#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 2.34 -0.02 1.12 5.36 -1.06 -5.03 117.98 120.70 1hdn s PHE 2 Ca 0.00 -0.78 0.02 0.00 -0.96 0.00 0.00 56.93 55.21 1hdn s PHE 2 Cb 0.00 -1.55 0.00 0.00 -0.34 0.00 0.00 43.02 41.13 1hdn s PHE 2 CO 0.00 -0.27 -0.06 1.14 -1.46 0.00 0.00 175.22 174.57 1hdn s GLN 3 N 0.03 0.60 -0.18 10.12 -2.07 -1.26 -1.39 119.66 125.52 1hdn s GLN 3 Ca -0.08 -0.19 0.00 0.00 -1.82 0.00 0.00 55.36 53.27 1hdn s GLN 3 Cb -0.15 -0.60 0.04 0.00 -1.09 0.00 0.00 33.01 31.21 1hdn s GLN 3 CO 0.05 0.07 -0.10 -1.14 -1.32 0.00 0.00 175.29 172.86 1hdn s GLN 4 N 0.16 1.90 -0.72 9.60 2.00 -0.04 -4.99 119.66 127.58 1hdn s GLN 4 Ca -0.02 -0.67 -0.26 0.00 -2.00 0.00 0.00 55.36 52.41 1hdn s GLN 4 Cb -0.06 -2.21 0.04 0.00 0.80 0.00 0.00 33.01 31.58 1hdn s GLN 4 CO -0.00 -0.38 1.23 -2.00 -0.50 0.00 0.00 175.29 173.64 1hdn s GLU 5 N 1.49 3.20 -0.01 1.67 2.12 -1.26 -1.22 118.70 124.69 1hdn s GLU 5 Ca 0.01 -0.29 0.03 0.00 0.36 0.00 0.00 54.97 55.07 1hdn s GLU 5 Cb -0.15 -4.18 -0.01 0.00 0.26 0.00 0.00 34.13 30.06 1hdn s GLU 5 CO -0.09 -2.07 -0.08 0.54 -0.54 0.00 0.00 175.26 173.02 1hdn s VAL 6 N 5.46 0.66 0.55 3.70 0.11 -0.64 -4.97 120.40 125.26 1hdn s VAL 6 Ca 0.34 -0.37 -0.18 0.00 -2.93 0.00 0.00 61.98 58.84 1hdn s VAL 6 Cb -0.09 -0.56 -0.06 0.00 -1.53 0.00 0.00 36.38 34.15 1hdn s VAL 6 CO 0.15 0.18 1.07 0.42 -3.33 0.00 0.00 175.10 173.58 1hdn s THR 7 N -0.22 3.64 -0.45 5.04 -4.23 -1.26 -0.23 115.64 117.93 1hdn s THR 7 Ca 0.03 0.91 -0.25 0.00 -1.18 0.00 0.00 61.69 61.20 1hdn s THR 7 Cb -0.03 -3.37 0.03 0.00 1.34 0.00 0.00 72.50 70.46 1hdn s THR 7 CO -0.00 -0.33 0.90 -0.63 -0.54 0.00 0.00 174.62 174.02 1hdn s ILE 8 N -2.14 4.51 -0.23 2.99 1.01 -0.79 -4.88 121.20 121.67 1hdn s ILE 8 Ca 0.67 0.73 0.21 0.00 0.00 0.00 0.00 60.65 62.25 1hdn s ILE 8 Cb -0.18 -4.41 0.02 0.00 0.01 0.00 0.00 42.46 37.90 1hdn s ILE 8 CO 0.29 -0.79 1.09 0.71 0.00 0.00 0.00 174.94 176.24 1hdn h THR 9 N 6.05 0.16 -2.40 2.92 1.35 -1.89 -1.03 112.91 118.08 1hdn h THR 9 Ca -0.24 -1.30 -0.53 0.00 -0.55 0.00 0.00 66.41 63.79 1hdn h THR 9 Cb 1.08 1.74 0.02 0.00 -1.73 0.00 0.00 68.15 69.26 1hdn h THR 9 CO 1.01 0.09 1.21 0.00 -0.25 0.00 0.00 175.52 177.59 1hdn s ALA 10 N -3.22 3.62 0.08 6.62 0.00 -1.26 -4.93 121.76 122.67 1hdn s ALA 10 Ca 0.00 1.36 -0.27 0.00 0.00 0.00 0.00 51.96 53.06 1hdn s ALA 10 Cb 0.09 -3.83 -0.17 0.00 0.00 0.00 0.00 23.12 19.21 1hdn s ALA 10 CO 0.78 -1.50 1.68 -1.35 0.00 0.00 0.00 175.76 175.36 1hdn h PRO 11 N 10.19 -0.32 -0.09 0.00 0.11 -1.93 -3.13 132.00 136.83 1hdn h PRO 11 Ca -0.49 0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 1hdn h PRO 11 Cb 1.23 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 1hdn h PRO 11 CO 0.94 -0.20 -0.34 -2.95 -0.21 0.00 0.00 178.00 175.24 1hdn h ASN 12 N -0.35 0.19 -4.75 -2.05 7.08 -1.93 -3.40 115.58 110.37 1hdn h ASN 12 Ca -0.03 -0.07 0.00 0.00 -3.08 0.00 0.00 56.30 53.12 1hdn h ASN 12 Cb 0.27 -0.05 0.00 0.00 -2.08 0.00 0.00 38.32 36.45 1hdn h ASN 12 CO 0.06 0.52 0.00 0.61 -2.08 0.00 0.00 177.43 176.54 1hdn n GLY 13 N -0.40 1.00 2.97 9.14 0.00 -1.18 -4.79 105.19 111.93 1hdn n GLY 13 Ca -0.01 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.48 6.06 0.00 0.99 4.32 -0.24 -4.93 117.00 122.72 1hdn n LEU 14 Ca 0.00 -3.94 0.00 0.00 -0.02 0.00 0.00 56.01 52.05 1hdn n LEU 14 Cb 0.00 -1.63 0.00 0.00 -1.62 0.00 0.00 43.42 40.17 1hdn n LEU 14 CO 0.00 0.67 0.00 0.00 -1.22 0.00 0.00 177.39 176.84 1hdn n HIS 15 N 6.98 -2.26 -0.25 -1.77 1.44 -1.26 -4.33 115.22 113.77 1hdn n HIS 15 Ca 0.51 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 56.25 1hdn n HIS 15 Cb 0.41 0.00 0.12 0.00 0.12 0.00 0.00 29.99 30.63 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 -1.42 0.32 0.14 0.61 1.35 -1.92 -1.29 112.91 110.70 1hdn h THR 16 Ca 0.00 -0.02 -0.30 0.00 -0.55 0.00 0.00 66.41 65.54 1hdn h THR 16 Cb 0.00 0.27 0.03 0.00 -1.73 0.00 0.00 68.15 66.72 1hdn h THR 16 CO 0.00 0.01 -1.28 0.08 -0.25 0.00 0.00 175.52 174.08 1hdn h ARG 17 N 0.05 0.58 -0.93 4.72 0.11 -1.96 -2.16 114.38 114.79 1hdn h ARG 17 Ca 0.37 -0.81 0.02 0.00 0.10 0.00 0.00 59.98 59.66 1hdn h ARG 17 Cb 0.62 0.28 -0.05 0.00 1.11 0.00 0.00 29.97 31.92 1hdn h ARG 17 CO -0.69 1.37 0.62 -1.35 0.10 0.00 0.00 179.97 180.02 1hdn h PRO 18 N 0.24 1.19 -0.73 0.08 0.11 -1.84 -1.71 132.00 129.35 1hdn h PRO 18 Ca -0.19 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 1hdn h PRO 18 Cb 1.95 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 32.76 1hdn h PRO 18 CO 0.24 0.79 0.41 0.00 -0.21 0.00 0.00 178.00 179.23 1hdn h ALA 19 N 1.43 0.94 -0.51 -0.75 0.00 -1.28 -1.70 119.26 117.39 1hdn h ALA 19 Ca 0.35 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1hdn h ALA 19 Cb -0.09 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 1hdn h ALA 19 CO -0.09 0.44 0.25 0.00 0.00 0.00 0.00 179.25 179.86 1hdn h ALA 20 N 1.21 0.66 -0.32 0.00 0.00 -0.97 -1.16 119.26 118.68 1hdn h ALA 20 Ca 0.26 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1hdn h ALA 20 Cb 0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.55 1hdn h ALA 20 CO -0.04 0.21 -0.06 0.37 0.00 0.00 0.00 179.25 179.73 1hdn h GLN 21 N 0.68 0.02 -0.63 0.00 4.15 -1.13 -2.33 115.11 115.88 1hdn h GLN 21 Ca 0.18 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.60 1hdn h GLN 21 Cb 0.10 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 1hdn h GLN 21 CO -0.02 0.01 0.41 0.35 -1.93 0.00 0.00 178.83 177.66 1hdn h PHE 22 N 0.02 0.78 -0.24 3.99 3.04 -1.05 -2.78 116.94 120.70 1hdn h PHE 22 Ca 0.15 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.10 1hdn h PHE 22 Cb 0.23 -0.26 -0.01 0.00 2.56 0.00 0.00 