#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 2.71 -0.07 1.12 5.36 -0.27 -4.99 117.98 121.84 1hdn s PHE 2 Ca 0.00 -0.80 0.04 0.00 -0.96 0.00 0.00 56.93 55.20 1hdn s PHE 2 Cb 0.00 -1.79 0.00 0.00 -0.34 0.00 0.00 43.02 40.90 1hdn s PHE 2 CO 0.00 -0.29 -0.19 -0.65 -1.46 0.00 0.00 175.22 172.63 1hdn s GLN 3 N 0.33 2.31 -0.34 10.12 -0.21 -1.26 -1.25 119.66 129.36 1hdn s GLN 3 Ca -0.14 -0.67 0.01 0.00 0.02 0.00 0.00 55.36 54.58 1hdn s GLN 3 Cb -0.17 -1.84 0.10 0.00 1.00 0.00 0.00 33.01 32.11 1hdn s GLN 3 CO 0.07 0.15 0.11 -0.65 -2.12 0.00 0.00 175.29 172.84 1hdn s GLN 4 N 0.37 1.02 -0.53 2.91 -0.21 -1.06 -5.01 119.66 117.15 1hdn s GLN 4 Ca -0.14 -1.45 -0.27 0.00 0.02 0.00 0.00 55.36 53.53 1hdn s GLN 4 Cb -0.16 -2.40 -0.03 0.00 1.00 0.00 0.00 33.01 31.43 1hdn s GLN 4 CO 0.06 -1.00 1.91 -1.21 -2.12 0.00 0.00 175.29 172.93 1hdn s GLU 5 N 1.22 2.72 0.02 2.91 2.02 -1.26 -2.18 118.70 124.15 1hdn s GLU 5 Ca 0.11 0.90 0.06 0.00 0.02 0.00 0.00 54.97 56.06 1hdn s GLU 5 Cb -0.19 -4.37 -0.02 0.00 0.10 0.00 0.00 34.13 29.66 1hdn s GLU 5 CO -0.17 -2.60 -0.18 0.14 0.02 0.00 0.00 175.26 172.47 1hdn s VAL 6 N 8.96 1.44 -0.13 2.63 -7.23 -0.22 -4.94 120.40 120.91 1hdn s VAL 6 Ca 0.74 -0.95 -0.22 0.00 -1.81 0.00 0.00 61.98 59.73 1hdn s VAL 6 Cb -0.15 -1.24 -0.03 0.00 0.56 0.00 0.00 36.38 35.52 1hdn s VAL 6 CO 0.24 0.26 0.67 0.42 -0.31 0.00 0.00 175.10 176.39 1hdn s THR 7 N -0.62 5.03 -0.46 5.32 -4.23 -1.26 -0.49 115.64 118.93 1hdn s THR 7 Ca 0.06 1.33 -0.28 0.00 -1.18 0.00 0.00 61.69 61.61 1hdn s THR 7 Cb -0.08 -4.00 0.01 0.00 1.34 0.00 0.00 72.50 69.78 1hdn s THR 7 CO 0.01 0.18 1.40 -0.63 -0.54 0.00 0.00 174.62 175.04 1hdn s ILE 8 N 1.34 3.88 -0.48 2.99 1.01 -0.09 -4.89 121.20 124.96 1hdn s ILE 8 Ca 0.33 0.86 0.23 0.00 0.00 0.00 0.00 60.65 62.07 1hdn s ILE 8 Cb -0.17 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 37.95 1hdn s ILE 8 CO 0.14 -0.89 1.05 0.35 0.00 0.00 0.00 174.94 175.59 1hdn n THR 9 N 7.02 0.30 -1.87 2.92 -2.24 -1.26 -0.23 114.28 118.92 1hdn n THR 9 Ca 0.15 -0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 1hdn n THR 9 Cb 0.48 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 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 -3.26 3.73 0.16 6.98 0.00 -1.26 -4.80 121.76 123.30 1hdn s ALA 10 Ca 0.02 1.31 -0.23 0.00 0.00 0.00 0.00 51.96 53.06 1hdn s ALA 10 Cb 0.13 -3.70 0.04 0.00 0.00 0.00 0.00 23.12 19.59 1hdn s ALA 10 CO 0.79 -1.08 1.61 -1.35 0.00 0.00 0.00 175.76 175.73 1hdn h PRO 11 N 8.09 -0.27 0.62 0.00 0.11 -1.95 -2.48 132.00 136.12 1hdn h PRO 11 Ca -0.43 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.66 1hdn h PRO 11 Cb 1.21 0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.38 1hdn h PRO 11 CO 0.93 -0.18 -0.30 -2.95 -0.21 0.00 0.00 178.00 175.29 1hdn h ASN 12 N -0.28 -0.71 0.00 -2.05 -1.07 -1.94 -3.23 115.58 106.31 1hdn h ASN 12 Ca 0.15 -0.01 0.00 0.00 0.07 0.00 0.00 56.30 56.51 1hdn h ASN 12 Cb 0.52 0.18 0.00 0.00 -2.07 0.00 0.00 38.32 36.95 1hdn h ASN 12 CO -0.46 -0.33 0.00 0.61 0.07 0.00 0.00 177.43 177.32 1hdn n GLY 13 N -0.51 -0.40 2.90 9.14 0.00 -1.00 -4.46 105.19 110.85 1hdn n GLY 13 Ca -0.11 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 1hdn n GLY 13 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1hdn n LEU 14 N 0.00 6.61 0.00 0.99 7.94 0.11 -4.73 117.00 127.91 1hdn n LEU 14 Ca 0.00 -4.82 0.00 0.00 -1.11 0.00 0.00 56.01 50.08 1hdn n LEU 14 Cb 0.00 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 42.53 1hdn n LEU 14 CO 0.00 1.48 0.00 0.00 -1.11 0.00 0.00 177.39 177.76 1hdn n HIS 15 N 3.09 -0.05 0.00 1.96 1.44 -1.26 -4.29 115.22 116.11 1hdn n HIS 15 Ca 0.36 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.07 1hdn n HIS 15 Cb 0.35 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.46 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 -0.05 0.00 0.09 0.61 -2.24 -1.26 -0.46 114.28 110.97 1hdn n THR 16 Ca 0.00 1.48 -0.06 0.00 -2.27 0.00 0.00 64.05 63.20 1hdn n THR 16 Cb 0.00 -2.06 0.09 0.00 -2.10 0.00 0.00 70.33 66.26 1hdn n THR 16 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1hdn h ARG 17 N 0.00 0.20 -0.36 -0.78 0.11 -1.99 -2.62 114.38 108.95 1hdn h ARG 17 Ca 0.00 -0.16 0.03 0.00 0.10 0.00 0.00 59.98 59.95 1hdn h ARG 17 Cb 0.00 0.03 -0.03 0.00 1.11 0.00 0.00 29.97 31.08 1hdn h ARG 17 CO 0.00 0.81 0.17 -1.35 0.10 0.00 0.00 179.97 179.70 1hdn h PRO 18 N 0.14 0.34 -0.36 0.08 0.11 -1.83 -2.52 132.00 127.96 1hdn h PRO 18 Ca -0.02 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.10 1hdn h PRO 18 Cb 1.22 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1hdn h PRO 18 CO 0.10 0.23 0.17 0.00 -0.21 0.00 0.00 178.00 178.29 1hdn h ALA 19 N 1.19 0.44 -1.00 -0.75 0.00 -0.74 -0.80 119.26 117.60 1hdn h ALA 19 Ca 0.15 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.20 1hdn h ALA 19 Cb 0.07 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 1hdn h ALA 19 CO -0.11 -0.21 0.63 0.00 0.00 0.00 0.00 179.25 179.56 1hdn h ALA 20 N 1.20 1.53 -0.14 0.00 0.00 -1.38 -1.30 119.26 119.17 1hdn h ALA 20 Ca 0.16 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.91 1hdn h ALA 20 Cb 0.08 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.67 1hdn h ALA 20 CO -0.12 0.22 -0.59 0.37 0.00 0.00 0.00 179.25 179.13 1hdn h GLN 21 N 0.99 0.64 -0.87 0.00 4.15 -0.97 -2.98 115.11 116.06 1hdn h GLN 21 Ca 0.49 -0.51 0.11 0.00 0.77 0.00 0.00 58.65 59.51 1hdn h GLN 21 Cb 0.49 0.10 -0.08 0.00 0.21 0.00 0.00 27.48 28.20 1hdn h GLN 21 CO -0.26 1.13 0.51 0.35 -1.93 0.00 0.00 178.83 178.63 1hdn h PHE 22 N 0.31 0.92 -0.17 3.99 3.04 -0.61 -2.00 116.94 122.42 1hdn h PHE 22 Ca -0.03 0.03 0.03 0.00 3.98 0.00 