#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 4.96 0.10 0.00 2.01 -1.25 -5.04 115.64 116.43 1hl5 s THR 2 Ca 0.00 0.66 0.07 0.00 0.31 0.00 0.00 61.69 62.73 1hl5 s THR 2 Cb 0.00 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 1hl5 s THR 2 CO 0.00 -0.18 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.04 1hl5 s LYS 3 N 2.55 1.05 0.19 4.92 1.02 -1.26 -1.96 119.74 126.25 1hl5 s LYS 3 Ca 0.23 -1.15 -0.03 0.00 0.02 0.00 0.00 55.97 55.04 1hl5 s LYS 3 Cb -0.15 -1.16 -0.03 0.00 -0.52 0.00 0.00 37.83 35.97 1hl5 s LYS 3 CO 0.13 0.26 0.18 0.00 -0.92 0.00 0.00 175.35 174.99 1hl5 s ALA 4 N -1.45 0.86 0.03 5.17 0.00 -0.52 -1.10 121.76 124.75 1hl5 s ALA 4 Ca 0.06 -1.51 -0.19 0.00 0.00 0.00 0.00 51.96 50.32 1hl5 s ALA 4 Cb -0.09 1.24 0.04 0.00 0.00 0.00 0.00 23.12 24.31 1hl5 s ALA 4 CO 0.04 -0.62 0.44 0.54 0.00 0.00 0.00 175.76 176.16 1hl5 s VAL 5 N -4.11 0.05 -0.10 0.00 0.11 0.44 -1.18 120.40 115.60 1hl5 s VAL 5 Ca 0.33 -0.39 -0.05 0.00 -2.93 0.00 0.00 61.98 58.94 1hl5 s VAL 5 Cb 0.06 -0.93 0.05 0.00 -1.53 0.00 0.00 36.38 34.03 1hl5 s VAL 5 CO 0.09 -0.22 0.23 0.00 -3.33 0.00 0.00 175.10 171.88 1hl5 s VAL 7 N 1.53 5.09 -0.18 0.00 1.01 -1.26 -1.10 120.40 125.49 1hl5 s VAL 7 Ca -0.07 -0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 1hl5 s VAL 7 Cb -0.11 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1hl5 s VAL 7 CO -0.08 0.10 0.46 -0.76 0.00 0.00 0.00 175.10 174.82 1hl5 s LEU 8 N 1.70 4.19 0.06 3.92 2.01 0.05 -3.94 118.68 126.68 1hl5 s LEU 8 Ca 0.06 0.66 0.00 0.00 0.01 0.00 0.00 54.13 54.86 1hl5 s LEU 8 Cb -0.17 -2.63 -0.04 0.00 0.01 0.00 0.00 46.19 43.37 1hl5 s LEU 8 CO 0.09 -0.09 -0.05 -0.54 1.01 0.00 0.00 176.35 176.78 1hl5 s LYS 9 N 1.20 0.66 0.00 1.70 1.02 -0.64 -1.68 119.74 122.00 1hl5 s LYS 9 Ca 0.23 -1.16 0.00 0.00 0.02 0.00 0.00 55.97 55.05 1hl5 s LYS 9 Cb -0.15 -0.00 0.00 0.00 -0.52 0.00 0.00 37.83 37.16 1hl5 s LYS 9 CO 0.09 -0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.88 1hl5 n GLY 10 N 0.31 3.64 0.15 -3.33 0.00 -1.23 -0.89 105.19 103.84 1hl5 n GLY 10 Ca -0.15 -1.18 0.12 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.23 1.61 3.32 -1.90 -3.47 116.42 115.74 1hl5 h ASP 11 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 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 0.01 0.00 0.61 -1.72 0.00 0.00 179.24 178.14 1hl5 n GLY 12 N 1.17 3.37 0.01 2.75 0.00 -1.26 -5.02 105.19 106.21 1hl5 n GLY 12 Ca 0.02 -1.89 0.14 0.00 0.00 0.00 