35.95 38.46 1hdn h PHE 22 CO -0.28 0.49 0.07 0.28 -2.02 0.00 0.00 178.31 176.84 1hdn h VAL 23 N 0.83 1.20 -0.38 1.41 2.07 -0.67 -0.21 116.25 120.51 1hdn h VAL 23 Ca 0.23 -0.64 0.08 0.00 0.82 0.00 0.00 66.70 67.18 1hdn h VAL 23 Cb -0.08 1.17 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 1hdn h VAL 23 CO -0.05 0.21 -0.08 0.50 0.02 0.00 0.00 177.57 178.16 1hdn h LYS 24 N 0.22 0.01 -0.27 1.57 3.11 -1.23 0.63 116.57 120.61 1hdn h LYS 24 Ca 0.08 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.92 1hdn h LYS 24 Cb 0.25 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.47 1hdn h LYS 24 CO -0.00 0.01 0.17 1.49 -2.81 0.00 0.00 179.45 178.31 1hdn h GLU 25 N 0.01 0.36 -0.70 1.90 4.57 -1.40 -1.98 114.58 117.33 1hdn h GLU 25 Ca 0.18 -0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.28 1hdn h GLU 25 Cb 0.28 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 1hdn h GLU 25 CO -0.38 0.25 0.20 0.00 -1.18 0.00 0.00 179.01 177.90 1hdn h ALA 26 N 1.08 1.02 -0.07 2.92 0.00 -0.70 -1.89 119.26 121.62 1hdn h ALA 26 Ca 0.10 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1hdn h ALA 26 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1hdn h ALA 26 CO -0.02 0.65 -0.14 -0.22 0.00 0.00 0.00 179.25 179.53 1hdn h LYS 27 N 1.05 0.10 0.00 0.00 3.64 -0.71 -2.74 116.57 117.92 1hdn h LYS 27 Ca 0.23 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1hdn h LYS 27 Cb 0.33 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1hdn h LYS 27 CO -0.00 0.24 -0.02 0.78 -2.27 0.00 0.00 179.45 178.18 1hdn h GLY 28 N 0.58 0.00 -3.46 5.01 0.00 -0.56 -3.44 103.07 101.20 1hdn h GLY 28 Ca 0.02 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.83 1hdn h GLY 28 CO 0.02 0.00 -0.26 -1.36 0.00 0.00 0.00 176.54 174.94 1hdn s PHE 29 N -4.20 3.48 -0.06 5.60 0.08 -1.04 -5.05 117.98 116.79 1hdn s PHE 29 Ca -0.04 0.43 -0.24 0.00 0.12 0.00 0.00 56.93 57.20 1hdn s PHE 29 Cb 0.13 -1.93 -0.28 0.00 -0.57 0.00 0.00 43.02 40.37 1hdn s PHE 29 CO 0.48 0.29 0.91 1.79 -0.10 0.00 0.00 175.22 178.59 1hdn h THR 30 N 1.40 1.58 -3.10 0.64 1.35 -1.85 -3.46 112.91 109.47 1hdn h THR 30 Ca -0.48 -2.34 -0.57 0.00 -0.55 0.00 0.00 66.41 62.46 1hdn h THR 30 Cb 1.19 3.11 0.11 0.00 -1.73 0.00 0.00 68.15 70.83 1hdn h THR 30 CO 0.67 0.65 0.48 -1.20 -0.25 0.00 0.00 175.52 175.86 1hdn n SER 31 N -4.32 2.58 -4.60 5.36 7.64 -1.26 -4.88 113.62 114.14 1hdn n SER 31 Ca -0.12 1.19 -0.43 0.00 1.01 0.00 0.00 58.87 60.53 1hdn n SER 31 Cb 0.67 -1.45 -0.02 0.00 -1.01 0.00 0.00 64.21 62.40 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 -1.60 3.69 -0.20 1.43 2.12 -0.41 -4.79 118.70 118.94 1hdn s GLU 32 Ca 0.58 0.65 -0.25 0.00 0.36 0.00 0.00 54.97 56.31 1hdn s GLU 32 Cb -0.60 -3.93 -0.01 0.00 0.26 0.00 0.00 34.13 29.85 1hdn s GLU 32 CO 0.60 -1.42 0.83 0.42 -0.54 0.00 0.00 