0.00 57.97 61.98 1hdn h PHE 22 Cb 1.22 -0.28 -0.03 0.00 2.56 0.00 0.00 35.95 39.42 1hdn h PHE 22 CO 0.10 0.36 -0.02 0.28 -2.02 0.00 0.00 178.31 177.02 1hdn h VAL 23 N 0.83 0.86 -0.19 1.41 2.07 -1.22 0.13 116.25 120.14 1hdn h VAL 23 Ca 0.43 -0.01 0.05 0.00 0.82 0.00 0.00 66.70 67.99 1hdn h VAL 23 Cb 0.42 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 1hdn h VAL 23 CO -0.26 0.01 -0.20 0.50 0.02 0.00 0.00 177.57 177.63 1hdn h LYS 24 N 0.03 -0.22 -0.29 1.57 3.64 -1.23 -0.94 116.57 119.15 1hdn h LYS 24 Ca 0.08 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.41 1hdn h LYS 24 Cb 0.11 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1hdn h LYS 24 CO -0.15 -0.14 -0.09 1.49 -2.27 0.00 0.00 179.45 178.29 1hdn h GLU 25 N -0.22 0.56 -0.85 1.90 4.57 -1.12 -3.07 114.58 116.35 1hdn h GLU 25 Ca 0.12 -0.22 0.07 0.00 -1.18 0.00 0.00 59.36 58.14 1hdn h GLU 25 Cb 0.41 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.90 1hdn h GLU 25 CO -0.32 0.77 0.52 0.00 -1.18 0.00 0.00 179.01 178.80 1hdn h ALA 26 N 0.77 1.17 -0.50 2.92 0.00 -0.60 -1.28 119.26 121.75 1hdn h ALA 26 Ca 0.07 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1hdn h ALA 26 Cb 0.58 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1hdn h ALA 26 CO 0.03 0.24 0.34 0.87 0.00 0.00 0.00 179.25 180.74 1hdn h LYS 27 N 0.94 0.27 0.00 0.00 1.57 -1.08 -2.10 116.57 116.17 1hdn h LYS 27 Ca 0.38 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1hdn h LYS 27 Cb 0.20 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1hdn h LYS 27 CO -0.18 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 1hdn n GLY 28 N -1.54 -1.18 3.81 3.86 0.00 -0.48 -4.71 105.19 104.95 1hdn n GLY 28 Ca 0.08 0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1hdn n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hdn s PHE 29 N -3.28 3.46 0.18 1.61 0.08 -0.79 -5.03 117.98 114.22 1hdn s PHE 29 Ca 0.04 0.40 -0.10 0.00 0.12 0.00 0.00 56.93 57.39 1hdn s PHE 29 Cb 0.09 -1.93 0.09 0.00 -0.57 0.00 0.00 43.02 40.69 1hdn s PHE 29 CO 0.34 0.60 1.71 1.79 -0.10 0.00 0.00 175.22 179.56 1hdn h THR 30 N 4.14 1.25 -3.15 0.64 1.35 -1.85 -3.44 112.91 111.85 1hdn h THR 30 Ca -0.52 -0.89 -0.58 0.00 -0.55 0.00 0.00 66.41 63.87 1hdn h THR 30 Cb 1.21 0.61 0.12 0.00 -1.73 0.00 0.00 68.15 68.35 1hdn h THR 30 CO 0.59 0.34 0.35 -1.20 -0.25 0.00 0.00 175.52 175.36 1hdn n SER 31 N -4.33 2.09 -4.53 5.36 7.64 -1.26 -4.93 113.62 113.66 1hdn n SER 31 Ca 0.04 1.14 -0.43 0.00 1.01 0.00 0.00 58.87 60.63 1hdn n SER 31 Cb 0.23 -1.42 -0.04 0.00 -1.01 0.00 0.00 64.21 61.97 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 -1.92 3.36 -0.88 1.43 2.56 -0.37 -4.81 118.70 118.07 1hdn s GLU 32 Ca 0.59 -0.21 -0.22 0.00 0.00 0.00 0.00 54.97 55.13 1hdn s GLU 32 Cb -0.58 -4.04 0.09 0.00 2.00 0.00 0.00 34.13 31.60 1hdn s GLU 32 CO 