0.00 46.02 44.30 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 0.23 -2.49 1.61 -0.04 -1.26 -4.85 135.00 128.20 1hl5 n PRO 13 Ca 0.00 -0.02 -0.42 0.00 -0.04 0.00 0.00 63.50 63.01 1hl5 n PRO 13 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 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 -2.78 4.29 0.06 0.52 1.01 -1.26 -4.20 120.40 118.03 1hl5 s VAL 14 Ca 0.21 1.62 -0.24 0.00 0.00 0.00 0.00 61.98 63.57 1hl5 s VAL 14 Cb 0.19 -4.04 0.06 0.00 0.00 0.00 0.00 36.38 32.59 1hl5 s VAL 14 CO 0.51 0.03 0.57 0.00 0.00 0.00 0.00 175.10 176.21 1hl5 s GLN 15 N 1.90 1.10 -0.07 2.72 -2.07 -0.96 -3.51 119.66 118.77 1hl5 s GLN 15 Ca 0.56 -0.21 -0.29 0.00 -1.82 0.00 0.00 55.36 53.59 1hl5 s GLN 15 Cb -0.25 0.51 0.09 0.00 -1.09 0.00 0.00 33.01 32.27 1hl5 s GLN 15 CO 0.23 -0.41 1.28 0.41 -1.32 0.00 0.00 175.29 175.49 1hl5 n GLY 16 N 0.29 0.14 2.98 2.60 0.00 -0.68 -0.73 105.19 109.79 1hl5 n GLY 16 Ca -0.18 -1.02 -0.22 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 -2.01 0.87 -0.12 -0.61 1.01 -0.88 -0.77 121.20 118.70 1hl5 s ILE 17 Ca 0.31 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.64 1hl5 s ILE 17 Cb -0.00 -0.82 0.01 0.00 0.01 0.00 0.00 42.46 41.66 1hl5 s ILE 17 CO -0.02 0.29 -0.19 -0.63 0.00 0.00 0.00 174.94 174.40 1hl5 s ILE 18 N 0.64 1.74 0.12 2.92 -1.09 -0.26 -2.39 121.20 122.89 1hl5 s ILE 18 Ca -0.11 -0.80 0.04 0.00 -2.23 0.00 0.00 60.65 57.54 1hl5 s ILE 18 Cb -0.14 -1.56 -0.04 0.00 -1.58 0.00 0.00 42.46 39.14 1hl5 s ILE 18 CO 0.02 0.49 0.15 0.20 -1.23 0.00 0.00 174.94 174.56 1hl5 s ASN 19 N 0.82 5.72 0.01 3.58 -0.87 0.27 -0.96 114.94 123.52 1hl5 s ASN 19 Ca -0.09 -0.01 0.03 0.00 -1.57 0.00 0.00 52.86 51.22 1hl5 s ASN 19 Cb -0.16 -1.57 -0.01 0.00 -0.02 0.00 0.00 41.25 39.49 1hl5 s ASN 19 CO -0.00 0.11 -0.09 -0.36 -2.57 0.00 0.00 177.10 174.19 1hl5 s PHE 20 N -1.61 0.83 -0.19 2.20 0.40 -0.32 -0.48 117.98 118.81 1hl5 s PHE 20 Ca 0.31 -0.26 -0.11 0.00 -0.60 0.00 0.00 56.93 56.27 1hl5 s PHE 20 Cb -0.11 -0.51 0.06 0.00 0.51 0.00 0.00 43.02 42.97 1hl5 s PHE 20 CO 0.24 -0.01 0.46 -2.00 0.70 0.00 0.00 175.22 174.61 1hl5 s GLU 21 N -0.68 0.46 -0.08 0.44 2.12 -0.63 -1.44 118.70 118.89 1hl5 s GLU 21 Ca 0.00 0.84 0.00 0.00 0.36 0.00 0.00 54.97 56.17 1hl5 s GLU 21 Cb -0.06 0.04 0.02 0.00 0.26 0.00 0.00 34.13 34.40 1hl5 s GLU 21 CO 0.00 -0.14 -0.07 -1.14 -0.54 0.00 0.00 175.26 173.37 1hl5 s GLN 22 N 1.27 1.26 0.02 4.30 0.74 -0.83 -0.31 119.66 126.11 1hl5 s GLN 22 