#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hl5 s THR 2 N 0.00 4.18 0.01 0.00 -1.32 -0.86 -4.89 115.64 112.76 1hl5 s THR 2 Ca 0.00 1.68 0.00 0.00 -1.21 0.00 0.00 61.69 62.16 1hl5 s THR 2 Cb 0.00 -3.87 -0.01 0.00 -1.51 0.00 0.00 72.50 67.10 1hl5 s THR 2 CO 0.00 0.02 -0.02 -0.54 -2.21 0.00 0.00 174.62 171.86 1hl5 s LYS 3 N -2.37 0.23 0.22 7.08 1.02 -1.26 -0.98 119.74 123.68 1hl5 s LYS 3 Ca 0.54 -0.44 -0.04 0.00 0.02 0.00 0.00 55.97 56.04 1hl5 s LYS 3 Cb -0.17 0.06 -0.03 0.00 -0.52 0.00 0.00 37.83 37.17 1hl5 s LYS 3 CO 0.22 -0.03 0.24 0.00 -0.92 0.00 0.00 175.35 174.86 1hl5 s ALA 4 N -1.03 0.76 0.05 5.17 0.00 -0.70 -1.43 121.76 124.58 1hl5 s ALA 4 Ca -0.11 -1.46 -0.23 0.00 0.00 0.00 0.00 51.96 50.16 1hl5 s ALA 4 Cb -0.07 1.30 0.05 0.00 0.00 0.00 0.00 23.12 24.40 1hl5 s ALA 4 CO -0.01 -0.67 0.53 0.54 0.00 0.00 0.00 175.76 176.15 1hl5 s VAL 5 N -4.10 0.03 -0.12 0.00 0.11 0.21 -1.25 120.40 115.27 1hl5 s VAL 5 Ca 0.34 -0.22 -0.06 0.00 -2.93 0.00 0.00 61.98 59.11 1hl5 s VAL 5 Cb 0.05 -0.98 0.05 0.00 -1.53 0.00 0.00 36.38 33.97 1hl5 s VAL 5 CO 0.11 -0.12 0.28 0.00 -3.33 0.00 0.00 175.10 172.04 1hl5 s VAL 7 N 1.57 5.23 -0.10 0.00 1.01 -1.26 -0.97 120.40 125.87 1hl5 s VAL 7 Ca -0.07 0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.87 1hl5 s VAL 7 Cb -0.10 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1hl5 s VAL 7 CO -0.09 0.06 0.46 -0.76 0.00 0.00 0.00 175.10 174.77 1hl5 s LEU 8 N 1.90 4.30 0.10 3.92 1.43 0.10 -3.99 118.68 126.45 1hl5 s LEU 8 Ca 0.10 0.82 -0.08 0.00 -1.03 0.00 0.00 54.13 53.94 1hl5 s LEU 8 Cb -0.16 -2.67 -0.00 0.00 0.03 0.00 0.00 46.19 43.38 1hl5 s LEU 8 CO 0.11 0.05 0.19 -0.54 0.23 0.00 0.00 176.35 176.39 1hl5 s LYS 9 N 0.39 0.88 0.00 1.70 1.02 -0.69 -1.68 119.74 121.36 1hl5 s LYS 9 Ca 0.25 -1.00 0.00 0.00 0.02 0.00 0.00 55.97 55.24 1hl5 s LYS 9 Cb -0.15 0.34 0.00 0.00 -0.52 0.00 0.00 37.83 37.50 1hl5 s LYS 9 CO 0.10 -0.28 0.00 0.41 -0.92 0.00 0.00 175.35 174.66 1hl5 n GLY 10 N -0.08 3.68 0.12 -3.33 0.00 -1.24 -1.42 105.19 102.92 1hl5 n GLY 10 Ca -0.14 -0.92 0.13 0.00 0.00 0.00 0.00 46.02 45.08 1hl5 n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1hl5 h ASP 11 N 0.00 0.00 -0.77 1.61 3.32 -1.92 -3.47 116.42 115.19 1hl5 h ASP 11 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1hl5 h ASP 11 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1hl5 h ASP 11 CO 0.00 0.03 0.00 0.61 -1.72 0.00 0.00 179.24 178.16 1hl5 n GLY 12 N 1.27 4.18 0.51 2.75 0.00 -1.26 -5.02 105.19 107.63 1hl5 n GLY 12 Ca 0.04 -1.95 0.10 0.00 0.00 0.00 0.00 46.02 44.22 1hl5 n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hl5 n PRO 13 N 0.00 1.68 -2.67 1.61 -0.04 -1.26 -4.89 135.00 129.43 1hl5 n PRO 13 Ca 0.00 -1.02 -0.42 0.00 -0.04 0.00 0.00 63.50 62.02 1hl5 n PRO 13 Cb 0.00 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 1hl5 n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1hl5 s VAL 14 N -1.81 4.74 0.01 0.52 1.01 -1.26 -4.29 120.40 119.32 1hl5 s VAL 14 Ca 0.32 1.99 -0.23 0.00 0.00 0.00 0.00 61.98 64.06 1hl5 s VAL 14 Cb 0.17 -4.28 0.05 0.00 0.00 0.00 0.00 36.38 32.32 1hl5 s VAL 14 CO 0.26 0.05 0.52 -1.58 0.00 0.00 0.00 175.10 174.35 1hl5 s GLN 15 N 1.75 0.97 0.00 2.72 -0.44 -0.92 -3.68 119.66 120.06 1hl5 s GLN 15 Ca 0.50 -0.09 0.00 0.00 -2.50 0.00 0.00 55.36 53.27 1hl5 s GLN 15 Cb -0.20 0.45 0.00 0.00 -1.64 0.00 0.00 33.01 31.62 1hl5 s GLN 15 CO 0.21 -0.33 0.00 0.41 0.50 0.00 0.00 175.29 176.09 1hl5 n GLY 16 N 0.70 -0.27 3.15 2.59 0.00 -0.67 -0.59 105.19 110.10 1hl5 n GLY 16 Ca -0.19 -0.95 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 1hl5 n GLY 16 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hl5 s ILE 17 N -2.00 1.59 -0.07 -0.61 1.01 -0.98 0.03 121.20 120.17 1hl5 s ILE 17 Ca 0.00 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.91 1hl5 s ILE 17 Cb 0.00 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 41.10 1hl5 s ILE 17 CO 0.00 0.45 -0.17 -0.63 0.00 0.00 0.00 174.94 174.59 1hl5 s ILE 18 N 0.23 1.50 0.13 2.92 -1.09 -0.15 -2.51 121.20 122.23 1hl5 s ILE 18 Ca -0.10 -0.71 0.04 0.00 -2.23 0.00 0.00 60.65 57.66 1hl5 s ILE 18 Cb -0.14 -1.32 -0.04 0.00 -1.58 0.00 0.00 42.46 39.38 1hl5 s ILE 18 CO 0.04 0.43 0.09 0.20 -1.23 0.00 0.00 174.94 174.48 1hl5 s ASN 19 N 0.39 5.43 -0.01 3.58 -0.87 0.11 -0.68 114.94 122.88 1hl5 s ASN 19 Ca -0.13 -0.11 0.04 0.00 -1.57 0.00 0.00 52.86 51.09 1hl5 s ASN 19 Cb -0.15 -1.41 -0.01 0.00 -0.02 0.00 0.00 41.25 39.66 1hl5 s ASN 19 CO 0.05 0.12 -0.13 -0.36 -2.57 0.00 0.00 177.10 174.21 1hl5 s PHE 20 N -1.57 1.15 -0.04 2.20 0.40 -0.38 -1.02 117.98 118.72 1hl5 s PHE 20 Ca 0.30 -0.23 -0.02 0.00 -0.60 0.00 0.00 56.93 56.37 1hl5 s PHE 20 Cb -0.11 -0.75 0.03 0.00 0.51 0.00 0.00 43.02 42.69 1hl5 s PHE 20 CO 0.22 -0.03 0.10 -2.00 0.70 0.00 0.00 175.22 174.20 1hl5 s GLU 21 N -0.24 0.06 -0.32 0.44 2.12 -0.00 -1.71 118.70 119.06 1hl5 s GLU 21 Ca 0.04 0.24 0.00 