175.26 175.15 1hdn s ILE 33 N 4.66 4.86 -0.10 -3.70 1.09 -1.26 -1.42 121.20 125.34 1hdn s ILE 33 Ca 0.51 1.61 0.03 0.00 -1.10 0.00 0.00 60.65 61.69 1hdn s ILE 33 Cb -0.08 -4.13 -0.01 0.00 -1.06 0.00 0.00 42.46 37.17 1hdn s ILE 33 CO 0.32 -0.02 -0.18 -0.89 -0.10 0.00 0.00 174.94 174.07 1hdn s THR 34 N 2.48 2.64 -0.55 2.92 2.01 -0.42 -1.85 115.64 122.87 1hdn s THR 34 Ca 0.37 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.52 1hdn s THR 34 Cb -0.16 -2.05 0.14 0.00 0.01 0.00 0.00 72.50 70.44 1hdn s THR 34 CO 0.10 0.55 0.35 -0.69 -0.69 0.00 0.00 174.62 174.24 1hdn s VAL 35 N 0.07 3.48 -0.81 3.82 1.01 -0.01 -0.99 120.40 126.97 1hdn s VAL 35 Ca -0.08 -2.72 -0.21 0.00 0.00 0.00 0.00 61.98 58.97 1hdn s VAL 35 Cb -0.15 -3.31 0.09 0.00 0.00 0.00 0.00 36.38 33.01 1hdn s VAL 35 CO 0.05 -0.81 1.08 -0.89 0.00 0.00 0.00 175.10 174.53 1hdn s THR 36 N 0.27 4.45 -0.73 3.92 2.01 -0.52 -1.49 115.64 123.55 1hdn s THR 36 Ca 0.14 -0.91 -0.19 0.00 0.31 0.00 0.00 61.69 61.05 1hdn s THR 36 Cb -0.21 -4.76 0.12 0.00 0.01 0.00 0.00 72.50 67.66 1hdn s THR 36 CO -0.03 -1.53 0.88 -0.55 -0.69 0.00 0.00 174.62 172.69 1hdn s SER 37 N 3.78 6.40 -0.25 3.53 0.15 0.42 -1.07 113.70 126.65 1hdn s SER 37 Ca 0.29 -1.73 -0.23 0.00 0.70 0.00 0.00 55.95 54.99 1hdn s SER 37 Cb -0.10 -2.33 0.03 0.00 -1.71 0.00 0.00 66.02 61.91 1hdn s SER 37 CO -0.00 -1.07 0.38 0.59 1.20 0.00 0.00 173.24 174.34 1hdn n ASN 38 N 6.26 -3.49 0.00 5.45 5.03 -0.05 -1.82 115.26 126.63 1hdn n ASN 38 Ca 0.04 -0.07 0.00 0.00 0.87 0.00 0.00 54.58 55.42 1hdn n ASN 38 Cb 0.45 -0.99 0.00 0.00 -1.02 0.00 0.00 39.78 38.22 1hdn n ASN 38 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1hdn n GLY 39 N -0.00 1.69 3.56 7.41 0.00 -1.26 -4.95 105.19 111.64 1hdn n GLY 39 Ca -0.05 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 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 2.66 -0.62 1.61 1.02 -0.76 -4.95 119.74 118.71 1hdn s LYS 40 Ca 0.00 0.96 -0.21 0.00 0.02 0.00 0.00 55.97 56.74 1hdn s LYS 40 Cb 0.00 -4.39 0.09 0.00 -0.52 0.00 0.00 37.83 33.00 1hdn s LYS 40 CO 0.00 -2.67 0.82 -1.12 -0.92 0.00 0.00 175.35 171.47 1hdn s SER 41 N 8.56 6.18 -0.00 2.83 0.01 -1.26 -0.44 113.70 129.58 1hdn s SER 41 Ca 0.77 -1.20 0.04 0.00 1.31 0.00 0.00 55.95 56.87 1hdn s SER 41 Cb -0.16 -2.36 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 1hdn s SER 41 CO 0.25 -1.25 -0.12 0.00 0.41 0.00 0.00 173.24 172.52 1hdn s ALA 42 N 3.32 2.79 0.04 1.44 0.00 -0.56 -4.97 121.76 123.82 1hdn s ALA 42 Ca 0.17 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 1hdn s ALA 42 Cb -0.21 -0.97 -0.09 0.00 0.00 0.00 0.00 23.12 21.86 1hdn s ALA 42 CO 0.08 0.58 1.88 0.45 0.00 0.00 0.00 175.76 178.75 1hdn s SER 43 N -1.19 6.49 0.49 0.00 0.15 -1.26 -0.83 113.70 117.55 1hdn s SER 43 Ca 0.14 2.61 0.27 0.00 0.70 0.00 0.00 