Ca -0.08 -0.19 -0.13 0.00 0.05 0.00 0.00 55.36 55.00 1hl5 s GLN 22 Cb -0.07 -1.28 -0.34 0.00 1.10 0.00 0.00 33.01 32.42 1hl5 s GLN 22 CO -0.12 -0.17 0.95 0.87 -0.55 0.00 0.00 175.29 176.27 1hl5 h LYS 23 N 7.73 0.48 -5.78 1.67 1.57 -1.86 -3.31 116.57 117.06 1hl5 h LYS 23 Ca -0.30 -0.82 -0.52 0.00 -1.87 0.00 0.00 60.65 57.14 1hl5 h LYS 23 Cb 1.15 0.31 -0.25 0.00 0.08 0.00 0.00 32.23 33.52 1hl5 h LYS 23 CO 0.41 1.39 -0.82 -1.21 -0.57 0.00 0.00 179.45 178.65 1hl5 s GLU 24 N -2.60 1.16 0.07 3.15 2.02 -1.26 -4.88 118.70 116.35 1hl5 s GLU 24 Ca -0.10 -0.91 -0.36 0.00 0.02 0.00 0.00 54.97 53.62 1hl5 s GLU 24 Cb 0.05 -1.25 -0.16 0.00 0.10 0.00 0.00 34.13 32.87 1hl5 s GLU 24 CO 0.92 0.31 1.44 0.45 0.02 0.00 0.00 175.26 178.40 1hl5 n SER 25 N 1.73 2.07 0.00 -0.19 2.88 -1.26 0.26 113.62 119.11 1hl5 n SER 25 Ca -0.18 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.46 1hl5 n SER 25 Cb 0.54 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 1hl5 n SER 25 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1hl5 n ASN 26 N 3.05 -0.39 -4.39 -3.46 5.03 -1.26 -4.97 115.26 108.88 1hl5 n ASN 26 Ca 0.19 0.00 -0.26 0.00 0.87 0.00 0.00 54.58 55.38 1hl5 n ASN 26 Cb 0.21 -2.08 0.15 0.00 -1.02 0.00 0.00 39.78 37.04 1hl5 n ASN 26 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1hl5 s GLY 27 N -2.00 1.77 0.25 7.41 0.00 0.14 -4.95 107.32 109.95 1hl5 s GLY 27 Ca 0.00 -1.62 -0.31 0.00 0.00 0.00 0.00 44.72 42.80 1hl5 s GLY 27 CO 0.00 -0.92 1.33 -1.05 0.00 0.00 0.00 173.10 172.46 1hl5 n PRO 28 N -3.26 1.89 -3.79 2.90 -0.02 -1.26 -4.82 135.00 126.64 1hl5 n PRO 28 Ca 0.16 0.67 -0.37 0.00 -2.02 0.00 0.00 63.50 61.95 1hl5 n PRO 28 Cb 0.60 -2.28 -0.13 0.00 -0.02 0.00 0.00 33.50 31.68 1hl5 n PRO 28 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1hl5 s VAL 29 N -0.31 3.91 0.03 -1.45 1.01 0.06 -3.95 120.40 119.70 1hl5 s VAL 29 Ca 0.66 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.85 1hl5 s VAL 29 Cb -0.66 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1hl5 s VAL 29 CO 0.53 0.21 0.78 -0.54 0.00 0.00 0.00 175.10 176.07 1hl5 s LYS 30 N 1.52 4.50 -0.13 2.72 1.02 0.57 -2.20 119.74 127.74 1hl5 s LYS 30 Ca 0.04 1.08 0.01 0.00 0.02 0.00 0.00 55.97 57.12 1hl5 s LYS 30 Cb -0.16 -3.38 0.02 0.00 -0.52 0.00 0.00 37.83 33.79 1hl5 s LYS 30 CO 0.02 0.24 -0.13 0.54 -0.92 0.00 0.00 175.35 175.09 1hl5 s VAL 31 N 0.11 1.44 0.00 3.17 0.11 -0.54 -1.61 120.40 123.09 1hl5 s VAL 31 Ca 0.39 -0.57 -0.15 0.00 -2.93 0.00 0.00 61.98 58.72 1hl5 s VAL 31 Cb -0.20 -1.35 0.02 0.00 -1.53 0.00 0.00 36.38 33.32 1hl5 s VAL 31 CO 0.23 0.43 0.33 -1.66 -3.33 0.00 0.00 175.10 171.10 1hl5 s TRP 32 N 1.32 -0.19 -4.44 1.54 -2.14 0.37 -1.17 118.94 114.24 1hl5 s TRP 32 Ca 0.00 0.23 0.00 0.00 2.66 0.00 0.00 56.10 58.99 1hl5 s TRP 32 Cb -0.14 0.11 0.00 0.00 -3.10 0.00 0.00 33.47 30.35 1hl5 s TRP 32 CO -0.07 -0.44 0.00 0.41 -2.66 0.00 0.00 176.95 174.20 1hl5 n GLY 33 N 1.05 -0.51 3.11 3.67 0.00 -0.49 0.94 105.19 112.97 1hl5 n GLY 33 Ca -0.21 -0.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 1hl5 n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hl5 s SER 34 N -4.00 0.00 -0.06 1.61 1.04 -1.01 0.53 113.70 111.81 1hl5 s SER 34 Ca 0.00 -0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.31 1hl5 s SER 34 Cb 0.00 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1hl5 s SER 34 CO 0.00 -0.36 -0.17 -0.63 0.98 0.00 0.00 173.24 173.06 1hl5 s ILE 35 N -1.30 1.45 0.47 -1.02 1.01 -0.50 -2.06 121.20 119.24 1hl5 s ILE 35 Ca -0.14 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 59.88 1hl5 s ILE 35 Cb -0.07 -1.27 -0.02 0.00 0.01 0.00 0.00 42.46 41.10 1hl5 s ILE 35 CO 0.02 0.42 0.17 -1.59 0.00 0.00 0.00 174.94 173.96 1hl5 s LYS 36 N 0.34 2.20 0.00 2.79 -2.85 0.09 0.08 119.74 122.39 1hl5 s LYS 36 Ca -0.11 -2.04 0.00 0.00 -1.00 0.00 0.00 55.97 52.82 1hl5 s LYS 36 Cb -0.15 -1.87 0.00 0.00 -2.06 0.00 0.00 37.83 33.75 1hl5 s LYS 36 CO 0.04 -0.28 0.00 0.41 0.10 0.00 0.00 175.35 175.62 1hl5 n GLY 37 N -1.34 0.49 3.92 0.59 0.00 -0.92 -2.27 105.19 105.66 1hl5 n GLY 37 Ca -0.06 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 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 4.31 0.55 0.99 1.43 -0.87 -4.30 118.68 120.80 1hl5 s LEU 38 Ca 0.00 0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 53.27 1hl5 s LEU 38 Cb 0.00 -3.09 -0.05 0.00 0.03 0.00 0.00 46.19 43.08 1hl5 s LEU 38 CO 0.00 0.09 1.20 0.42 0.23 0.00 0.00 176.35 178.29 1hl5 s THR 39 N -1.64 2.77 0.42 5.49 -4.23 -1.26 -3.98 115.64 113.21 1hl5 s THR 39 Ca 0.37 0.51 -0.26 0.00 -1.18 0.00 0.00 61.69 61.13 1hl5 s THR 39 Cb -0.12 -3.22 -0.09 0.00 1.34 0.00 0.00 72.50 70.41 1hl5 s THR 39 CO 0.27 -0.07 1.39 -0.70 -0.54 0.00 0.00 174.62 174.97 1hl5 s GLU 40 N -3.15 3.85 0.00 3.99 2.12 -1.26 -4.57 118.70 119.68 1hl5 s GLU 40 Ca 0.73 2.34 0.00 0.00 0.36 0.00 0.00 54.97 58.40 1hl5 s GLU 40 Cb -0.30 -2.74 0.00 0.00 0.26 0.00 0.00 34.13 31.35 