0.00 0.36 0.00 0.00 54.97 55.60 1hl5 s GLU 21 Cb -0.06 -0.11 0.10 0.00 0.26 0.00 0.00 34.13 34.32 1hl5 s GLU 21 CO -0.00 -0.11 0.09 -1.14 -0.54 0.00 0.00 175.26 173.56 1hl5 s GLN 22 N 0.74 0.85 0.25 4.30 0.74 -0.15 -0.90 119.66 125.49 1hl5 s GLN 22 Ca -0.06 -1.21 -0.00 0.00 0.05 0.00 0.00 55.36 54.14 1hl5 s GLN 22 Cb -0.08 -2.20 0.31 0.00 1.10 0.00 0.00 33.01 32.14 1hl5 s GLN 22 CO -0.03 -0.98 1.68 -0.22 -0.55 0.00 0.00 175.29 175.19 1hl5 h LYS 23 N 8.00 0.58 -6.85 1.67 1.63 -1.82 -2.28 116.57 117.50 1hl5 h LYS 23 Ca -0.12 -0.23 -0.69 0.00 -0.85 0.00 0.00 60.65 58.76 1hl5 h LYS 23 Cb 1.02 -0.03 -0.22 0.00 -0.60 0.00 0.00 32.23 32.40 1hl5 h LYS 23 CO 0.48 0.79 -0.86 -1.21 -3.45 0.00 0.00 179.45 175.20 1hl5 s GLU 24 N -4.50 1.52 0.21 1.90 2.02 -1.26 -4.54 118.70 114.06 1hl5 s GLU 24 Ca -0.08 -1.29 -0.32 0.00 0.02 0.00 0.00 54.97 53.31 1hl5 s GLU 24 Cb 0.13 -1.95 -0.13 0.00 0.10 0.00 0.00 34.13 32.29 1hl5 s GLU 24 CO 0.81 0.46 1.57 0.43 0.02 0.00 0.00 175.26 178.56 1hl5 n SER 25 N 1.03 3.35 0.00 -0.19 7.64 -1.26 -0.76 113.62 123.43 1hl5 n SER 25 Ca -0.17 1.10 0.00 0.00 1.01 0.00 0.00 58.87 60.81 1hl5 n SER 25 Cb 0.53 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.24 1hl5 n SER 25 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1hl5 n ASN 26 N 3.00 -3.12 -3.38 6.43 3.02 -1.26 -4.95 115.26 115.00 1hl5 n ASN 26 Ca 0.14 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.48 1hl5 n ASN 26 Cb 0.32 -2.84 0.14 0.00 -0.61 0.00 0.00 39.78 36.80 1hl5 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hl5 n GLY 27 N -0.54 -1.32 3.75 7.41 0.00 0.06 -5.01 105.19 109.54 1hl5 n GLY 27 Ca 0.00 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.92 1hl5 n GLY 27 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1hl5 s PRO 28 N -5.05 3.18 -0.17 1.61 0.02 -1.26 -4.83 135.00 128.50 1hl5 s PRO 28 Ca 0.54 2.28 -0.05 0.00 0.02 0.00 0.00 61.00 63.79 1hl5 s PRO 28 Cb -0.01 -2.30 -0.03 0.00 0.02 0.00 0.00 34.50 32.17 1hl5 s PRO 28 CO 0.38 -1.17 0.01 0.08 -0.33 0.00 0.00 177.00 175.96 1hl5 s VAL 29 N -1.28 4.25 -0.16 3.83 1.01 0.30 -4.35 120.40 124.00 1hl5 s VAL 29 Ca 0.71 -0.22 -0.19 0.00 0.00 0.00 0.00 61.98 62.28 1hl5 s VAL 29 Cb -0.41 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 1hl5 s VAL 29 CO 0.50 0.47 0.51 -0.75 0.00 0.00 0.00 175.10 175.82 1hl5 s LYS 30 N 0.50 4.27 -0.22 2.72 2.20 -0.08 -0.94 119.74 128.19 1hl5 s LYS 30 Ca -0.00 0.46 0.01 0.00 -0.36 0.00 0.00 55.97 56.07 1hl5 s LYS 30 Cb -0.14 -3.50 0.03 0.00 -1.51 0.00 0.00 37.83 32.72 1hl5 s LYS 30 CO 0.02 -0.01 -0.14 0.08 -0.36 0.00 0.00 175.35 174.94 1hl5 s VAL 31 N 1.17 2.26 0.00 4.02 1.01 0.49 -0.82 120.40 128.53 1hl5 s VAL 31 Ca 0.26 -1.19 -0.19 0.00 0.00 0.00 0.00 61.98 60.85 1hl5 s VAL 31 Cb -0.15 -2.12 0.04 0.00 0.00 0.00 0.00 36.38 34.14 1hl5 s VAL 31 CO 0.10 0.28 0.41 -1.66 0.00 0.00 0.00 175.10 174.23 1hl5 s TRP 32 N 1.23 -0.29 -4.08 5.22 -2.14 -0.19 -0.31 118.94 118.39 1hl5 s TRP 32 Ca -0.01 0.40 0.00 0.00 2.66 0.00 0.00 56.10 59.15 1hl5 s TRP 32 Cb -0.16 0.19 0.00 0.00 -3.10 0.00 0.00 33.47 30.40 1hl5 s TRP 32 CO -0.09 -0.50 0.00 0.41 -2.66 0.00 0.00 176.95 174.12 1hl5 n GLY 33 N 0.92 -0.53 3.06 3.67 0.00 -0.55 0.07 105.19 111.83 1hl5 n GLY 33 Ca -0.20 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.86 1hl5 n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hl5 s SER 34 N -4.00 -0.10 -0.06 1.61 0.15 -1.04 -0.57 113.70 109.69 1hl5 s SER 34 Ca 0.00 0.14 0.03 0.00 0.70 0.00 0.00 55.95 56.82 1hl5 s SER 34 Cb 0.00 0.29 0.01 0.00 -1.71 0.00 0.00 66.02 64.60 1hl5 s SER 34 CO 0.00 -0.16 -0.14 -0.63 1.20 0.00 0.00 173.24 173.51 1hl5 s ILE 35 N -0.42 1.22 0.45 6.45 1.01 -0.31 -2.33 121.20 127.27 1hl5 s ILE 35 Ca -0.05 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.09 1hl5 s ILE 35 Cb -0.03 -1.09 -0.05 0.00 0.01 0.00 0.00 42.46 41.30 1hl5 s ILE 35 CO 0.01 0.37 0.07 -1.59 0.00 0.00 0.00 174.94 173.79 1hl5 s LYS 36 N 0.43 2.10 0.00 2.79 -2.85 0.24 0.01 119.74 122.46 1hl5 s LYS 36 Ca -0.11 -2.14 0.00 0.00 -1.00 0.00 0.00 55.97 52.73 1hl5 s LYS 36 Cb -0.14 -1.71 0.00 0.00 -2.06 0.00 0.00 37.83 33.92 1hl5 s LYS 36 CO 0.03 -0.19 0.00 0.41 0.10 0.00 0.00 175.35 175.70 1hl5 n GLY 37 N -1.16 0.61 3.95 0.59 0.00 -0.95 -2.18 105.19 106.06 1hl5 n GLY 37 Ca -0.08 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 1hl5 n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hl5 s LEU 38 N 0.00 4.18 0.45 0.99 1.43 -0.72 -4.40 118.68 120.62 1hl5 s LEU 38 Ca 0.00 0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 53.15 1hl5 s LEU 38 Cb 0.00 -3.08 -0.08 0.00 0.03 0.00 0.00 46.19 43.05 1hl5 s LEU 38 CO 0.00 -0.16 1.06 0.42 0.23 0.00 0.00 176.35 177.90 1hl5 s THR 39 N -2.10 3.65 0.28 5.49 -4.23 -1.26 -4.12 115.64 113.36 1hl5 s THR 39 Ca 0.37 1.14 -0.30 0.00 -1.18 0.00 0.00 61.69 61.73 1hl5 s THR 39 Cb -0.10 -3.53 -0.13 0.00 1.34 0.00 0.00 72.50 70.09 1hl5 