55.95 59.67 1hdn s SER 43 Cb -0.11 -2.54 1.19 0.00 -1.71 0.00 0.00 66.02 62.85 1hdn s SER 43 CO 0.04 -1.02 1.94 0.00 1.20 0.00 0.00 173.24 175.41 1hdn h ALA 44 N 9.95 1.10 0.00 5.45 0.00 -1.71 -3.16 119.26 130.89 1hdn h ALA 44 Ca -0.47 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1hdn h ALA 44 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1hdn h ALA 44 CO 0.94 0.20 0.00 0.87 0.00 0.00 0.00 179.25 181.27 1hdn h LYS 45 N 0.00 0.00 -4.98 0.00 1.57 -1.85 -3.36 116.57 107.95 1hdn h LYS 45 Ca -0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 1hdn h LYS 45 Cb 0.57 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.64 1hdn h LYS 45 CO 0.02 0.00 -0.65 0.45 -0.57 0.00 0.00 179.45 178.70 1hdn s SER 46 N -5.45 4.88 0.08 0.86 0.15 -1.19 -4.86 113.70 108.16 1hdn s SER 46 Ca 0.08 -0.25 -0.25 0.00 0.70 0.00 0.00 55.95 56.23 1hdn s SER 46 Cb 0.08 -1.86 -0.10 0.00 -1.71 0.00 0.00 66.02 62.43 1hdn s SER 46 CO 0.63 -0.02 1.40 -0.07 1.20 0.00 0.00 173.24 176.38 1hdn h LEU 47 N 8.12 -1.17 -0.61 3.45 3.38 -1.86 -0.79 115.31 125.82 1hdn h LEU 47 Ca -0.39 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1hdn h LEU 47 Cb 1.17 0.44 0.00 0.00 0.09 0.00 0.00 40.66 42.36 1hdn h LEU 47 CO 0.59 -0.39 0.00 0.33 0.09 0.00 0.00 178.44 179.06 1hdn n PHE 48 N -4.62 0.50 -0.09 1.13 7.35 -1.26 -0.40 117.46 120.07 1hdn n PHE 48 Ca -0.06 0.22 -0.16 0.00 -0.76 0.00 0.00 57.45 56.69 1hdn n PHE 48 Cb 0.29 -0.85 -0.13 0.00 0.35 0.00 0.00 39.48 39.14 1hdn n PHE 48 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1hdn n LYS 49 N -1.98 0.68 0.00 -4.13 4.76 -0.79 -3.84 118.16 112.87 1hdn n LYS 49 Ca 0.01 0.15 -0.17 0.00 -2.87 0.00 0.00 58.31 55.43 1hdn n LYS 49 Cb 0.14 -1.58 -0.10 0.00 -1.84 0.00 0.00 35.03 31.65 1hdn n LYS 49 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1hdn h LEU 50 N 0.01 0.59 -2.44 -0.35 5.85 -0.60 -3.06 115.31 115.32 1hdn h LEU 50 Ca -0.52 -0.73 0.02 0.00 0.84 0.00 0.00 57.88 57.49 1hdn h LEU 50 Cb 2.01 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.85 1hdn h LEU 50 CO -0.02 1.24 0.12 1.56 -0.34 0.00 0.00 178.44 181.00 1hdn h GLN 51 N -0.00 0.00 0.00 1.25 4.20 -0.94 -0.71 115.11 118.90 1hdn h GLN 51 Ca -0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1hdn h GLN 51 Cb 1.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.10 1hdn h GLN 51 CO 0.13 0.00 -1.06 0.25 -0.67 0.00 0.00 178.83 177.47 1hdn n THR 52 N -3.57 0.13 -2.61 -0.54 -2.24 -1.23 -4.54 114.28 99.68 1hdn n THR 52 Ca -0.01 -0.22 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 1hdn n THR 52 Cb 0.21 0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.70 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 -3.79 4.48 -1.03 3.22 2.96 -0.28 -4.94 118.68 119.30 1hdn s LEU 53 Ca 0.04 1.94 -0.27 0.00 -0.22 0.00 0.00 54.13 55.62 1hdn