0.60 -1.45 1.19 0.42 -0.56 0.00 0.00 175.26 175.46 1hdn s ILE 33 N 3.92 4.32 0.06 -3.70 1.09 -1.26 -1.85 121.20 123.78 1hdn s ILE 33 Ca 0.31 -0.89 -0.31 0.00 -1.10 0.00 0.00 60.65 58.66 1hdn s ILE 33 Cb -0.12 -4.85 -0.06 0.00 -1.06 0.00 0.00 42.46 36.37 1hdn s ILE 33 CO 0.20 -1.65 1.20 -0.89 -0.10 0.00 0.00 174.94 173.70 1hdn s THR 34 N 3.91 4.04 -0.55 2.92 2.01 -0.21 -0.54 115.64 127.23 1hdn s THR 34 Ca 0.34 1.46 -0.01 0.00 0.31 0.00 0.00 61.69 63.79 1hdn s THR 34 Cb -0.06 -3.94 0.14 0.00 0.01 0.00 0.00 72.50 68.65 1hdn s THR 34 CO -0.03 0.11 0.34 -0.69 -0.69 0.00 0.00 174.62 173.66 1hdn s VAL 35 N 1.07 3.35 -0.80 3.82 1.01 0.33 -0.57 120.40 128.61 1hdn s VAL 35 Ca 0.59 -2.80 -0.18 0.00 0.00 0.00 0.00 61.98 59.59 1hdn s VAL 35 Cb -0.29 -3.24 0.14 0.00 0.00 0.00 0.00 36.38 32.99 1hdn s VAL 35 CO 0.29 -0.81 0.93 -0.89 0.00 0.00 0.00 175.10 174.62 1hdn s THR 36 N 0.20 4.93 -0.52 3.92 2.01 -0.67 -2.09 115.64 123.42 1hdn s THR 36 Ca 0.15 -1.55 -0.15 0.00 0.31 0.00 0.00 61.69 60.45 1hdn s THR 36 Cb -0.22 -4.63 0.13 0.00 0.01 0.00 0.00 72.50 67.79 1hdn s THR 36 CO -0.03 -1.30 0.47 -0.94 -0.69 0.00 0.00 174.62 172.12 1hdn s SER 37 N 3.29 6.10 -0.77 3.53 1.04 -0.32 -1.13 113.70 125.43 1hdn s SER 37 Ca 0.23 -1.79 -0.03 0.00 0.48 0.00 0.00 55.95 54.84 1hdn s SER 37 Cb -0.12 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 63.84 1hdn s SER 37 CO -0.04 -0.82 0.63 0.59 0.98 0.00 0.00 173.24 174.58 1hdn n ASN 38 N 5.18 -5.64 0.00 7.02 4.13 -0.58 -2.15 115.26 123.23 1hdn n ASN 38 Ca -0.13 -0.67 0.00 0.00 1.68 0.00 0.00 54.58 55.46 1hdn n ASN 38 Cb 0.40 -2.59 0.00 0.00 -1.54 0.00 0.00 39.78 36.06 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 -1.54 2.14 3.54 7.41 0.00 -1.26 -4.93 105.19 110.55 1hdn n GLY 39 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 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 3.44 -0.56 1.61 1.02 -0.91 -4.97 119.74 119.36 1hdn s LYS 40 Ca 0.00 -0.86 -0.23 0.00 0.02 0.00 0.00 55.97 54.90 1hdn s LYS 40 Cb 0.00 -4.90 0.05 0.00 -0.52 0.00 0.00 37.83 32.47 1hdn s LYS 40 CO 0.00 -2.14 0.87 -1.54 -0.92 0.00 0.00 175.35 171.61 1hdn s SER 41 N 4.43 6.27 -0.04 2.83 1.04 -1.26 -1.18 113.70 125.80 1hdn s SER 41 Ca 0.40 -0.63 0.03 0.00 0.48 0.00 0.00 55.95 56.23 1hdn s SER 41 Cb -0.04 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.69 1hdn s SER 41 CO -0.01 -1.19 -0.12 0.00 0.98 0.00 0.00 173.24 172.90 1hdn s ALA 42 N 3.64 1.16 0.09 5.32 0.00 -0.89 -4.99 121.76 126.10 1hdn s ALA 42 Ca 0.25 -0.47 -0.31 0.00 0.00 0.00 0.00 51.96 51.43 1hdn s ALA 42 Cb -0.15 -0.43 -0.08 0.00 0.00 0.00 0.00 23.12 22.46 1hdn s ALA 42 CO 0.15 0.19 1.50 0.45 0.00 0.00 0.00 175.76 178.04 1hdn s SER 43 N 0.22 6.73 0.45 0.00 0.15 -1.26 -0.51 113.70 119.47 1hdn s SER 43 Ca -0.05 2.37 0.13 0.00 0.70 0.00 0.00 55.95 59.10 1hdn s