s THR 39 CO 0.32 -0.11 1.39 1.21 -0.54 0.00 0.00 174.62 176.89 1hl5 n GLU 40 N -0.57 2.16 0.00 3.99 2.13 -1.26 -4.59 120.64 122.50 1hl5 n GLU 40 Ca 0.07 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.66 1hl5 n GLU 40 Cb 0.51 -2.41 0.00 0.00 0.27 0.00 0.00 31.44 29.81 1hl5 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hl5 n GLY 41 N 1.65 -0.01 3.82 8.31 0.00 -0.37 -4.93 105.19 113.67 1hl5 n GLY 41 Ca 0.09 -2.25 -0.35 0.00 0.00 0.00 0.00 46.02 43.51 1hl5 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hl5 s LEU 42 N 0.00 4.21 -0.03 0.99 1.43 -1.26 -0.98 118.68 123.04 1hl5 s LEU 42 Ca 0.00 1.43 -0.01 0.00 -1.03 0.00 0.00 54.13 54.52 1hl5 s LEU 42 Cb 0.00 -3.87 0.03 0.00 0.03 0.00 0.00 46.19 42.38 1hl5 s LEU 42 CO 0.00 -0.09 0.05 -1.00 0.23 0.00 0.00 176.35 175.54 1hl5 s HIS 43 N -1.74 0.02 0.54 0.29 3.76 -0.15 -2.95 115.29 115.05 1hl5 s HIS 43 Ca 0.49 0.18 -0.22 0.00 -0.15 0.00 0.00 55.06 55.37 1hl5 s HIS 43 Cb -0.14 -0.26 -0.05 0.00 1.11 0.00 0.00 32.58 33.24 1hl5 s HIS 43 CO 0.19 -0.11 1.35 0.20 -0.85 0.00 0.00 174.74 175.52 1hl5 s GLY 44 N 1.27 2.88 -0.19 -2.22 0.00 -0.41 -0.56 107.32 108.08 1hl5 s GLY 44 Ca -0.07 1.31 -0.04 0.00 0.00 0.00 0.00 44.72 45.92 1hl5 s GLY 44 CO -0.03 1.83 0.19 -0.12 0.00 0.00 0.00 173.10 174.96 1hl5 s PHE 45 N -1.32 -0.16 0.03 1.90 5.36 -0.20 -0.80 117.98 122.79 1hl5 s PHE 45 Ca 0.71 0.12 -0.03 0.00 -0.96 0.00 0.00 56.93 56.78 1hl5 s PHE 45 Cb -0.40 -0.43 -0.02 0.00 -0.34 0.00 0.00 43.02 41.83 1hl5 s PHE 45 CO 0.47 -0.56 0.03 -1.01 -1.46 0.00 0.00 175.22 172.68 1hl5 s HIS 46 N 2.28 0.26 -0.22 10.12 3.76 -0.78 -2.63 115.29 128.07 1hl5 s HIS 46 Ca 0.05 -0.56 -0.20 0.00 -0.15 0.00 0.00 55.06 54.20 1hl5 s HIS 46 Cb -0.16 -0.19 -0.02 0.00 1.11 0.00 0.00 32.58 33.32 1hl5 s HIS 46 CO -0.11 -0.28 0.60 0.08 -0.85 0.00 0.00 174.74 174.18 1hl5 s VAL 47 N -2.16 5.03 0.34 -0.90 1.01 0.19 -0.83 120.40 123.07 1hl5 s VAL 47 Ca -0.09 1.09 0.05 0.00 0.00 0.00 0.00 61.98 63.03 1hl5 s VAL 47 Cb -0.04 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 1hl5 s VAL 47 CO -0.03 0.09 0.49 -1.00 0.00 0.00 0.00 175.10 174.65 1hl5 s HIS 48 N 2.12 3.22 0.08 5.22 3.76 0.12 -0.90 115.29 128.91 1hl5 s HIS 48 Ca 0.26 -0.07 -0.18 0.00 -0.15 0.00 0.00 55.06 54.92 1hl5 s HIS 48 Cb -0.16 -1.97 -0.08 0.00 1.11 0.00 0.00 32.58 31.49 1hl5 s HIS 48 CO 0.09 0.02 1.49 1.49 -0.85 0.00 0.00 174.74 176.98 1hl5 h GLU 49 N 0.85 0.49 -5.97 1.40 4.81 -0.69 -2.67 114.58 112.80 1hl5 h GLU 49 Ca -0.47 -0.18 -0.68 0.00 -0.13 0.00 0.00 59.36 57.90 1hl5 h GLU 49 Cb 1.25 -0.03 -0.18 0.00 0.63 0.00 0.00 28.75 30.42 1hl5 h GLU 49 CO 0.56 0.70 -0.67 -0.06 -0.73 0.00 0.00 179.01 178.81 1hl5 s PHE 50 N -4.80 3.02 -0.45 0.92 0.08 -0.30 -4.65 117.98 111.80 1hl5 s PHE 50 Ca -0.13 0.03 -0.05 0.00 0.12 0.00 0.00 56.93 56.90 1hl5 s PHE 50 Cb 0.08 -1.77 -0.06 0.00 -0.57 0.00 0.00 43.02 40.70 1hl5 s PHE 50 CO 0.76 0.33 3.04 0.41 -0.10 0.00 0.00 175.22 179.66 1hl5 n GLY 51 N 2.38 3.96 3.12 4.36 0.00 -0.94 -3.82 105.19 114.24 1hl5 n GLY 51 Ca -0.18 -1.65 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 1hl5 n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hl5 s ASP 52 N 1.03 4.84 -0.22 1.61 -1.08 -1.26 -4.96 116.67 116.63 1hl5 s ASP 52 Ca 0.62 -1.56 0.15 0.00 -0.52 0.00 0.00 52.55 51.24 1hl5 s ASP 52 Cb 0.33 -1.68 0.73 0.00 -1.46 0.00 0.00 42.92 40.84 1hl5 s ASP 52 CO -0.13 -0.31 1.65 -3.20 0.52 0.00 0.00 175.17 173.70 1hl5 n ASN 53 N 4.52 5.16 0.24 -0.34 4.05 -1.26 -2.88 115.26 124.76 1hl5 n ASN 53 Ca -0.09 -2.95 0.08 0.00 0.45 0.00 0.00 54.58 52.07 1hl5 n ASN 53 Cb 0.43 -0.64 0.60 0.00 1.23 0.00 0.00 39.78 41.39 1hl5 n ASN 53 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1hl5 h THR 54 N 3.33 0.96 -1.03 -0.44 1.35 -1.92 -2.51 112.91 112.64 1hl5 h THR 54 Ca 0.00 -0.47 -0.56 0.00 -0.55 0.00 0.00 66.41 64.83 1hl5 h THR 54 Cb 1.81 1.26 -0.43 0.00 -1.73 0.00 0.00 68.15 69.07 1hl5 h THR 54 CO 0.41 0.13 -0.79 0.00 -0.25 0.00 0.00 175.52 175.01 1hl5 n ALA 55 N -2.45 5.00 -0.69 6.62 0.00 -1.26 -5.06 120.51 122.67 1hl5 n ALA 55 Ca -0.02 -3.97 0.00 0.00 0.00 0.00 0.00 53.44 49.44 1hl5 n ALA 55 Cb 0.21 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1hl5 n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hl5 n GLY 56 N -0.62 0.53 0.24 0.00 0.00 -0.95 -3.09 105.19 101.31 1hl5 n GLY 56 Ca 0.41 -0.79 0.16 0.00 0.00 0.00 0.00 46.02 45.80 1hl5 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hl5 h THR 58 N 0.00 1.21 0.00 0.00 2.02 -1.88 -2.33 112.91 111.94 1hl5 h THR 58 Ca 0.00 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1hl5 h THR 58 Cb 0.43 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1hl5 h THR 58 CO 0.00 0.25 0.00 -1.54 0.37 0.00 0.00 175.52 174.60 1hl5 n SER 59 N -4.34 0.00 0.06 4.18 3.41 -1.16 -2.65 113.62 113.12 1hl5 n SER 59 Ca 0.06 -0.36 0.10 0.00 -0.26 0.00 0.00 58.87 58.41 1hl5 n SER 59 Cb 0.13 -0.14 