1hl5 s GLU 40 CO 0.34 -0.65 0.00 0.41 -0.54 0.00 0.00 175.26 174.81 1hl5 n GLY 41 N 0.60 -0.25 3.74 -1.50 0.00 0.37 -4.88 105.19 103.27 1hl5 n GLY 41 Ca 0.04 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 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 4.47 -0.04 0.99 1.02 -1.26 0.74 118.68 124.61 1hl5 s LEU 42 Ca 0.00 1.63 0.01 0.00 0.02 0.00 0.00 54.13 55.79 1hl5 s LEU 42 Cb 0.00 -3.42 0.02 0.00 0.02 0.00 0.00 46.19 42.81 1hl5 s LEU 42 CO 0.00 -0.03 -0.02 -1.00 0.02 0.00 0.00 176.35 175.32 1hl5 s HIS 43 N -0.01 0.55 0.53 0.29 3.76 -0.21 -3.02 115.29 117.17 1hl5 s HIS 43 Ca 0.43 -0.11 -0.22 0.00 -0.15 0.00 0.00 55.06 55.01 1hl5 s HIS 43 Cb -0.22 -0.55 -0.06 0.00 1.11 0.00 0.00 32.58 32.87 1hl5 s HIS 43 CO 0.27 -0.16 1.36 0.41 -0.85 0.00 0.00 174.74 175.76 1hl5 n GLY 44 N 4.09 0.79 2.66 -2.22 0.00 0.07 -0.93 105.19 109.64 1hl5 n GLY 44 Ca -0.26 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1hl5 n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1hl5 s PHE 45 N -1.27 -0.04 0.08 1.61 5.36 0.18 -0.82 117.98 123.08 1hl5 s PHE 45 Ca 0.70 -0.27 0.02 0.00 -0.96 0.00 0.00 56.93 56.42 1hl5 s PHE 45 Cb -0.43 -0.60 -0.04 0.00 -0.34 0.00 0.00 43.02 41.62 1hl5 s PHE 45 CO 0.51 -0.70 -0.08 -1.01 -1.46 0.00 0.00 175.22 172.48 1hl5 s HIS 46 N 2.23 0.87 -0.27 10.12 3.76 -0.67 -2.39 115.29 128.93 1hl5 s HIS 46 Ca 0.07 -0.74 -0.12 0.00 -0.15 0.00 0.00 55.06 54.11 1hl5 s HIS 46 Cb -0.16 -0.50 -0.05 0.00 1.11 0.00 0.00 32.58 32.99 1hl5 s HIS 46 CO -0.22 -0.10 0.25 0.08 -0.85 0.00 0.00 174.74 173.91 1hl5 s VAL 47 N -2.74 5.27 0.32 -0.90 1.01 0.04 -0.26 120.40 123.14 1hl5 s VAL 47 Ca 0.04 0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.36 1hl5 s VAL 47 Cb -0.01 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 1hl5 s VAL 47 CO -0.02 0.23 0.50 -1.00 0.00 0.00 0.00 175.10 174.80 1hl5 s HIS 48 N 1.80 3.46 0.10 5.22 3.76 0.73 -0.72 115.29 129.64 1hl5 s HIS 48 Ca 0.10 0.21 -0.20 0.00 -0.15 0.00 0.00 55.06 55.02 1hl5 s HIS 48 Cb -0.16 -1.82 -0.09 0.00 1.11 0.00 0.00 32.58 31.62 1hl5 s HIS 48 CO 0.10 0.19 1.70 1.49 -0.85 0.00 0.00 174.74 177.36 1hl5 h GLU 49 N 0.86 0.24 -5.56 1.40 4.81 0.31 -2.91 114.58 113.74 1hl5 h GLU 49 Ca -0.50 -0.03 -0.65 0.00 -0.13 0.00 0.00 59.36 58.05 1hl5 h GLU 49 Cb 1.23 -0.05 -0.15 0.00 0.63 0.00 0.00 28.75 30.41 1hl5 h GLU 49 CO 0.61 0.24 -0.58 -0.06 -0.73 0.00 0.00 179.01 178.49 1hl5 s PHE 50 N -5.85 3.25 -0.53 0.92 0.08 -0.08 -4.63 117.98 