121.96 1hdn h ALA 26 Ca 0.03 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1hdn h ALA 26 Cb 0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1hdn h ALA 26 CO -0.01 0.32 0.46 0.87 0.00 0.00 0.00 179.25 180.90 1hdn h LYS 27 N 1.06 0.77 -0.23 0.00 1.57 -0.63 -2.82 116.57 116.29 1hdn h LYS 27 Ca 0.44 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 59.00 1hdn h LYS 27 Cb 0.28 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1hdn h LYS 27 CO -0.21 0.51 -0.55 0.78 -0.57 0.00 0.00 179.45 179.41 1hdn h GLY 28 N 0.79 0.85 -5.62 3.86 0.00 -0.82 -3.44 103.07 98.69 1hdn h GLY 28 Ca 0.29 -1.05 -0.56 0.00 0.00 0.00 0.00 47.33 46.01 1hdn h GLY 28 CO -0.09 0.94 1.07 -1.36 0.00 0.00 0.00 176.54 177.10 1hdn s PHE 29 N -4.00 2.21 0.20 5.60 0.08 -0.75 -4.93 117.98 116.38 1hdn s PHE 29 Ca -0.11 0.52 -0.14 0.00 0.12 0.00 0.00 56.93 57.32 1hdn s PHE 29 Cb 0.09 -3.87 0.21 0.00 -0.57 0.00 0.00 43.02 38.88 1hdn s PHE 29 CO 0.87 -2.99 1.65 1.79 -0.10 0.00 0.00 175.22 176.44 1hdn h THR 30 N 5.83 0.46 -3.93 0.64 1.35 -1.85 -3.43 112.91 111.98 1hdn h THR 30 Ca -0.34 -0.01 -0.53 0.00 -0.55 0.00 0.00 66.41 64.98 1hdn h THR 30 Cb 1.15 0.43 0.09 0.00 -1.73 0.00 0.00 68.15 68.09 1hdn h THR 30 CO 0.98 0.01 0.71 -0.94 -0.25 0.00 0.00 175.52 176.03 1hdn s SER 31 N -5.23 6.39 -0.90 5.36 1.04 -1.26 -4.83 113.70 114.27 1hdn s SER 31 Ca -0.14 2.89 -0.25 0.00 0.48 0.00 0.00 55.95 58.94 1hdn s SER 31 Cb 0.18 -2.66 0.02 0.00 0.10 0.00 0.00 66.02 63.66 1hdn s SER 31 CO 0.73 -0.82 1.55 -0.70 0.98 0.00 0.00 173.24 174.97 1hdn s GLU 32 N -2.08 3.21 -1.05 4.02 2.56 0.62 -4.82 118.70 121.16 1hdn s GLU 32 Ca 0.53 -0.60 -0.24 0.00 0.00 0.00 0.00 54.97 54.66 1hdn s GLU 32 Cb -0.43 -4.95 -0.08 0.00 2.00 0.00 0.00 34.13 30.67 1hdn s GLU 32 CO 0.58 -2.47 1.97 0.42 -0.56 0.00 0.00 175.26 175.20 1hdn s ILE 33 N 6.52 3.45 -0.33 -3.70 -1.09 -1.26 -3.12 121.20 121.66 1hdn s ILE 33 Ca 0.50 -0.61 -0.27 0.00 -2.23 0.00 0.00 60.65 58.05 1hdn s ILE 33 Cb -0.04 -4.24 0.01 0.00 -1.58 0.00 0.00 42.46 36.61 1hdn s ILE 33 CO 0.00 -0.87 0.96 -0.89 -1.23 0.00 0.00 174.94 172.91 1hdn s THR 34 N 11.22 4.60 -0.53 2.92 2.01 0.46 -0.73 115.64 135.59 1hdn s THR 34 Ca 0.71 1.43 -0.15 0.00 0.31 0.00 0.00 61.69 63.99 1hdn s THR 34 Cb -0.04 -4.32 0.13 0.00 0.01 0.00 0.00 72.50 68.28 1hdn s THR 34 CO 0.08 -0.44 0.48 -0.69 -0.69 0.00 0.00 174.62 173.35 1hdn s VAL 35 N 3.43 5.04 -0.68 3.82 1.01 0.44 -0.99 120.40 132.46 1hdn s VAL 35 Ca 0.40 -1.57 -0.22 0.00 0.00 0.00 0.00 61.98 60.59 1hdn s VAL 35 Cb -0.13 -4.24 0.08 0.00 0.00 0.00 0.00 36.38 32.09 1hdn s VAL 35 CO 0.16 -0.86 0.98 -0.89 0.00 0.00 0.00 175.10 174.49 1hdn s THR 36 