0.41 0.00 -0.26 0.00 0.00 64.21 64.35 1hl5 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hl5 n ALA 60 N -1.14 1.72 -0.35 7.33 0.00 -0.88 -4.42 120.51 122.77 1hl5 n ALA 60 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1hl5 n ALA 60 Cb 0.12 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1hl5 n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hl5 n GLY 61 N 0.13 -0.84 1.66 0.00 0.00 -1.08 -1.15 105.19 103.90 1hl5 n GLY 61 Ca 0.03 -1.17 -0.11 0.00 0.00 0.00 0.00 46.02 44.77 1hl5 n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hl5 n PRO 62 N -0.13 -0.14 -2.03 1.61 -0.04 -1.26 -4.61 135.00 128.41 1hl5 n PRO 62 Ca 0.00 -1.02 -0.39 0.00 -0.04 0.00 0.00 63.50 62.05 1hl5 n PRO 62 Cb 0.00 -0.44 -0.00 0.00 -0.04 0.00 0.00 33.50 33.02 1hl5 n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1hl5 s HIS 63 N -1.73 2.77 0.03 0.54 3.76 -1.26 -0.61 115.29 118.79 1hl5 s HIS 63 Ca 0.30 1.40 -0.30 0.00 -0.15 0.00 0.00 55.06 56.31 1hl5 s HIS 63 Cb -0.01 -3.69 -0.08 0.00 1.11 0.00 0.00 32.58 29.91 1hl5 s HIS 63 CO 0.21 -2.17 1.77 0.12 -0.85 0.00 0.00 174.74 173.82 1hl5 s PHE 64 N -1.27 1.92 -0.41 1.40 5.36 -0.08 -4.49 117.98 120.42 1hl5 s PHE 64 Ca 0.58 0.00 0.09 0.00 -0.96 0.00 0.00 56.93 56.65 1hl5 s PHE 64 Cb -0.38 -4.07 0.33 0.00 -0.34 0.00 0.00 43.02 38.56 1hl5 s PHE 64 CO 0.49 -4.51 0.87 -1.71 -1.46 0.00 0.00 175.22 168.89 1hl5 n ASN 65 N 6.59 -0.48 0.29 6.13 5.15 -1.26 -1.68 115.26 130.00 1hl5 n ASN 65 Ca 0.18 -3.26 0.16 0.00 -0.60 0.00 0.00 54.58 51.05 1hl5 n ASN 65 Cb 0.41 0.39 0.87 0.00 -0.53 0.00 0.00 39.78 40.92 1hl5 n ASN 65 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1hl5 h PRO 66 N 3.08 0.00 -0.47 1.20 0.13 -1.90 -1.71 132.00 132.33 1hl5 h PRO 66 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1hl5 h PRO 66 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1hl5 h PRO 66 CO 0.36 0.06 0.00 1.28 -0.23 0.00 0.00 178.00 179.46 1hl5 n LEU 67 N -3.55 2.82 -3.84 1.56 4.77 -1.26 -4.97 117.00 112.54 1hl5 n LEU 67 Ca -0.02 -1.35 -0.29 0.00 -0.03 0.00 0.00 56.01 54.31 1hl5 n LEU 67 Cb 0.17 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1hl5 n LEU 67 CO 0.27 0.68 -0.16 -1.20 -1.33 0.00 0.00 177.39 175.65 1hl5 n SER 68 N 1.05 -2.78 -4.96 -1.43 7.64 -0.64 -5.00 113.62 107.50 1hl5 n SER 68 Ca 0.18 -1.03 -0.24 0.00 1.01 0.00 0.00 58.87 58.79 1hl5 n SER 68 Cb 0.46 -3.12 0.03 0.00 -1.01 0.00 0.00 64.21 60.57 1hl5 n SER 68 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1hl5 n ARG 69 N -4.35 0.63 -2.90 1.43 1.74 -1.26 -5.13 116.66 106.82 1hl5 n ARG 69 Ca -0.20 -3.42 -0.25 0.00 -0.77 0.00 0.00 57.85 53.20 1hl5 n ARG 69 Cb 0.64 0.14 0.00 0.00 -1.02 0.00 0.00 32.46 32.22 1hl5 n ARG 69 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1hl5 s LYS 70 N -4.47 3.36 0.46 5.56 1.02 -1.26 -4.75 119.74 119.65 1hl5 s LYS 70 Ca 0.44 -0.12 -0.24 0.00 0.02 0.00 0.00 55.97 56.06 1hl5 s LYS 70 Cb -0.03 -2.49 -0.07 0.00 -0.52 0.00 0.00 37.83 34.72 1hl5 s LYS 70 CO 0.28 -0.17 1.27 -1.58 -0.92 0.00 0.00 175.35 174.23 1hl5 s HIS 71 N -2.61 2.71 0.00 3.18 5.65 -0.27 -3.05 115.29 120.91 1hl5 s HIS 71 Ca 0.46 1.44 0.00 0.00 0.25 0.00 0.00 55.06 57.21 1hl5 s HIS 71 Cb -0.10 -3.61 0.00 0.00 -1.18 0.00 0.00 32.58 27.69 1hl5 s HIS 71 CO 0.41 -2.10 0.00 0.41 -0.65 0.00 0.00 174.74 172.81 1hl5 n GLY 72 N 0.61 2.73 3.94 1.59 0.00 -1.24 -4.42 105.19 108.39 1hl5 n GLY 72 Ca 0.06 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.82 1hl5 n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hl5 s GLY 73 N -0.61 1.61 0.48 -0.02 0.00 -1.23 -4.71 107.32 102.84 1hl5 s GLY 73 Ca 0.00 -0.93 0.14 0.00 0.00 0.00 0.00 44.72 43.92 1hl5 s GLY 73 CO 0.00 -0.70 2.11 -0.56 0.00 0.00 0.00 173.10 173.95 1hl5 h PRO 74 N 0.12 0.18 0.00 2.90 0.13 -1.88 -1.89 132.00 131.56 1hl5 h PRO 74 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1hl5 h PRO 74 Cb 1.26 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1hl5 h PRO 74 CO 0.58 0.12 0.00 1.63 -0.23 0.00 0.00 178.00 180.10 1hl5 n LYS 75 N -4.51 0.19 -2.83 0.86 4.76 -1.26 -4.87 118.16 110.50 1hl5 n LYS 75 Ca -0.00 0.22 -0.35 0.00 -2.87 0.00 0.00 58.31 55.31 1hl5 n LYS 75 Cb 0.11 -1.75 -0.07 0.00 -1.84 0.00 0.00 35.03 31.48 1hl5 n LYS 75 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1hl5 s ASP 76 N -4.13 7.12 0.13 4.39 1.01 -0.71 -4.97 116.67 119.50 1hl5 s ASP 76 Ca 0.10 1.72 -0.09 0.00 0.71 0.00 0.00 52.55 55.00 1hl5 s ASP 76 Cb 0.13 -2.54 -0.08 0.00 1.01 0.00 0.00 42.92 41.43 1hl5 s ASP 76 CO 0.53 -0.20 1.35 -0.08 0.21 0.00 0.00 175.17 176.98 1hl5 h GLU 77 N 2.57 0.66 -5.63 8.23 4.22 -1.89 -3.37 114.58 119.37 1hl5 h GLU 77 Ca -0.48 -0.54 -0.62 0.00 0.08 0.00 0.00 59.36 57.80 1hl5 h GLU 77 Cb 1.19 0.11 -0.13 0.00 0.50 0.00 0.00 28.75 30.42 1hl5 h GLU 77 CO 0.63 1.16 0.82 -2.00 -2.18 0.00 0.00 179.01 177.44 1hl5 s GLU 78 N -3.70 3.28 0.16 1.92 2.56 -1.26 -4.95 118.70 116.71 