111.14 1hl5 s PHE 50 Ca -0.13 0.14 -0.05 0.00 0.12 0.00 0.00 56.93 57.01 1hl5 s PHE 50 Cb 0.07 -1.95 -0.04 0.00 -0.57 0.00 0.00 43.02 40.53 1hl5 s PHE 50 CO 0.69 0.32 2.99 0.41 -0.10 0.00 0.00 175.22 179.54 1hl5 n GLY 51 N 2.85 4.06 3.15 4.36 0.00 -1.00 -3.71 105.19 114.90 1hl5 n GLY 51 Ca -0.18 -1.68 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 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 0.98 4.84 -0.25 1.61 -1.08 -1.26 -4.96 116.67 116.56 1hl5 s ASP 52 Ca 0.62 -1.38 0.13 0.00 -0.52 0.00 0.00 52.55 51.40 1hl5 s ASP 52 Cb 0.32 -1.69 0.65 0.00 -1.46 0.00 0.00 42.92 40.74 1hl5 s ASP 52 CO -0.13 -0.27 1.60 -3.20 0.52 0.00 0.00 175.17 173.69 1hl5 n ASN 53 N 4.57 4.35 0.23 -0.34 5.15 -1.26 -2.94 115.26 125.02 1hl5 n ASN 53 Ca -0.12 -3.15 0.07 0.00 -0.60 0.00 0.00 54.58 50.78 1hl5 n ASN 53 Cb 0.43 -0.64 0.54 0.00 -0.53 0.00 0.00 39.78 39.58 1hl5 n ASN 53 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 1hl5 h THR 54 N 2.37 0.96 -1.58 -0.44 1.35 -1.93 -2.63 112.91 111.01 1hl5 h THR 54 Ca 0.10 -0.79 -0.58 0.00 -0.55 0.00 0.00 66.41 64.59 1hl5 h THR 54 Cb 1.83 1.45 -0.42 0.00 -1.73 0.00 0.00 68.15 69.28 1hl5 h THR 54 CO 0.44 0.21 -0.74 0.00 -0.25 0.00 0.00 175.52 175.18 1hl5 n ALA 55 N -2.41 4.97 -0.94 6.62 0.00 -1.26 -5.06 120.51 122.43 1hl5 n ALA 55 Ca -0.02 -4.33 0.00 0.00 0.00 0.00 0.00 53.44 49.09 1hl5 n ALA 55 Cb 0.29 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.17 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 -0.44 0.90 0.26 0.00 0.00 -0.99 -2.96 105.19 101.97 1hl5 n GLY 56 Ca 0.37 -0.70 0.18 0.00 0.00 0.00 0.00 46.02 45.87 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 1.08 0.00 0.00 2.02 -1.87 -2.24 112.91 111.90 1hl5 h THR 58 Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1hl5 h THR 58 Cb 0.32 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1hl5 h THR 58 CO 0.00 0.14 0.00 -1.54 0.37 0.00 0.00 175.52 174.49 1hl5 n SER 59 N -4.72 0.00 0.20 4.18 3.41 -1.20 -2.87 113.62 112.63 1hl5 n SER 59 Ca 0.06 -0.59 0.15 0.00 -0.26 0.00 0.00 58.87 58.22 1hl5 n SER 59 Cb 0.08 -0.01 0.63 0.00 -0.26 0.00 0.00 64.21 64.65 1hl5 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hl5 h ALA 60 N 3.21 1.00 -0.15 7.33 0.00 -1.28 -3.40 119.26 125.97 1hl5 h ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1hl5 h ALA 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1hl5 h ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1hl5 n