SER 43 Cb -0.11 -2.58 1.02 0.00 -1.71 0.00 0.00 66.02 62.64 1hdn s SER 43 CO 0.02 -0.76 2.03 0.00 1.20 0.00 0.00 173.24 175.72 1hdn h ALA 44 N 7.45 1.75 0.00 5.45 0.00 -1.15 -2.41 119.26 130.36 1hdn h ALA 44 Ca -0.41 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1hdn h ALA 44 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1hdn h ALA 44 CO 0.90 0.19 0.00 1.63 0.00 0.00 0.00 179.25 181.97 1hdn n LYS 45 N -4.40 0.60 -5.00 0.00 5.02 -1.26 -4.18 118.16 108.94 1hdn n LYS 45 Ca -0.02 0.01 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 1hdn n LYS 45 Cb 0.18 -1.50 -0.17 0.00 -0.02 0.00 0.00 35.03 33.52 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 -2.06 2.85 0.00 4.39 0.15 -0.90 -4.82 113.70 113.30 1hdn s SER 46 Ca 0.29 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.43 1hdn s SER 46 Cb 0.14 -1.30 0.00 0.00 -1.71 0.00 0.00 66.02 63.15 1hdn s SER 46 CO 0.24 0.12 0.98 -0.11 1.20 0.00 0.00 173.24 175.67 1hdn n LEU 47 N 3.68 0.00 -0.33 3.45 7.94 -1.26 -1.49 117.00 128.98 1hdn n LEU 47 Ca -0.20 0.98 0.07 0.00 -1.11 0.00 0.00 56.01 55.74 1hdn n LEU 47 Cb 0.52 -0.48 0.26 0.00 0.53 0.00 0.00 43.42 44.25 1hdn n LEU 47 CO 0.27 -0.48 1.24 -0.26 -1.11 0.00 0.00 177.39 177.06 1hdn h PHE 48 N 0.00 1.08 -0.28 1.96 0.04 -1.97 0.36 116.94 118.13 1hdn h PHE 48 Ca 0.00 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.84 1hdn h PHE 48 Cb 0.00 -0.35 -0.04 0.00 2.20 0.00 0.00 35.95 37.76 1hdn h PHE 48 CO 0.10 0.47 0.03 0.87 -0.60 0.00 0.00 178.31 179.19 1hdn h LYS 49 N 0.98 0.12 -0.04 1.51 1.79 -1.84 -1.05 116.57 118.03 1hdn h LYS 49 Ca 0.45 -0.01 -0.21 0.00 -2.18 0.00 0.00 60.65 58.70 1hdn h LYS 49 Cb 0.41 -0.03 0.02 0.00 -1.58 0.00 0.00 32.23 31.05 1hdn h LYS 49 CO -0.21 0.08 -0.81 1.25 -1.08 0.00 0.00 179.45 178.67 1hdn h LEU 50 N 0.12 0.78 -0.56 2.94 5.85 -0.27 -3.17 115.31 121.01 1hdn h LEU 50 Ca 0.13 -0.71 0.06 0.00 0.84 0.00 0.00 57.88 58.20 1hdn h LEU 50 Cb 0.15 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 1hdn h LEU 50 CO -0.20 1.39 0.26 -0.61 -0.34 0.00 0.00 178.44 178.95 1hdn h GLN 51 N 0.25 0.48 0.00 1.25 4.15 -0.25 -1.21 115.11 119.78 1hdn h GLN 51 Ca -0.09 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.30 1hdn h GLN 51 Cb 1.48 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 29.06 1hdn h GLN 51 CO 0.16 0.32 0.00 0.25 -1.93 0.00 0.00 178.83 177.63 1hdn n THR 52 N -4.90 0.37 -2.95 2.39 -2.24 -0.41 -4.78 114.28 101.77 1hdn n THR 52 Ca 0.06 0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.52 1hdn n THR 52 Cb 0.18 -0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 67.65 1hdn n THR 52 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1hdn s LEU 53 N -2.78 4.08 -0.57 3.22 2.96 -0.46 -4.99 118.68 120.14 1hdn s LEU 53 Ca 0.16 0.82 -0.27 0.00 -0.22 0.00 0.00 54.13 54.62 1hdn s