1hl5 s GLU 78 Ca -0.09 -0.93 -0.18 0.00 0.00 0.00 0.00 54.97 53.78 1hl5 s GLU 78 Cb 0.09 -4.49 0.04 0.00 2.00 0.00 0.00 34.13 31.77 1hl5 s GLU 78 CO 0.88 -1.92 0.49 -0.98 -0.56 0.00 0.00 175.26 173.16 1hl5 s ARG 79 N 4.24 1.24 0.49 4.30 1.70 -1.17 -3.72 118.95 126.04 1hl5 s ARG 79 Ca 0.30 -0.75 -0.19 0.00 -0.47 0.00 0.00 55.73 54.62 1hl5 s ARG 79 Cb -0.11 0.51 -0.08 0.00 -0.57 0.00 0.00 34.95 34.70 1hl5 s ARG 79 CO 0.05 -0.52 1.01 -1.01 -1.08 0.00 0.00 175.30 173.75 1hl5 s HIS 80 N -3.83 3.15 0.38 5.89 3.76 -1.20 -4.67 115.29 118.77 1hl5 s HIS 80 Ca 0.06 1.56 0.11 0.00 -0.15 0.00 0.00 55.06 56.63 1hl5 s HIS 80 Cb 0.00 -2.96 0.88 0.00 1.11 0.00 0.00 32.58 31.62 1hl5 s HIS 80 CO -0.08 -0.61 1.91 0.28 -0.85 0.00 0.00 174.74 175.40 1hl5 h VAL 81 N 1.40 0.87 -0.04 -0.90 2.07 -1.87 -2.01 116.25 115.76 1hl5 h VAL 81 Ca -0.49 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1hl5 h VAL 81 Cb 1.20 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1hl5 h VAL 81 CO 0.60 0.11 0.00 0.61 0.02 0.00 0.00 177.57 178.91 1hl5 n GLY 82 N -1.47 -0.71 3.56 2.17 0.00 -0.68 -4.37 105.19 103.69 1hl5 n GLY 82 Ca 0.14 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1hl5 n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hl5 s ASP 83 N -1.42 6.45 -0.09 1.61 1.01 -0.76 -0.64 116.67 122.83 1hl5 s ASP 83 Ca 0.22 -1.34 0.17 0.00 0.71 0.00 0.00 52.55 52.32 1hl5 s ASP 83 Cb 0.11 -2.57 0.66 0.00 1.01 0.00 0.00 42.92 42.13 1hl5 s ASP 83 CO 0.17 -1.56 1.55 0.18 0.21 0.00 0.00 175.17 175.73 1hl5 n LEU 84 N 8.99 4.33 0.00 1.23 4.77 -1.08 -3.50 117.00 131.75 1hl5 n LEU 84 Ca 0.30 -2.18 0.00 0.00 -0.03 0.00 0.00 56.01 54.09 1hl5 n LEU 84 Cb 0.51 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1hl5 n LEU 84 CO 0.66 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 178.10 1hl5 n GLY 85 N 1.14 0.53 3.44 -0.72 0.00 -1.21 -4.79 105.19 103.59 1hl5 n GLY 85 Ca 0.24 -0.88 -0.24 0.00 0.00 0.00 0.00 46.02 45.13 1hl5 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hl5 s ASN 86 N -4.00 3.46 0.32 1.61 0.01 -1.26 -1.04 114.94 114.03 1hl5 s ASN 86 Ca 0.00 -0.98 0.09 0.00 -0.71 0.00 0.00 52.86 51.26 1hl5 s ASN 86 Cb 0.00 -0.27 -0.05 0.00 0.41 0.00 0.00 41.25 41.34 1hl5 s ASN 86 CO 0.00 0.05 0.03 0.68 -1.51 0.00 0.00 177.10 176.35 1hl5 s VAL 87 N -2.27 2.97 -0.19 1.60 -7.23 0.27 -4.90 120.40 110.65 1hl5 s VAL 87 Ca 0.26 -1.90 0.01 0.00 -1.81 0.00 0.00 61.98 58.55 1hl5 s VAL 87 Cb -0.06 -2.84 0.03 0.00 0.56 0.00 0.00 36.38 34.08 1hl5 s VAL 87 CO 0.13 -0.26 -0.18 -0.89 -0.31 0.00 0.00 175.10 173.60 1hl5 s THR 88 N -2.44 2.02 0.04 5.32 2.01 -1.26 -0.98 115.64 120.35 1hl5 s THR 88 Ca 0.34 -1.04 -0.15 0.00 0.31 0.00 0.00 61.69 61.15 1hl5 s THR 88 Cb -0.03 -1.90 -0.06 0.00 0.01 0.00 0.00 72.50 70.53 1hl5 s THR 88 CO 0.20 0.42 0.46 0.00 -0.69 0.00 0.00 174.62 175.01 1hl5 s ALA 89 N 1.28 3.66 0.93 7.40 0.00 -0.15 -4.17 121.76 130.71 1hl5 s ALA 89 Ca 0.02 -0.16 -0.09 0.00 0.00 0.00 0.00 51.96 51.74 1hl5 s ALA 89 Cb -0.14 -2.45 0.13 0.00 0.00 0.00 0.00 23.12 20.66 1hl5 s ALA 89 CO -0.11 0.47 0.80 -0.40 0.00 0.00 0.00 175.76 176.51 1hl5 n ASP 90 N 1.64 0.20 0.14 0.00 5.68 0.03 -1.24 116.55 123.01 1hl5 n ASP 90 Ca -0.12 -1.37 0.12 0.00 -0.50 0.00 0.00 54.79 52.92 1hl5 n ASP 90 Cb 0.52 -0.60 0.51 0.00 -1.14 0.00 0.00 41.12 40.41 1hl5 n ASP 90 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1hl5 n LYS 91 N -2.66 0.20 -0.02 0.11 2.85 -1.26 -0.45 118.16 116.92 1hl5 n LYS 91 Ca 0.10 0.46 0.13 0.00 -1.05 0.00 0.00 58.31 57.95 1hl5 n LYS 91 Cb 0.36 -1.90 0.52 0.00 -0.65 0.00 0.00 35.03 33.36 1hl5 n LYS 91 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1hl5 n ASP 92 N -2.28 1.39 0.00 -5.58 8.00 -1.26 -4.88 116.55 111.94 1hl5 n ASP 92 Ca 0.02 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 54.00 1hl5 n ASP 92 Cb 0.21 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 1hl5 n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hl5 n GLY 93 N 1.14 0.58 3.53 0.44 0.00 0.40 -4.73 105.19 106.55 1hl5 n GLY 93 Ca 0.18 -0.35 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 1hl5 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hl5 s VAL 94 N -2.00 4.40 -0.30 1.61 1.01 -1.26 -1.75 120.40 122.12 1hl5 s VAL 94 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.73 1hl5 s VAL 94 Cb 0.00 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 1hl5 s VAL 94 CO 0.00 0.42 0.14 0.00 0.00 0.00 0.00 175.10 175.65 1hl5 s ALA 95 N 0.87 3.27 -0.20 5.51 0.00 0.10 -0.79 121.76 130.51 1hl5 s ALA 95 Ca 0.03 -1.31 -0.23 0.00 0.00 0.00 0.00 51.96 50.45 1hl5 s ALA 95 Cb -0.14 -2.32 -0.02 0.00 0.00 0.00 0.00 23.12 20.64 1hl5 s ALA 95 CO 0.02 -0.79 0.72 -0.51 0.00 0.00 0.00 175.76 175.20 1hl5 s ASP 96 N 1.62 6.78 -0.16 0.00 1.01 -1.26 -1.17 116.67 123.49 1hl5 s ASP 96 Ca 0.05 0.95 -0.04 0.00 0.71 0.00 0.00 52.55 54.22 1hl5 s ASP 96 Cb -0.17 -2.39 