s LEU 53 Cb 0.15 -3.59 -0.21 0.00 0.50 0.00 0.00 46.19 43.03 1hdn s LEU 53 CO 0.81 -0.17 2.18 -0.83 -1.32 0.00 0.00 176.35 177.02 1hdn s GLY 54 N 0.06 -1.10 -1.07 7.98 0.00 -1.26 -4.86 107.32 107.08 1hdn s GLY 54 Ca 0.49 -1.34 -0.07 0.00 0.00 0.00 0.00 44.72 43.80 1hdn s GLY 54 CO 0.32 4.30 1.10 1.04 0.00 0.00 0.00 173.10 179.86 1hdn n LEU 55 N 19.62 5.38 -4.49 0.66 4.77 -1.26 -4.90 117.00 136.77 1hdn n LEU 55 Ca 0.42 -5.08 -0.23 0.00 -0.03 0.00 0.00 56.01 51.09 1hdn n LEU 55 Cb 0.46 -1.38 -0.11 0.00 -2.33 0.00 0.00 43.42 40.07 1hdn n LEU 55 CO 0.58 1.44 -0.28 0.28 -1.33 0.00 0.00 177.39 178.08 1hdn s THR 56 N -1.51 1.45 -0.32 -5.08 -1.32 -1.26 -1.08 115.64 106.52 1hdn s THR 56 Ca 0.31 -2.01 -0.40 0.00 -1.21 0.00 0.00 61.69 58.37 1hdn s THR 56 Cb -0.07 -2.82 -0.16 0.00 -1.51 0.00 0.00 72.50 67.94 1hdn s THR 56 CO -0.07 -0.03 1.82 1.67 -2.21 0.00 0.00 174.62 175.81 1hdn n GLN 57 N -0.75 0.98 0.00 7.08 -0.06 -1.24 -1.94 117.38 121.44 1hdn n GLN 57 Ca -0.03 0.35 0.00 0.00 -2.00 0.00 0.00 57.00 55.31 1hdn n GLN 57 Cb 0.66 -2.07 0.00 0.00 -4.06 0.00 0.00 30.24 24.78 1hdn n GLN 57 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1hdn n GLY 58 N 4.73 2.93 3.65 1.69 0.00 -0.39 -5.01 105.19 112.80 1hdn n GLY 58 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.94 3.51 -0.51 2.61 2.01 -0.82 -4.58 115.64 114.92 1hdn s THR 59 Ca 0.00 0.61 -0.28 0.00 0.31 0.00 0.00 61.69 62.33 1hdn s THR 59 Cb 0.00 -3.43 0.02 0.00 0.01 0.00 0.00 72.50 69.09 1hdn s THR 59 CO 0.00 -0.10 1.34 -0.69 -0.69 0.00 0.00 174.62 174.48 1hdn s VAL 60 N 4.53 3.92 -0.25 3.82 1.01 -1.26 -1.88 120.40 130.29 1hdn s VAL 60 Ca 0.76 0.87 -0.06 0.00 0.00 0.00 0.00 61.98 63.54 1hdn s VAL 60 Cb -0.33 -4.44 -0.02 0.00 0.00 0.00 0.00 36.38 31.60 1hdn s VAL 60 CO 0.31 -1.05 0.05 0.54 0.00 0.00 0.00 175.10 174.95 1hdn s VAL 61 N 5.46 4.03 -0.68 2.92 0.11 0.68 -0.87 120.40 132.05 1hdn s VAL 61 Ca 0.53 -0.35 -0.25 0.00 -2.93 0.00 0.00 61.98 58.98 1hdn s VAL 61 Cb -0.10 -2.92 0.05 0.00 -1.53 0.00 0.00 36.38 31.88 1hdn s VAL 61 CO 0.29 0.30 1.10 -0.89 -3.33 0.00 0.00 175.10 172.57 1hdn s THR 62 N 1.56 4.07 -0.44 5.04 2.01 -0.24 -1.63 115.64 126.02 1hdn s THR 62 Ca 0.05 0.05 -0.29 0.00 0.31 0.00 0.00 61.69 61.82 1hdn s THR 62 Cb -0.15 -4.77 0.02 0.00 0.01 0.00 0.00 72.50 67.60 1hdn s THR 62 CO 0.02 -1.59 1.23 -0.63 -0.69 0.00 0.00 174.62 172.95 1hdn s ILE 63 N 4.78 4.12 -0.03 1.82 1.01 -0.36 -1.44 121.20 131.11 1hdn s ILE 63 Ca 0.29 1.17 0.08 0.00 0.00 0.00 0.00 60.65 62.18 1hdn s ILE 63 Cb -0.13 -4.44 -0.02 0.00 0.01 0.00 0.00 42.46 37.89 1hdn s ILE 63 CO 0.13 -0.86 -0.25 -0.55 0.00 0.00 0.00 174.94 173.41 1hdn s SER 64 N 2.89 3.10 -0.22 3.58 0.15 -0.16 -0.86 113.70 122.19 1hdn s SER 64 Ca 0.53 -0.46 0.01 0.00 0.70 0.00 0.00 55.95 56.72 1hdn s SER 64 Cb -0.10 -0.42 