LEU 53 Cb 0.15 -3.09 -0.01 0.00 0.50 0.00 0.00 46.19 43.74 1hdn s LEU 53 CO 0.38 -0.54 1.75 -0.83 -1.32 0.00 0.00 176.35 175.78 1hdn s GLY 54 N 1.49 0.44 -0.45 7.98 0.00 -1.26 -4.98 107.32 110.54 1hdn s GLY 54 Ca 0.32 -0.57 0.01 0.00 0.00 0.00 0.00 44.72 44.48 1hdn s GLY 54 CO 0.10 3.25 0.21 1.08 0.00 0.00 0.00 173.10 177.74 1hdn s LEU 55 N 8.08 4.93 0.22 0.66 1.43 -1.26 -4.97 118.68 127.77 1hdn s LEU 55 Ca 0.65 -2.40 -0.00 0.00 -1.03 0.00 0.00 54.13 51.35 1hdn s LEU 55 Cb -0.13 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 1hdn s LEU 55 CO 0.23 -0.40 0.16 0.28 0.23 0.00 0.00 176.35 176.84 1hdn s THR 56 N 0.59 0.00 -0.31 5.49 -1.32 -1.26 -0.71 115.64 118.12 1hdn s THR 56 Ca 0.12 -1.99 -0.34 0.00 -1.21 0.00 0.00 61.69 58.28 1hdn s THR 56 Cb -0.22 -2.49 -0.10 0.00 -1.51 0.00 0.00 72.50 68.18 1hdn s THR 56 CO -0.04 0.00 2.17 1.67 -2.21 0.00 0.00 174.62 176.20 1hdn n GLN 57 N -0.32 1.30 0.00 7.08 7.27 -0.97 -1.37 117.38 130.38 1hdn n GLN 57 Ca 0.03 0.37 0.00 0.00 0.07 0.00 0.00 57.00 57.46 1hdn n GLN 57 Cb 0.65 -2.60 0.00 0.00 2.41 0.00 0.00 30.24 30.70 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 6.22 0.77 3.66 1.69 0.00 0.68 -5.01 105.19 113.20 1hdn n GLY 58 Ca 0.38 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.00 4.28 -0.63 2.61 2.01 -0.47 -4.83 115.64 116.61 1hdn s THR 59 Ca 0.00 1.55 -0.22 0.00 0.31 0.00 0.00 61.69 63.32 1hdn s THR 59 Cb 0.00 -4.00 0.07 0.00 0.01 0.00 0.00 72.50 68.57 1hdn s THR 59 CO 0.00 -0.14 0.93 -0.69 -0.69 0.00 0.00 174.62 174.03 1hdn s VAL 60 N 3.52 4.39 -0.23 3.82 1.01 -1.26 -0.91 120.40 130.73 1hdn s VAL 60 Ca 0.55 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 62.19 1hdn s VAL 60 Cb -0.21 -4.63 -0.02 0.00 0.00 0.00 0.00 36.38 31.52 1hdn s VAL 60 CO 0.15 -1.35 0.00 0.54 0.00 0.00 0.00 175.10 174.44 1hdn s VAL 61 N 3.90 3.73 -0.58 2.92 0.11 0.35 -1.53 120.40 129.31 1hdn s VAL 61 Ca 0.23 -0.38 -0.22 0.00 -2.93 0.00 0.00 61.98 58.68 1hdn s VAL 61 Cb -0.17 -2.73 0.06 0.00 -1.53 0.00 0.00 36.38 32.02 1hdn s VAL 61 CO 0.12 0.38 0.85 -0.89 -3.33 0.00 0.00 175.10 172.23 1hdn s THR 62 N 1.53 4.52 -0.97 5.04 2.01 -0.29 -1.06 115.64 126.43 1hdn s THR 62 Ca 0.06 -0.26 -0.24 0.00 0.31 0.00 0.00 61.69 61.56 1hdn s THR 62 Cb -0.15 -4.53 0.03 0.00 0.01 0.00 0.00 72.50 67.86 1hdn s THR 62 CO -0.01 -1.17 1.54 -0.63 -0.69 0.00 0.00 174.62 173.67 1hdn s ILE 63 N 3.56 3.80 -0.68 1.82 1.09 -0.93 -1.67 121.20 128.20 1hdn s ILE 63 Ca 0.22 -0.57 -0.09 0.00 -1.10 0.00 0.00 60.65 59.10 1hdn s ILE 63 Cb -0.17 -4.82 0.18 0.00 -1.06 0.00 0.00 42.46 36.59 1hdn s ILE 63 CO 0.13 -1.72 0.56 -0.55 -0.10 0.00 0.00 174.94 173.26 1hdn s SER 64 N 5.55 6.00 -0.41 3.58 0.15 0.27 -2.55 113.70 126.28 1hdn s SER 64 Ca 0.50 -2.56 -0.17 0.00 0.70 0.00 0.00 55.95 54.42 1hdn s SER 64 Cb -0.02 -2.05 0.02 0.00 -1.71 