N 1.53 4.37 -0.40 3.92 2.01 -0.25 -1.50 115.64 125.32 1hdn s THR 36 Ca 0.04 -0.49 -0.14 0.00 0.31 0.00 0.00 61.69 61.41 1hdn s THR 36 Cb -0.29 -4.69 0.02 0.00 0.01 0.00 0.00 72.50 67.55 1hdn s THR 36 CO 0.02 -1.46 0.27 -0.55 -0.69 0.00 0.00 174.62 172.22 1hdn s SER 37 N 3.69 5.99 -0.16 3.53 0.15 -0.47 -0.52 113.70 125.91 1hdn s SER 37 Ca 0.23 -0.94 -0.06 0.00 0.70 0.00 0.00 55.95 55.88 1hdn s SER 37 Cb -0.16 -2.12 0.01 0.00 -1.71 0.00 0.00 66.02 62.04 1hdn s SER 37 CO 0.08 -0.43 0.17 -0.46 1.20 0.00 0.00 173.24 173.79 1hdn n ASN 38 N 5.11 -1.36 0.00 5.45 0.23 0.70 -0.91 115.26 124.48 1hdn n ASN 38 Ca -0.11 -0.14 0.00 0.00 -0.53 0.00 0.00 54.58 53.80 1hdn n ASN 38 Cb 0.47 -0.42 0.00 0.00 -2.08 0.00 0.00 39.78 37.75 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 -0.38 2.74 3.51 4.83 0.00 -1.26 -4.95 105.19 109.68 1hdn n GLY 39 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.05 3.69 -0.50 1.61 1.02 -0.08 -4.97 119.74 120.45 1hdn s LYS 40 Ca 0.00 -1.61 -0.27 0.00 0.02 0.00 0.00 55.97 54.11 1hdn s LYS 40 Cb 0.00 -5.18 -0.01 0.00 -0.52 0.00 0.00 37.83 32.12 1hdn s LYS 40 CO 0.00 -2.00 1.72 -1.12 -0.92 0.00 0.00 175.35 173.03 1hdn s SER 41 N 4.16 5.71 -0.10 2.83 0.01 -1.26 -1.37 113.70 123.67 1hdn s SER 41 Ca 0.41 0.64 -0.01 0.00 1.31 0.00 0.00 55.95 58.31 1hdn s SER 41 Cb -0.02 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.71 1hdn s SER 41 CO -0.07 -1.98 -0.05 0.00 0.41 0.00 0.00 173.24 171.55 1hdn s ALA 42 N 7.55 1.12 0.04 1.44 0.00 -0.56 -4.96 121.76 126.39 1hdn s ALA 42 Ca 0.67 -0.41 -0.33 0.00 0.00 0.00 0.00 51.96 51.90 1hdn s ALA 42 Cb -0.15 -0.84 -0.12 0.00 0.00 0.00 0.00 23.12 22.01 1hdn s ALA 42 CO 0.26 -0.40 1.81 0.45 0.00 0.00 0.00 175.76 177.87 1hdn n SER 43 N 4.95 3.58 0.22 0.00 2.88 -1.26 -0.42 113.62 123.57 1hdn n SER 43 Ca -0.11 1.00 0.07 0.00 -1.33 0.00 0.00 58.87 58.49 1hdn n SER 43 Cb 0.50 -1.44 0.58 0.00 -0.75 0.00 0.00 64.21 63.09 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 8.38 1.88 0.00 -1.46 0.00 -1.29 -3.03 119.26 123.75 1hdn h ALA 44 Ca -0.47 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1hdn h ALA 44 Cb 1.25 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1hdn h ALA 44 CO 0.93 0.09 -0.03 0.87 0.00 0.00 0.00 179.25 181.11 1hdn h LYS 45 N 0.07 0.00 -5.16 0.00 1.57 -1.80 -3.37 116.57 107.88 1hdn h LYS 45 Ca 0.02 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.14 1hdn h LYS 45 Cb 0.08 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.22 1hdn h LYS 45 CO 0.00 0.03 -0.08 0.45 -0.57 0.00 0.00 179.45 179.29 1hdn s SER 46 N -5.68 6.28 0.20 0.86 0.15 -1.14 -4.89 113.70 109.48 1hdn s SER 46 Ca -0.03 -0.25 -0.17 0.00 0.70 0.00 0.00 55.95 56.19 1hdn s SER 46 Cb 0.13 -2.26 0.19 0.00 -1.71 0.00 0.00 66.02 62.37 1hdn s SER 46 CO 0.50 -0.55 1.60 0.25 1.20 0.00 0.00 173.24 176.25 1hdn h LEU 47 N 9.16 -0.89 -0.56 3.45 5.85 -1.88 -1.07 115.31 129.38 1hdn h LEU 47 Ca -0.27 0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.74 1hdn h LEU 47 Cb 1.12 0.49 -0.07 0.00 0.37 0.00 0.00 40.66 42.58 1hdn h LEU 47 CO 0.79 -0.27 0.20 0.15 -0.34 0.00 0.00 178.44 178.97 1hdn h PHE 48 N -0.09 0.34 0.29 1.25 3.57 -1.94 -2.11 116.94 118.26 1hdn h PHE 48 Ca 0.28 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 1hdn h PHE 48 Cb 0.52 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1hdn h PHE 48 CO -0.59 0.09 -0.14 0.87 -2.23 0.00 0.00 178.31 176.31 1hdn h LYS 49 N 0.37 -0.37 -0.24 1.11 1.57 -1.49 -1.14 116.57 116.37 1hdn h LYS 49 Ca 0.28 0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 59.02 1hdn h LYS 49 Cb 0.33 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1hdn h LYS 49 CO -0.29 -0.14 -0.10 1.25 -0.57 0.00 0.00 179.45 179.61 1hdn h LEU 50 N -0.56 0.37 -0.20 2.94 5.85 -1.38 -1.61 115.31 120.73 1hdn h LEU 50 Ca -0.04 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1hdn h LEU 50 Cb 0.41 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1hdn h LEU 50 CO 0.07 0.51 0.06 1.56 -0.34 0.00 0.00 178.44 180.30 1hdn h GLN 51 N 0.37 0.31 0.00 1.25 4.20 -1.20 -3.14 115.11 116.90 1hdn h GLN 51 Ca 0.07 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1hdn h GLN 51 Cb 0.41 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1hdn h GLN 51 CO 0.02 0.41 0.00 0.00 -0.67 0.00 0.00 178.83 178.59 1hdn h THR 52 N 0.15 0.00 -3.22 -0.54 1.03 -0.94 -3.46 112.91 105.94 1hdn h THR 52 Ca 0.06 -0.66 -0.53 0.00 -0.01 0.00 0.00 66.41 65.28 1hdn h THR 52 Cb 0.23 1.63 0.01 0.00 -1.07 0.00 0.00 68.15 68.94 1hdn h THR 52 CO -0.00 0.00 0.56 -0.22 -0.01 0.00 0.00 175.52 175.85 1hdn s LEU 53 N -5.92 4.38 -0.62 0.00 2.96 -0.63 -4.99 118.68 113.87 1hdn s LEU 53 Ca 0.04 2.05 -0.27 0.00 -0.22 0.00 0.00 54.13 55.73 1hdn s LEU 53 Cb 0.08 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.19 1hdn s LEU 53 CO 0.58 -0.46 1.57 -0.83 -1.32 0.00 0.00 176.35 175.89 1hdn s GLY 54 N 0.94 0.62 -0.79 7.98 0.00 -1.26 -4.95 107.32 109.86 1hdn s GLY 54 Ca 0.58 -0.80 0.03 0.00 0.00 0.00 0.00 44.72 44.52 1hdn s GLY 54 CO 0.30 3.02 1.02 1.04 0.00 0.00 0.00 173.10 178.48 1hdn n LEU 55 N 10.77 4.76 -4.15 0.66 4.77 -1.26 -4.89 117.00 127.66 1hdn n LEU 55 Ca 0.13 -5.39 -0.17 0.00 -0.03 0.00 0.00 56.01 50.56 1hdn n LEU 55 Cb 0.50 -0.87 -0.05 0.00 -2.33 0.00 0.00 43.42 40.67 1hdn n LEU 55 CO 0.71 1.96 0.08 0.28 -1.33 