GLY 61 N -0.19 -0.58 0.42 0.00 0.00 -1.14 -0.90 105.19 102.81 1hl5 n GLY 61 Ca 0.01 -1.12 -0.03 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 0.53 -2.22 1.61 -0.04 -1.26 -4.66 135.00 128.96 1hl5 n PRO 62 Ca 0.00 -0.30 -0.38 0.00 -0.04 0.00 0.00 63.50 62.78 1hl5 n PRO 62 Cb 0.00 -0.07 -0.01 0.00 -0.04 0.00 0.00 33.50 33.37 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 -0.13 2.97 0.13 0.54 3.76 -1.26 0.66 115.29 121.96 1hl5 s HIS 63 Ca 0.07 1.52 -0.31 0.00 -0.15 0.00 0.00 55.06 56.19 1hl5 s HIS 63 Cb -0.00 -3.46 -0.10 0.00 1.11 0.00 0.00 32.58 30.12 1hl5 s HIS 63 CO 0.05 -1.55 1.71 0.12 -0.85 0.00 0.00 174.74 174.22 1hl5 s PHE 64 N -1.39 2.52 -0.50 1.40 5.36 0.10 -4.39 117.98 121.08 1hl5 s PHE 64 Ca 0.58 0.26 0.06 0.00 -0.96 0.00 0.00 56.93 56.87 1hl5 s PHE 64 Cb -0.32 -4.06 0.22 0.00 -0.34 0.00 0.00 43.02 38.52 1hl5 s PHE 64 CO 0.41 -4.21 0.84 -1.71 -1.46 0.00 0.00 175.22 169.09 1hl5 n ASN 65 N 5.05 -3.07 0.30 6.13 5.15 -1.26 -1.46 115.26 126.10 1hl5 n ASN 65 Ca 0.16 -3.15 0.16 0.00 -0.60 0.00 0.00 54.58 51.15 1hl5 n ASN 65 Cb 0.38 1.79 0.94 0.00 -0.53 0.00 0.00 39.78 42.37 1hl5 n ASN 65 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1hl5 h PRO 66 N 4.32 0.00 -0.63 1.20 0.11 -1.92 -2.69 132.00 132.38 1hl5 h PRO 66 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1hl5 h PRO 66 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1hl5 h PRO 66 CO 0.22 0.02 0.00 1.28 -0.21 0.00 0.00 178.00 179.30 1hl5 n LEU 67 N -3.69 3.65 -4.02 2.35 4.77 -1.26 -4.96 117.00 113.85 1hl5 n LEU 67 Ca -0.03 -1.83 -0.29 0.00 -0.03 0.00 0.00 56.01 53.83 1hl5 n LEU 67 Cb 0.10 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.70 1hl5 n LEU 67 CO 0.26 0.79 -0.27 -1.20 -1.33 0.00 0.00 177.39 175.65 1hl5 n SER 68 N 1.20 -0.86 -4.95 -1.43 7.64 -1.02 -4.95 113.62 109.25 1hl5 n SER 68 Ca 0.21 -1.10 -0.20 0.00 1.01 0.00 0.00 58.87 58.80 1hl5 n SER 68 Cb 0.62 -2.63 0.00 0.00 -1.01 0.00 0.00 64.21 61.19 1hl5 n SER 68 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hl5 s ARG 69 N -6.76 2.55 0.49 1.43 0.52 -1.26 -5.12 118.95 110.80 1hl5 s ARG 69 Ca 0.09 -1.52 -0.05 0.00 -0.52 0.00 0.00 55.73 53.73 1hl5 s ARG 69 Cb -0.04 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.88 1hl5 s ARG 69 CO 0.92 -0.40 0.80 0.15 0.02 0.00 0.00 175.30 176.78 1hl5 s LYS 70 N -4.33 3.46 0.44 3.54 -0.14 -1.26 -4.71 119.74 116.75 1hl5 s LYS 70 Ca 0.51 0.16 -0.24 0.00 -1.36 0.00 0.00 55.97 55.05 