0.00 0.00 66.02 62.26 1hdn s SER 64 CO -0.06 -0.54 0.44 0.00 1.20 0.00 0.00 173.24 174.29 1hdn s ALA 65 N 0.38 3.44 -0.23 5.45 0.00 -0.38 -1.04 121.76 129.36 1hdn s ALA 65 Ca 0.15 -1.43 -0.07 0.00 0.00 0.00 0.00 51.96 50.61 1hdn s ALA 65 Cb -0.18 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1hdn s ALA 65 CO -0.05 -1.50 0.05 -1.83 0.00 0.00 0.00 175.76 172.43 1hdn s GLU 66 N 2.16 3.68 0.00 0.00 -1.05 -0.77 -1.11 118.70 121.61 1hdn s GLU 66 Ca 0.13 -0.47 0.00 0.00 -0.15 0.00 0.00 54.97 54.48 1hdn s GLU 66 Cb -0.17 -3.25 0.00 0.00 -0.44 0.00 0.00 34.13 30.28 1hdn s GLU 66 CO 0.14 -0.08 0.00 0.41 0.95 0.00 0.00 175.26 176.67 1hdn n GLY 67 N 4.58 0.80 0.21 -3.83 0.00 -1.26 -1.24 105.19 104.46 1hdn n GLY 67 Ca -0.16 -1.78 -0.08 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.49 -1.99 1.61 5.08 -1.94 -3.28 114.58 113.57 1hdn h GLU 68 Ca 0.00 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1hdn h GLU 68 Cb 0.00 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1hdn h GLU 68 CO 0.00 -0.33 0.01 -0.40 -1.00 0.00 0.00 179.01 177.29 1hdn n ASP 69 N -4.03 5.38 -0.10 1.42 5.68 -1.26 -4.63 116.55 119.01 1hdn n ASP 69 Ca -0.06 -2.43 -0.06 0.00 -0.50 0.00 0.00 54.79 51.74 1hdn n ASP 69 Cb 0.20 -1.13 0.01 0.00 -1.14 0.00 0.00 41.12 39.06 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 1.02 -0.09 0.29 0.11 4.11 -1.83 0.72 114.58 118.90 1hdn h GLU 70 Ca 0.01 0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.43 1hdn h GLU 70 Cb 1.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1hdn h GLU 70 CO 0.02 -0.06 -0.14 1.96 0.07 0.00 0.00 179.01 180.86 1hdn h GLN 71 N -0.09 -0.38 -0.83 1.06 4.20 -1.89 -2.67 115.11 114.51 1hdn h GLN 71 Ca 0.18 0.03 0.12 0.00 0.06 0.00 0.00 58.65 59.04 1hdn h GLN 71 Cb 0.37 0.09 -0.08 0.00 0.30 0.00 0.00 27.48 28.15 1hdn h GLN 71 CO -0.42 -0.06 0.45 -0.22 -0.67 0.00 0.00 178.83 177.91 1hdn h LYS 72 N -0.73 0.66 0.44 1.46 3.64 -1.83 0.19 116.57 120.40 1hdn h LYS 72 Ca -0.04 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1hdn h LYS 72 Cb 0.49 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1hdn h LYS 72 CO 0.07 0.44 -0.25 0.00 -2.27 0.00 0.00 179.45 177.43 1hdn h ALA 73 N 1.51 -0.65 0.02 5.00 0.00 -0.88 -2.75 119.26 121.52 1hdn h ALA 73 Ca 0.43 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1hdn h ALA 73 Cb 0.53 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1hdn h ALA 73 CO -0.31 -0.87 -0.08 0.28 0.00 0.00 0.00 179.25 178.26 1hdn h VAL 74 N -0.65 0.80 -0.08 0.00 2.07 -0.93 -1.56 116.25 115.90 1hdn h VAL 74 Ca -0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.48 1hdn h VAL 74 Cb 0.52 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1hdn h VAL 74 CO 0.07 0.00 -0.26 -0.08 0.02 0.00 0.00 177.57 177.31 1hdn h GLU 75 N -0.15 -0.26 0.00 1.57 4.81 -0.69 0.15 114.58 