0.00 0.00 177.39 179.09 1hdn s THR 56 N -2.73 0.00 0.35 -5.08 -1.32 -1.26 -0.20 115.64 105.40 1hdn s THR 56 Ca 0.37 -1.71 -0.29 0.00 -1.21 0.00 0.00 61.69 58.86 1hdn s THR 56 Cb 0.12 -2.64 -0.11 0.00 -1.51 0.00 0.00 72.50 68.36 1hdn s THR 56 CO 0.02 0.00 1.50 0.00 -2.21 0.00 0.00 174.62 173.93 1hdn s GLN 57 N -3.03 4.13 0.00 7.08 -2.07 -1.25 -2.87 119.66 121.66 1hdn s GLN 57 Ca 0.34 2.54 0.00 0.00 -1.82 0.00 0.00 55.36 56.42 1hdn s GLN 57 Cb 0.00 -2.99 0.00 0.00 -1.09 0.00 0.00 33.01 28.93 1hdn s GLN 57 CO 0.24 -0.53 0.00 0.41 -1.32 0.00 0.00 175.29 174.09 1hdn n GLY 58 N 0.94 2.18 3.55 2.60 0.00 -1.26 -4.93 105.19 108.27 1hdn n GLY 58 Ca 0.03 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 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 0.00 3.48 0.32 2.61 2.01 -1.14 -4.99 115.64 117.94 1hdn s THR 59 Ca 0.00 0.07 -0.28 0.00 0.31 0.00 0.00 61.69 61.79 1hdn s THR 59 Cb 0.00 -4.23 -0.09 0.00 0.01 0.00 0.00 72.50 68.19 1hdn s THR 59 CO 0.00 -1.18 1.06 0.54 -0.69 0.00 0.00 174.62 174.36 1hdn s VAL 60 N 8.32 3.63 -0.10 3.82 0.11 -1.26 -4.21 120.40 130.72 1hdn s VAL 60 Ca 0.60 1.49 0.01 0.00 -2.93 0.00 0.00 61.98 61.16 1hdn s VAL 60 Cb -0.10 -3.89 0.02 0.00 -1.53 0.00 0.00 36.38 30.88 1hdn s VAL 60 CO 0.13 0.25 -0.12 0.54 -3.33 0.00 0.00 175.10 172.56 1hdn s VAL 61 N -1.34 1.28 -0.27 2.04 0.11 -0.97 -0.22 120.40 121.02 1hdn s VAL 61 Ca 0.49 -0.51 -0.08 0.00 -2.93 0.00 0.00 61.98 58.95 1hdn s VAL 61 Cb -0.28 -1.20 -0.02 0.00 -1.53 0.00 0.00 36.38 33.36 1hdn s VAL 61 CO 0.35 0.40 0.10 -0.89 -3.33 0.00 0.00 175.10 171.73 1hdn s THR 62 N 1.07 4.39 -0.77 5.04 2.01 0.32 -0.08 115.64 127.62 1hdn s THR 62 Ca -0.06 -0.29 -0.22 0.00 0.31 0.00 0.00 61.69 61.43 1hdn s THR 62 Cb -0.15 -3.13 0.08 0.00 0.01 0.00 0.00 72.50 69.31 1hdn s THR 62 CO -0.02 0.23 1.07 -0.63 -0.69 0.00 0.00 174.62 174.58 1hdn s ILE 63 N 1.61 4.36 -0.17 1.82 -1.09 0.20 -1.09 121.20 126.83 1hdn s ILE 63 Ca 0.05 -0.68 -0.04 0.00 -2.23 0.00 0.00 60.65 57.75 1hdn s ILE 63 Cb -0.16 -4.76 -0.03 0.00 -1.58 0.00 0.00 42.46 35.94 1hdn s ILE 63 CO 0.05 -1.54 -0.03 -0.55 -1.23 0.00 0.00 174.94 171.64 1hdn s SER 64 N 3.78 4.82 -0.06 3.58 0.15 -0.16 -1.61 113.70 124.21 1hdn s SER 64 Ca 0.28 -0.14 0.01 0.00 0.70 0.00 0.00 55.95 56.80 1hdn s SER 64 Cb -0.12 -1.80 0.02 0.00 -1.71 0.00 0.00 66.02 62.42 1hdn s SER 64 CO 0.03 0.14 -0.07 0.00 1.20 0.00 0.00 173.24 174.55 1hdn s ALA 65 N 0.52 0.93 -0.10 5.45 0.00 0.57 -0.40 121.76 128.73 1hdn s ALA 65 Ca -0.02 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 51.74 1hdn s ALA 65 Cb -0.14 -0.57 -0.01 0.00 0.00 0.00 0.00 23.12 22.41 1hdn s ALA 65 CO 0.03 -0.08 -0.21 -1.83 0.00 0.00 0.00 175.76 173.66 1hdn s GLU 66 N 1.07 3.05 0.00 0.00 -1.05 -1.18 -0.79 118.70 119.80 1hdn s GLU 66 Ca -0.08 -0.83 0.00 0.00 -0.15 0.00 0.00 54.97 53.91 1hdn s GLU 66 Cb -0.14 -2.36 0.00 0.00 -0.44 0.00 0.00 34.13 31.18 1hdn s GLU 66 CO -0.01 0.22 0.00 0.41 0.95 0.00 0.00 175.26 176.84 1hdn n GLY 67 N 3.42 0.77 0.17 -3.83 0.00 -1.26 -0.27 105.19 104.18 1hdn n GLY 67 Ca -0.19 -1.83 -0.07 0.00 0.00 0.00 0.00 46.02 43.94 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 -0.41 -0.15 1.61 5.08 -1.96 -3.14 114.58 115.61 1hdn h GLU 68 Ca 0.00 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1hdn h GLU 68 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1hdn h GLU 68 CO 0.00 -0.28 0.00 -0.25 -1.00 0.00 0.00 179.01 177.48 1hdn n ASP 69 N -3.42 0.15 -0.31 1.42 8.00 -1.26 -4.59 116.55 116.54 1hdn n ASP 69 Ca -0.05 -0.62 -0.10 0.00 0.71 0.00 0.00 54.79 54.73 1hdn n ASP 69 Cb 0.17 -0.08 -0.07 0.00 -0.02 0.00 0.00 41.12 41.12 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 0.34 -0.14 -0.08 -1.24 4.11 -1.85 0.17 114.58 115.88 1hdn h GLU 70 Ca 0.00 0.01 -0.05 0.00 0.07 0.00 0.00 59.36 59.39 1hdn h GLU 70 Cb 0.08 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1hdn h GLU 70 CO 0.00 -0.09 -0.15 1.96 0.07 0.00 0.00 179.01 180.80 1hdn h GLN 71 N -0.14 0.25 -0.34 1.06 4.20 -1.89 -2.13 115.11 116.12 1hdn h GLN 71 Ca 0.16 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1hdn h GLN 71 Cb 0.50 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1hdn h GLN 71 CO -0.82 0.74 0.12 -0.22 -0.67 0.00 0.00 178.83 177.98 1hdn h LYS 72 N -0.22 0.53 -0.60 1.46 3.64 -1.75 -0.77 116.57 118.86 1hdn h LYS 72 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1hdn h LYS 72 Cb 0.73 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.44 1hdn h LYS 72 CO 0.03 0.55 0.39 0.00 -2.27 0.00 0.00 179.45 178.15 1hdn h ALA 73 N 0.96 0.76 0.58 5.00 0.00 -0.68 -0.16 119.26 125.72 1hdn h ALA 73 Ca 0.11 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1hdn h ALA 73 Cb 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1hdn h ALA 73 CO -0.01 0.21 -0.36 0.28 0.00 0.00 0.00 179.25 179.37 1hdn h VAL 74 N 0.81 0.26 -0.49 0.00 2.07 -1.13 -0.91 116.25 116.87 1hdn h VAL 74 Ca 0.22 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.83 1hdn h VAL 74 Cb -0.07 0.26 -0.09 0.00 -1.52 0.00 0.00 31.29 29.87 1hdn h VAL 74 CO -0.05 0.00 -0.09 -0.08 0.02 0.00 0.00 177.57 177.38 1hdn h GLU 75 N -0.90 0.03 0.21 1.57 4.81 -0.83 0.19 114.58 119.66 1hdn h GLU 75 Ca -0.07 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1hdn h GLU 75 Cb 0.73 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1hdn