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 1hl5 s ASP 96 CO 0.06 -0.36 -0.02 -0.69 0.21 0.00 0.00 175.17 174.38 1hl5 s VAL 97 N 2.18 4.07 -0.25 -1.27 1.01 0.26 -4.75 120.40 121.65 1hl5 s VAL 97 Ca 0.32 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.98 1hl5 s VAL 97 Cb -0.16 -2.80 0.14 0.00 0.00 0.00 0.00 36.38 33.56 1hl5 s VAL 97 CO 0.10 0.48 0.40 -0.55 0.00 0.00 0.00 175.10 175.54 1hl5 s SER 98 N 0.39 0.05 0.05 3.32 0.15 -1.25 -1.48 113.70 114.93 1hl5 s SER 98 Ca -0.02 0.31 0.04 0.00 0.70 0.00 0.00 55.95 56.98 1hl5 s SER 98 Cb -0.14 1.24 -0.02 0.00 -1.71 0.00 0.00 66.02 65.39 1hl5 s SER 98 CO 0.02 -0.29 -0.13 -0.63 1.20 0.00 0.00 173.24 173.41 1hl5 s ILE 99 N 2.58 1.00 -0.11 6.45 1.01 0.58 -4.99 121.20 127.73 1hl5 s ILE 99 Ca 0.14 -1.11 0.03 0.00 0.00 0.00 0.00 60.65 59.71 1hl5 s ILE 99 Cb -0.15 -0.95 0.01 0.00 0.01 0.00 0.00 42.46 41.37 1hl5 s ILE 99 CO -0.16 -0.14 -0.21 -0.70 0.00 0.00 0.00 174.94 173.72 1hl5 s GLU 100 N -1.41 2.80 -0.01 2.79 2.12 -1.26 -0.38 118.70 123.35 1hl5 s GLU 100 Ca -0.02 -0.79 0.01 0.00 0.36 0.00 0.00 54.97 54.54 1hl5 s GLU 100 Cb -0.09 -2.20 0.00 0.00 0.26 0.00 0.00 34.13 32.11 1hl5 s GLU 100 CO 0.02 0.08 -0.04 0.34 -0.54 0.00 0.00 175.26 175.12 1hl5 s ASP 101 N 0.58 0.57 0.00 -1.70 2.15 -0.12 -4.94 116.67 113.21 1hl5 s ASP 101 Ca -0.14 -0.08 0.15 0.00 0.43 0.00 0.00 52.55 52.92 1hl5 s ASP 101 Cb -0.17 -0.13 0.33 0.00 -0.30 0.00 0.00 42.92 42.66 1hl5 s ASP 101 CO 0.04 0.02 1.24 -1.20 -0.17 0.00 0.00 175.17 175.11 1hl5 n SER 102 N 3.25 2.98 -0.10 -0.34 7.64 -1.26 -0.54 113.62 125.25 1hl5 n SER 102 Ca -0.16 -1.89 -0.24 0.00 1.01 0.00 0.00 58.87 57.59 1hl5 n SER 102 Cb 0.56 -0.22 -0.12 0.00 -1.01 0.00 0.00 64.21 63.43 1hl5 n SER 102 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1hl5 n VAL 103 N 0.92 1.57 -0.96 0.44 0.31 -1.26 -4.88 118.33 114.48 1hl5 n VAL 103 Ca 0.14 -0.36 -0.29 0.00 -0.01 0.00 0.00 64.34 63.82 1hl5 n VAL 103 Cb 0.47 -1.82 0.18 0.00 -0.91 0.00 0.00 33.84 31.75 1hl5 n VAL 103 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1hl5 s ILE 104 N -2.47 2.29 0.17 2.52 -4.36 -1.26 -4.85 121.20 113.23 1hl5 s ILE 104 Ca -0.32 0.09 -0.21 0.00 -0.26 0.00 0.00 60.65 59.95 1hl5 s ILE 104 Cb 0.10 -2.41 0.06 0.00 1.25 0.00 0.00 42.46 41.45 1hl5 s ILE 104 CO 0.59 -0.12 0.58 -0.55 0.24 0.00 0.00 174.94 175.68 1hl5 s SER 105 N -3.10 -0.46 -0.15 4.36 0.15 -1.11 -4.72 113.70 108.67 1hl5 s SER 105 Ca 0.66 -0.16 0.16 0.00 0.70 0.00 0.00 55.95 57.31 1hl5 s SER 105 Cb -0.21 0.60 0.70 0.00 -1.71 0.00 0.00 66.02 65.40 1hl5 s SER 105 CO 0.59 -1.01 1.61 0.18 1.20 0.00 0.00 173.24 175.81 1hl5 n LEU 106 N -0.37 4.80 -3.90 3.45 4.77 -1.26 -1.48 117.00 123.01 1hl5 n LEU 106 Ca -0.15 -2.65 -0.08 0.00 -0.03 0.00 0.00 56.01 53.10 1hl5 n LEU 106 Cb 0.64 -0.58 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1hl5 n LEU 106 CO 0.13 0.73 0.38 -0.94 -1.33 0.00 0.00 177.39 176.37 1hl5 s SER 107 N -1.05 -0.17 0.03 -1.43 1.04 -1.26 -4.88 113.70 105.98 1hl5 s SER 107 Ca 0.49 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.16 1hl5 s SER 107 Cb 0.34 0.69 0.00 0.00 0.10 0.00 0.00 66.02 67.16 1hl5 s SER 107 CO 0.19 -1.30 0.00 0.61 0.98 0.00 0.00 173.24 173.72 1hl5 n GLY 108 N -0.44 -1.99 0.00 7.32 0.00 -1.26 -3.35 105.19 105.47 1hl5 n GLY 108 Ca -0.03 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.69 1hl5 n GLY 108 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1hl5 n ASP 109 N 0.76 0.02 -1.62 1.61 4.64 -1.26 -2.14 116.55 118.56 1hl5 n ASP 109 Ca 0.00 0.50 0.09 0.00 -1.38 0.00 0.00 54.79 54.01 1hl5 n ASP 109 Cb 0.00 -0.51 0.37 0.00 -1.04 0.00 0.00 41.12 39.94 1hl5 n ASP 109 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 1hl5 n HIS 110 N -1.52 1.55 -2.00 -0.67 8.25 -1.26 -4.90 115.22 114.67 1hl5 n HIS 110 Ca 0.05 -0.63 -0.42 0.00 -0.26 0.00 0.00 57.72 56.47 1hl5 n HIS 110 Cb 0.27 -0.27 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 1hl5 n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1hl5 n ILE 112 N 3.51 0.06 -2.02 0.00 -5.35 -0.55 -4.94 119.36 110.07 1hl5 n ILE 112 Ca 0.11 -0.53 -0.41 0.00 -0.27 0.00 0.00 62.75 61.65 1hl5 n ILE 112 Cb 0.40 1.32 -0.02 0.00 -1.74 0.00 0.00 39.64 39.59 1hl5 n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1hl5 s ILE 113 N -1.45 2.69 0.00 7.28 -1.09 -1.26 -1.76 121.20 125.61 1hl5 s ILE 113 Ca 0.22 0.58 0.00 0.00 -2.23 0.00 0.00 60.65 59.21 1hl5 s ILE 113 Cb 0.15 -3.37 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 1hl5 s ILE 113 CO 0.22 0.09 0.00 0.61 -1.23 0.00 0.00 174.94 174.64 1hl5 n GLY 114 N 2.19 1.18 2.89 6.18 0.00 0.14 -4.99 105.19 112.78 1hl5 n GLY 114 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1hl5 n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hl5 n ARG 115 N -2.00 0.73 -4.97 1.61 1.74 -0.72 -2.22 116.66 110.83 1hl5 n ARG 115 Ca 0.00 -2.35 -0.32 0.00 -0.77 0.00 0.00 57.85 54.40 1hl5 n ARG 115 Cb 0.00 -0.11 -0.16 0.00 -1.02 0.00 0.00 32.46 31.17 1hl5 n ARG 115 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1hl5 s THR 116 N -1.72 2.61 -0.04 0.55 2.01 -1.01 -0.34 115.64 117.71 1hl5 s THR 116 Ca 0.42 -0.82 -0.17 0.00 0.31 0.00 0.00 61.69 61.43 1hl5 s THR 116 Cb -0.03 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.37 1hl5 s THR 116 CO 0.27 0.54 0.46 -0.22 -0.69 0.00 0.00 174.62 174.97 1hl5 s LEU 117 N 0.34 4.40 -0.04 4.42 2.96 -0.39 0.13 118.68 130.50 1hl5 s LEU 117 Ca -0.14 0.94 0.03 0.00 -0.22 0.00 0.00 54.13 54.73 1hl5 s LEU 117 Cb -0.17 -2.67 0.00 0.00 0.50 0.00 0.00 46.19 43.85 1hl5 s LEU 117 CO 0.07 0.18 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.47 1hl5 s VAL 118 N -0.35 1.07 -0.06 1.68 1.01 -0.01 -2.04 120.40 121.69 1hl5 s VAL 118 Ca 0.25 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1hl5 s VAL 118 Cb -0.16 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1hl5 s VAL 118 CO 0.13 0.32 -0.08 0.54 0.00 0.00 0.00 175.10 176.01 1hl5 s VAL 119 N 0.20 3.60 0.39 2.92 0.11 -0.71 -1.86 120.40 125.06 1hl5 s VAL 119 Ca -0.05 -0.53 0.08 0.00 -2.93 0.00 0.00 61.98 58.55 1hl5 s VAL 119 Cb -0.11 -2.47 -0.03 0.00 -1.53 0.00 0.00 36.38 32.25 1hl5 s VAL 119 CO 0.01 0.59 0.32 -1.00 -3.33 0.00 0.00 175.10 171.69 1hl5 s HIS 120 N -0.80 2.75 0.19 1.54 3.76 0.02 -0.98 115.29 121.76 1hl5 s HIS 120 Ca 0.12 -0.44 -0.08 0.00 -0.15 0.00 0.00 55.06 54.51 1hl5 s HIS 120 Cb -0.11 -2.01 0.09 0.00 1.11 0.00 0.00 32.58 31.67 1hl5 s HIS 120 CO 0.01 0.03 1.66 1.49 -0.85 0.00 0.00 174.74 177.08 1hl5 h GLU 121 N 1.17 1.07 -5.15 1.40 4.81 -0.82 -3.38 114.58 113.68 1hl5 h GLU 121 Ca -0.43 -0.33 -0.56 0.00 -0.13 0.00 0.00 59.36 57.92 1hl5 h GLU 121 Cb 1.26 -0.10 -0.13 0.00 0.63 0.00 0.00 28.75 30.40 1hl5 h GLU 121 CO 0.59 1.03 -0.54 0.15 -0.73 0.00 0.00 179.01 179.51 1hl5 s LYS 122 N -5.06 1.91 0.44 1.92 1.02 -0.00 -4.92 119.74 115.04 1hl5 s LYS 122 Ca -0.12 -2.14 -0.24 0.00 0.02 0.00 0.00 55.97 53.49 1hl5 s LYS 122 Cb 0.14 -0.90 -0.08 0.00 -0.52 0.00 0.00 37.83 36.47 1hl5 s LYS 122 CO 0.86 -0.36 1.19 0.00 -0.92 0.00 0.00 175.35 176.12 1hl5 s ALA 123 N -3.15 3.06 -0.19 5.17 0.00 -1.15 -1.29 121.76 124.21 1hl5 s ALA 123 Ca 0.24 1.00 -0.27 0.00 0.00 0.00 0.00 51.96 52.94 1hl5 s ALA 123 Cb 0.04 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 1hl5 s ALA 123 CO 0.13 -0.67 0.91 0.34 0.00 0.00 0.00 175.76 176.47 1hl5 s ASP 124 N -1.19 7.01 0.00 0.00 -1.08 -1.26 -3.89 116.67 116.26 1hl5 s ASP 124 Ca 0.61 1.25 0.10 0.00 -0.52 0.00 0.00 52.55 53.99 1hl5 s ASP 124 Cb -0.31 -2.49 0.58 0.00 -1.46 0.00 0.00 42.92 39.24 1hl5 s ASP 124 CO 0.38 -0.50 1.37 -0.90 0.52 0.00 0.00 175.17 176.04 1hl5 n ASP 125 N 5.66 0.07 -2.18 -0.34 5.68 0.80 -4.89 116.55 121.35 1hl5 n ASP 125 Ca 0.07 -1.70 -0.20 0.00 -0.50 0.00 0.00 54.79 52.46 1hl5 n ASP 125 Cb 0.48 -0.01 -0.03 0.00 -1.14 0.00 0.00 41.12 40.42 1hl5 n ASP 125 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1hl5 n LEU 126 N -0.61 -1.74 0.00 -2.12 4.77 -1.26 -1.47 117.00 114.56 1hl5 n LEU 126 Ca 0.08 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1hl5 n LEU 126 Cb 0.04 -2.83 0.00 0.00 -2.33 0.00 0.00 43.42 38.31 1hl5 n LEU 126 CO 0.06 -0.43 0.00 0.61 -1.33 0.00 0.00 177.39 176.29 1hl5 n GLY 127 N -0.82 0.66 1.51 -0.72 0.00 -1.25 -3.50 105.19 101.07 1hl5 n GLY 127 Ca -0.23 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.82 1hl5 n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hl5 n LYS 128 N -2.63 3.54 0.00 1.61 5.02 -0.54 -4.56 118.16 120.60 1hl5 n LYS 128 Ca 0.00 -3.04 0.13 0.00 -2.02 0.00 0.00 58.31 53.38 1hl5 n LYS 128 Cb 0.00 -2.06 0.36 0.00 -0.02 0.00 0.00 35.03 33.30 1hl5 n LYS 128 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1hl5 n GLY 129 N -0.20 -1.08 2.11 0.72 0.00 -1.26 -4.96 105.19 100.51 1hl5 n GLY 129 Ca 0.30 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 1hl5 n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hl5 n GLY 130 N 1.44 0.63 3.22 -0.02 0.00 -1.26 -4.97 105.19 104.23 1hl5 n GLY 130 Ca 0.08 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 1hl5 n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hl5 s ASN 131 N -2.89 0.48 0.30 1.61 2.20 -1.26 -5.04 114.94 110.34 1hl5 s ASN 131 Ca 0.00 -1.47 0.04 0.00 -0.94 0.00 0.00 52.86 50.50 1hl5 s ASN 131 Cb 0.00 0.42 0.48 0.00 -2.00 0.00 0.00 41.25 40.15 1hl5 s ASN 131 CO 0.00 -0.89 1.75 -0.08 -2.94 0.00 0.00 177.10 174.94 1hl5 h GLU 132 N 2.51 0.41 -0.74 3.55 4.57 -1.99 -2.61 114.58 120.28 1hl5 h GLU 132 Ca -0.33 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 57.68 1hl5 h GLU 132 Cb 1.25 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.77 1hl5 h GLU 132 CO 0.49 0.63 0.40 1.49 -1.18 0.00 0.00 179.01 180.84 1hl5 h GLU 133 N 0.36 1.02 -0.43 1.92 4.57 -1.99 -0.99 114.58 119.04 1hl5 h GLU 133 Ca 0.05 -0.11 0.02 0.00 -1.18 0.00 0.00 59.36 58.14 1hl5 h GLU 133 Cb 0.64 