120.01 1hdn h GLU 75 Ca 0.02 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 1hdn h GLU 75 Cb 0.18 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 1hdn h GLU 75 CO -0.06 -0.17 -0.50 1.25 -0.73 0.00 0.00 179.01 178.79 1hdn h HIS 76 N -0.27 0.00 -0.04 0.92 2.76 -1.49 -2.64 115.15 114.39 1hdn h HIS 76 Ca 0.02 0.00 -0.21 0.00 -2.20 0.00 0.00 60.37 57.98 1hdn h HIS 76 Cb 0.32 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.30 1hdn h HIS 76 CO -0.53 0.50 -0.79 -0.07 -1.30 0.00 0.00 177.93 175.74 1hdn h LEU 77 N 0.00 0.77 -0.56 0.26 3.38 -0.96 -1.70 115.31 116.50 1hdn h LEU 77 Ca -0.01 -0.71 -0.00 0.00 0.09 0.00 0.00 57.88 57.25 1hdn h LEU 77 Cb 1.03 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1hdn h LEU 77 CO 0.07 1.37 0.33 0.58 0.09 0.00 0.00 178.44 180.88 1hdn h VAL 78 N 0.23 1.17 -0.07 1.22 2.07 -0.65 0.84 116.25 121.07 1hdn h VAL 78 Ca -0.09 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.06 1hdn h VAL 78 Cb 1.46 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 1hdn h VAL 78 CO 0.16 0.18 -0.43 0.50 0.02 0.00 0.00 177.57 177.99 1hdn h LYS 79 N 0.75 -0.47 -0.51 1.57 3.64 -1.54 -2.74 116.57 117.27 1hdn h LYS 79 Ca 0.20 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.69 1hdn h LYS 79 Cb -0.00 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.86 1hdn h LYS 79 CO -0.04 -0.32 0.17 1.25 -2.27 0.00 0.00 179.45 178.25 1hdn h LEU 80 N -0.49 0.15 -0.63 5.20 5.85 -1.06 -2.10 115.31 122.22 1hdn h LEU 80 Ca 0.02 0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.93 1hdn h LEU 80 Cb 0.56 0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.56 1hdn h LEU 80 CO -0.33 0.11 0.11 -0.03 -0.34 0.00 0.00 178.44 177.96 1hdn h MET 81 N 0.33 0.23 -0.21 1.25 4.05 -0.73 -1.91 114.93 117.95 1hdn h MET 81 Ca 0.25 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.63 1hdn h MET 81 Cb 0.29 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.03 1hdn h MET 81 CO -0.27 0.15 0.00 0.00 0.23 0.00 0.00 176.91 177.02 1hdn h ALA 82 N 1.52 0.28 -0.38 0.39 0.00 -1.08 -3.33 119.26 116.66 1hdn h ALA 82 Ca 0.33 -0.20 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 1hdn h ALA 82 Cb 0.52 -0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.12 1hdn h ALA 82 CO -0.45 -0.00 0.28 0.39 0.00 0.00 0.00 179.25 179.47 1hdn n GLU 83 N -4.69 1.53 -3.72 0.00 1.02 -0.73 -4.68 120.64 109.37 1hdn n GLU 83 Ca -0.04 -1.19 -0.30 0.00 -0.02 0.00 0.00 57.16 55.61 1hdn n GLU 83 Cb 0.23 -1.46 -0.15 0.00 -0.02 0.00 0.00 31.44 30.03 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 -1.33 2.16 0.00 -4.62 1.43 -1.14 -4.99 118.68 110.19 1hdn s LEU 84 Ca 0.23 -1.69 0.00 0.00 -1.03 0.00 0.00 54.13 51.64 1hdn s LEU 84 Cb 0.19 -0.84 0.00 0.00 0.03 0.00 0.00 46.19 45.57 1hdn s LEU 84 CO 0.03 -0.41 0.48 -0.62 0.23 0.00 0.00 176.35 176.06