h GLU 75 CO 0.07 0.02 -0.10 1.25 -0.73 0.00 0.00 179.01 179.52 1hdn h HIS 76 N 0.03 -0.26 0.00 0.92 2.76 -0.99 -3.18 115.15 114.43 1hdn h HIS 76 Ca 0.24 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.29 1hdn h HIS 76 Cb 0.36 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.39 1hdn h HIS 76 CO -0.38 -0.10 -0.51 -0.07 -1.30 0.00 0.00 177.93 175.56 1hdn h LEU 77 N -0.36 0.00 -0.67 0.26 3.38 -0.44 -2.78 115.31 114.70 1hdn h LEU 77 Ca -0.03 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.03 1hdn h LEU 77 Cb 0.27 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 1hdn h LEU 77 CO 0.05 0.51 0.32 0.58 0.09 0.00 0.00 178.44 179.99 1hdn h VAL 78 N 0.00 0.85 0.77 1.22 2.07 -0.67 -0.26 116.25 120.23 1hdn h VAL 78 Ca -0.01 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 1hdn h VAL 78 Cb 1.10 0.24 0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1hdn h VAL 78 CO 0.07 0.10 -0.37 0.11 0.02 0.00 0.00 177.57 177.50 1hdn h LYS 79 N 0.57 -0.99 -0.97 1.57 1.57 -1.49 -3.25 116.57 113.57 1hdn h LYS 79 Ca 0.33 0.07 0.21 0.00 -1.87 0.00 0.00 60.65 59.38 1hdn h LYS 79 Cb 0.33 0.23 -0.09 0.00 0.08 0.00 0.00 32.23 32.78 1hdn h LYS 79 CO -0.26 -0.66 0.62 -0.07 -0.57 0.00 0.00 179.45 178.51 1hdn h LEU 80 N -1.15 0.56 -1.15 2.94 3.38 -1.38 -1.35 115.31 117.16 1hdn h LEU 80 Ca -0.11 0.07 0.15 0.00 0.09 0.00 0.00 57.88 58.08 1hdn h LEU 80 Cb 0.79 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.43 1hdn h LEU 80 CO 0.17 0.19 0.60 -0.03 0.09 0.00 0.00 178.44 179.47 1hdn h MET 81 N 0.55 0.78 0.00 1.13 4.05 -1.08 -1.22 114.93 119.14 1hdn h MET 81 Ca 0.54 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.91 1hdn h MET 81 Cb 1.13 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.76 1hdn h MET 81 CO -0.28 0.52 -0.87 0.00 0.23 0.00 0.00 176.91 176.51 1hdn n ALA 82 N -2.39 2.91 -0.01 0.39 0.00 -0.52 -4.45 120.51 116.45 1hdn n ALA 82 Ca 0.19 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1hdn n ALA 82 Cb 0.46 -1.09 -0.12 0.00 0.00 0.00 0.00 19.45 18.69 1hdn n ALA 82 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1hdn n GLU 83 N -2.26 0.65 -2.41 0.00 1.02 -0.57 -4.97 120.64 112.11 1hdn n GLU 83 Ca 0.02 0.07 -0.42 0.00 -0.02 0.00 0.00 57.16 56.81 1hdn n GLU 83 Cb 0.48 -1.67 -0.03 0.00 -0.02 0.00 0.00 31.44 30.19 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 -5.42 4.29 0.00 -4.62 1.43 -0.57 -5.06 118.68 108.74 1hdn s LEU 84 Ca -0.06 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.94 1hdn s LEU 84 Cb 0.09 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.75 1hdn s LEU 84 CO 0.84 -0.60 0.03 -0.62 0.23 0.00 0.00 176.35 176.23