0.05 0.00 -1.71 0.00 0.00 66.02 63.84 1hdn s SER 64 CO 0.30 0.31 -0.09 0.00 1.20 0.00 0.00 173.24 174.97 1hdn s ALA 65 N -0.57 2.05 -0.44 5.45 0.00 -0.48 -1.30 121.76 126.47 1hdn s ALA 65 Ca 0.09 -1.31 -0.07 0.00 0.00 0.00 0.00 51.96 50.66 1hdn s ALA 65 Cb -0.10 -1.36 0.11 0.00 0.00 0.00 0.00 23.12 21.76 1hdn s ALA 65 CO -0.00 -0.97 0.27 -1.21 0.00 0.00 0.00 175.76 173.85 1hdn s GLU 66 N 1.36 2.35 0.00 0.00 2.02 -0.51 -2.58 118.70 121.35 1hdn s GLU 66 Ca -0.04 -1.71 0.00 0.00 0.02 0.00 0.00 54.97 53.25 1hdn s GLU 66 Cb -0.17 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.29 1hdn s GLU 66 CO -0.07 -1.09 0.00 0.41 0.02 0.00 0.00 175.26 174.52 1hdn n GLY 67 N 4.80 0.90 0.00 -1.39 0.00 -1.26 -1.28 105.19 106.96 1hdn n GLY 67 Ca -0.07 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.48 1.61 4.71 -1.26 -3.04 120.64 122.18 1hdn n GLU 68 Ca 0.00 0.27 -0.04 0.00 -0.01 0.00 0.00 57.16 57.39 1hdn n GLU 68 Cb 0.00 -0.76 -0.05 0.00 -1.01 0.00 0.00 31.44 29.62 1hdn n GLU 68 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1hdn n ASP 69 N -0.56 3.38 0.04 1.62 5.68 -1.26 -4.72 116.55 120.72 1hdn n ASP 69 Ca 0.00 -2.01 -0.14 0.00 -0.50 0.00 0.00 54.79 52.14 1hdn n ASP 69 Cb 0.00 -0.81 -0.09 0.00 -1.14 0.00 0.00 41.12 39.08 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 3.09 -0.56 -0.31 0.11 4.11 -1.82 -0.44 114.58 118.77 1hdn h GLU 70 Ca 0.06 0.04 -0.04 0.00 0.07 0.00 0.00 59.36 59.48 1hdn h GLU 70 Cb 0.80 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1hdn h GLU 70 CO 0.17 -0.37 0.02 1.96 0.07 0.00 0.00 179.01 180.85 1hdn h GLN 71 N -0.58 0.54 -0.81 1.06 4.20 -1.89 -2.97 115.11 114.65 1hdn h GLN 71 Ca 0.01 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.53 1hdn h GLN 71 Cb 0.63 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.32 1hdn h GLN 71 CO -0.33 0.66 0.39 -0.22 -0.67 0.00 0.00 178.83 178.65 1hdn h LYS 72 N 0.35 1.18 0.26 1.46 3.64 -1.92 -2.28 116.57 119.26 1hdn h LYS 72 Ca 0.09 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1hdn h LYS 72 Cb 0.40 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1hdn h LYS 72 CO 0.01 0.91 -0.13 0.00 -2.27 0.00 0.00 179.45 177.97 1hdn h ALA 73 N 1.21 -0.35 0.56 5.00 0.00 -0.92 -2.38 119.26 122.37 1hdn h ALA 73 Ca 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1hdn h ALA 73 Cb 0.12 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1hdn h ALA 73 CO -0.03 -0.64 -0.43 0.28 0.00 0.00 0.00 179.25 178.42 1hdn h VAL 74 N -0.47 0.00 -0.78 0.00 2.07 -1.48 -2.72 116.25 112.88 1hdn h VAL 74 Ca -0.04 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.59 1hdn h VAL 74 Cb 0.35 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.00 1hdn h VAL 74 CO 0.06 0.00 -0.46 -0.08 0.02 0.00 0.00 177.57 177.10 1hdn h GLU 75 N -0.96 -0.12 -0.49 1.57 4.81 -1.41 -0.69 