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 1hl5 h GLU 133 CO 0.05 0.75 0.29 1.03 -1.18 0.00 0.00 179.01 179.94 1hl5 h SER 134 N 1.03 0.44 0.06 1.04 0.87 -1.81 0.93 113.55 116.10 1hl5 h SER 134 Ca 0.26 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1hl5 h SER 134 Cb 0.03 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1hl5 h SER 134 CO -0.04 0.31 -0.02 0.35 -0.53 0.00 0.00 176.83 176.90 1hl5 n THR 135 N -4.48 0.00 -0.06 2.23 -2.24 -0.42 -2.28 114.28 107.04 1hl5 n THR 135 Ca 0.04 -0.12 -0.13 0.00 -2.27 0.00 0.00 64.05 61.57 1hl5 n THR 135 Cb 0.11 -0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.29 1hl5 n THR 135 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hl5 n LYS 136 N -0.50 0.28 0.00 -0.78 5.02 -0.39 -1.11 118.16 120.67 1hl5 n LYS 136 Ca 0.20 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 1hl5 n LYS 136 Cb 0.24 -0.97 0.00 0.00 -0.02 0.00 0.00 35.03 34.28 1hl5 n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1hl5 n THR 137 N -3.63 0.00 -1.11 -0.18 -2.24 0.19 -4.68 114.28 102.63 1hl5 n THR 137 Ca -0.25 -0.28 -0.04 0.00 -2.27 0.00 0.00 64.05 61.22 1hl5 n THR 137 Cb 0.65 1.25 -0.02 0.00 -2.10 0.00 0.00 70.33 70.11 1hl5 n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hl5 n GLY 138 N 0.25 0.66 2.61 3.38 0.00 -0.96 -3.24 105.19 107.87 1hl5 n GLY 138 Ca 0.00 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.40 1hl5 n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hl5 n ASN 139 N 0.43 -5.00 0.00 1.61 3.02 -1.25 -0.14 115.26 113.92 1hl5 n ASN 139 Ca -0.04 -0.02 0.15 0.00 -0.03 0.00 0.00 54.58 54.64 1hl5 n ASN 139 Cb 0.19 -4.16 0.76 0.00 -0.61 0.00 0.00 39.78 35.95 1hl5 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hl5 n ALA 140 N -2.48 2.47 -0.20 5.41 0.00 -1.20 -4.71 120.51 119.81 1hl5 n ALA 140 Ca -0.17 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1hl5 n ALA 140 Cb 0.64 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1hl5 n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hl5 n GLY 141 N 1.26 -0.39 3.75 0.00 0.00 -1.26 -0.82 105.19 107.72 1hl5 n GLY 141 Ca 0.14 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 1hl5 n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hl5 s SER 142 N -4.00 3.92 -0.37 1.61 1.04 -1.26 -4.61 113.70 110.03 1hl5 s SER 142 Ca 0.00 1.50 -0.15 0.00 0.48 0.00 0.00 55.95 57.78 1hl5 s SER 142 Cb 0.00 -2.20 -0.00 0.00 0.10 0.00 0.00 66.02 63.92 1hl5 s SER 142 CO 0.00 -2.36 0.34 -0.13 0.98 0.00 0.00 173.24 172.08 1hl5 s ARG 143 N -4.98 3.36 0.03 4.02 0.52 -1.26 -0.63 118.95 120.00 1hl5 s ARG 143 Ca 0.62 -0.63 -0.00 0.00 -0.52 0.00 0.00 55.73 55.20 1hl5 s ARG 143 Cb -0.17 -3.87 -0.26 0.00 0.52 0.00 0.00 34.95 31.17 1hl5 s ARG 143 CO 0.56 -0.61 0.94 -0.07 0.02 0.00 0.00 175.30 176.14 1hl5 h LEU 144 N 8.74 0.31 -7.10 2.53 3.38 -1.36 -3.47 115.31 118.34 1hl5 h LEU 144 Ca -0.29 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.21 1hl5 h LEU 144 Cb 1.14 -0.10 -0.18 0.00 0.09 0.00 0.00 40.66 41.61 1hl5 h LEU 144 CO 0.71 1.33 0.11 0.00 0.09 0.00 0.00 178.44 180.68 1hl5 s ALA 145 N -2.63 -1.56 0.27 1.53 0.00 -1.18 -4.15 121.76 114.04 1hl5 s ALA 145 Ca -0.07 0.99 -0.19 0.00 0.00 0.00 0.00 51.96 52.70 1hl5 s ALA 145 Cb 0.07 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.37 1hl5 s ALA 145 CO 0.85 -0.42 0.66 0.00 0.00 0.00 0.00 175.76 176.85 1hl5 s GLY 147 N -2.94 -0.49 0.17 0.00 0.00 -0.86 -1.71 107.32 101.49 1hl5 s GLY 147 Ca 0.13 0.67 -0.23 0.00 0.00 0.00 0.00 44.72 45.30 1hl5 s GLY 147 CO 0.07 0.22 0.73 0.14 0.00 0.00 0.00 173.10 174.26 1hl5 s VAL 148 N -3.42 4.48 -0.26 1.40 1.01 -1.26 -1.26 120.40 121.09 1hl5 s VAL 148 Ca 0.04 1.50 -0.26 0.00 0.00 0.00 0.00 61.98 63.27 1hl5 s VAL 148 Cb -0.01 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1hl5 s VAL 148 CO -0.09 0.43 0.89 -0.63 0.00 0.00 0.00 175.10 175.71 1hl5 s ILE 149 N -1.26 4.76 0.27 2.22 1.01 0.54 -4.56 121.20 124.18 1hl5 s ILE 149 Ca 0.37 1.60 0.10 0.00 0.00 0.00 0.00 60.65 62.72 1hl5 s ILE 149 Cb -0.21 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 1hl5 s ILE 149 CO 0.23 -0.18 -0.05 -0.83 0.00 0.00 0.00 174.94 174.12 1hl5 s GLY 150 N 1.41 1.70 0.24 6.18 0.00 0.04 -0.68 107.32 116.21 1hl5 s GLY 150 Ca 0.37 -1.70 -0.30 0.00 0.00 0.00 0.00 44.72 43.10 1hl5 s GLY 150 CO 0.09 -1.77 1.24 -0.42 0.00 0.00 0.00 173.10 172.24 1hl5 s ILE 151 N -2.35 3.25 0.26 0.90 1.01 -1.26 -0.62 121.20 122.38 1hl5 s ILE 151 Ca 0.31 1.12 0.12 0.00 0.00 0.00 0.00 60.65 62.20 1hl5 s ILE 151 Cb -0.06 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 1hl5 s ILE 151 CO 0.19 0.21 -0.21 0.00 0.00 0.00 0.00 174.94 175.13 1hl5 s ALA 152 N -0.43 2.69 -2.00 9.38 0.00 -0.51 -4.80 121.76 126.08 1hl5 s ALA 152 Ca 0.52 -1.82 0.27 0.00 0.00 0.00 0.00 51.96 50.93 1hl5 s ALA 152 Cb -0.35 -0.28 1.60 0.00 0.00 0.00 0.00 23.12 24.09 1hl5 s ALA 152 CO 0.41 0.32 1.95 0.94 0.00 0.00 0.00 175.76 179.38