114.58 117.29 1hdn h GLU 75 Ca -0.07 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.24 1hdn h GLU 75 Cb 0.80 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.14 1hdn h GLU 75 CO 0.02 -0.08 0.11 1.25 -0.73 0.00 0.00 179.01 179.58 1hdn h HIS 76 N -0.12 0.18 -0.01 0.92 2.76 -1.43 -2.13 115.15 115.32 1hdn h HIS 76 Ca 0.21 0.03 -0.15 0.00 -2.20 0.00 0.00 60.37 58.27 1hdn h HIS 76 Cb 0.54 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 1hdn h HIS 76 CO -0.83 0.01 -0.68 -0.07 -1.30 0.00 0.00 177.93 175.06 1hdn h LEU 77 N 0.25 0.06 -0.42 0.26 3.38 -0.89 -1.19 115.31 116.76 1hdn h LEU 77 Ca 0.24 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1hdn h LEU 77 Cb 0.32 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1hdn h LEU 77 CO -0.31 0.72 0.12 0.58 0.09 0.00 0.00 178.44 179.65 1hdn h VAL 78 N 0.04 1.22 -0.66 1.22 2.07 -0.79 -2.04 116.25 117.31 1hdn h VAL 78 Ca -0.01 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 1hdn h VAL 78 Cb 1.20 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 1hdn h VAL 78 CO 0.09 0.26 0.38 0.11 0.02 0.00 0.00 177.57 178.44 1hdn h LYS 79 N 0.54 0.91 0.59 1.57 1.79 -1.06 -1.64 116.57 119.27 1hdn h LYS 79 Ca 0.14 -0.09 -0.02 0.00 -2.18 0.00 0.00 60.65 58.49 1hdn h LYS 79 Cb 0.28 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 1hdn h LYS 79 CO -0.00 0.67 -0.40 -0.07 -1.08 0.00 0.00 179.45 178.57 1hdn h LEU 80 N 0.90 -1.03 -0.67 2.94 4.07 -1.16 -2.80 115.31 117.56 1hdn h LEU 80 Ca 0.24 0.06 0.14 0.00 0.08 0.00 0.00 57.88 58.40 1hdn h LEU 80 Cb 0.01 0.31 -0.10 0.00 1.08 0.00 0.00 40.66 41.95 1hdn h LEU 80 CO -0.04 -0.59 0.10 -0.03 -1.08 0.00 0.00 178.44 176.79 1hdn h MET 81 N -0.94 0.20 -0.79 1.13 4.05 -1.30 -2.15 114.93 115.13 1hdn h MET 81 Ca -0.08 -0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.34 1hdn h MET 81 Cb 0.76 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.48 1hdn h MET 81 CO 0.06 0.13 0.52 0.00 0.23 0.00 0.00 176.91 177.85 1hdn h ALA 82 N 1.58 1.01 -0.39 0.39 0.00 -1.24 -2.95 119.26 117.65 1hdn h ALA 82 Ca 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1hdn h ALA 82 Cb 0.60 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1hdn h ALA 82 CO -0.51 0.40 0.00 0.39 0.00 0.00 0.00 179.25 179.53 1hdn n GLU 83 N -4.55 2.29 -3.79 0.00 1.02 -0.86 -4.85 120.64 109.91 1hdn n GLU 83 Ca 0.08 -1.97 -0.37 0.00 -0.02 0.00 0.00 57.16 54.89 1hdn n GLU 83 Cb 0.03 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 29.91 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 -1.37 4.37 0.00 -4.62 1.43 -0.90 -5.07 118.68 112.52 1hdn s LEU 84 Ca 0.37 0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.98 1hdn s LEU 84 Cb 0.21 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1hdn s LEU 84 CO 0.29 0.35 0.00 -0.62 0.23 0.00 0.00 176.35 176.60