1hl5 s LYS 70 Cb -0.06 -2.37 -0.08 0.00 -1.68 0.00 0.00 37.83 33.65 1hl5 s LYS 70 CO 0.31 -0.27 1.21 -1.58 -0.76 0.00 0.00 175.35 174.26 1hl5 s HIS 71 N -2.77 2.85 0.13 3.18 5.65 0.42 -3.18 115.29 121.57 1hl5 s HIS 71 Ca 0.48 1.50 -0.01 0.00 0.25 0.00 0.00 55.06 57.28 1hl5 s HIS 71 Cb -0.10 -3.48 0.01 0.00 -1.18 0.00 0.00 32.58 27.82 1hl5 s HIS 71 CO 0.45 -1.72 0.19 0.41 -0.65 0.00 0.00 174.74 173.42 1hl5 n GLY 72 N 0.57 2.62 3.93 1.59 0.00 -1.25 -4.39 105.19 108.25 1hl5 n GLY 72 Ca 0.06 -1.41 -0.26 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.76 1.62 0.29 -0.02 0.00 -1.03 -4.61 107.32 101.81 1hl5 s GLY 73 Ca 0.10 -0.81 -0.00 0.00 0.00 0.00 0.00 44.72 44.00 1hl5 s GLY 73 CO 0.07 -0.53 1.90 -2.55 0.00 0.00 0.00 173.10 171.99 1hl5 h PRO 74 N -0.13 1.04 0.00 2.90 0.11 -1.88 -1.88 132.00 132.16 1hl5 h PRO 74 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1hl5 h PRO 74 Cb 1.27 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1hl5 h PRO 74 CO 0.60 0.69 0.00 1.63 -0.21 0.00 0.00 178.00 180.70 1hl5 n LYS 75 N -4.49 0.05 -2.58 1.05 5.02 -1.26 -4.85 118.16 111.10 1hl5 n LYS 75 Ca 0.14 0.08 -0.40 0.00 -2.02 0.00 0.00 58.31 56.11 1hl5 n LYS 75 Cb 0.19 -1.56 -0.05 0.00 -0.02 0.00 0.00 35.03 33.59 1hl5 n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1hl5 s ASP 76 N -3.31 7.39 0.14 4.39 1.01 -0.71 -4.93 116.67 120.66 1hl5 s ASP 76 Ca 0.12 2.15 -0.17 0.00 0.71 0.00 0.00 52.55 55.36 1hl5 s ASP 76 Cb 0.16 -2.62 0.03 0.00 1.01 0.00 0.00 42.92 41.50 1hl5 s ASP 76 CO 0.51 -0.04 1.74 -0.08 0.21 0.00 0.00 175.17 177.51 1hl5 h GLU 77 N 3.90 0.20 -6.61 8.23 4.22 -1.88 -3.36 114.58 119.27 1hl5 h GLU 77 Ca -0.46 -0.01 -0.57 0.00 0.08 0.00 0.00 59.36 58.40 1hl5 h GLU 77 Cb 1.21 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.34 1hl5 h GLU 77 CO 0.67 0.13 0.88 -2.00 -2.18 0.00 0.00 179.01 176.51 1hl5 s GLU 78 N -6.17 3.74 -0.07 1.92 2.56 -1.26 -4.97 118.70 114.46 1hl5 s GLU 78 Ca -0.13 0.58 -0.29 0.00 0.00 0.00 0.00 54.97 55.13 1hl5 s GLU 78 Cb 0.11 -3.89 0.10 0.00 2.00 0.00 0.00 34.13 32.46 1hl5 s GLU 78 CO 0.70 -1.31 0.87 -0.98 -0.56 0.00 0.00 175.26 173.98 1hl5 s ARG 79 N 4.29 0.81 0.63 4.30 1.70 -1.22 -3.96 118.95 125.50 1hl5 s ARG 79 Ca 0.47 -0.02 -0.15 0.00 -0.47 0.00 0.00 55.73 55.56 1hl5 s ARG 79 Cb -0.08 0.38 -0.01 0.00 -0.57 0.00 0.00 34.95 34.66 1hl5 s ARG 79 CO 0.29 -0.30 1.08 -1.01 -1.08 0.00 0.00 175.30 174.29 1hl5 s HIS 80 N -1.95 2.80 0.38 5.89 3.76 -1.19 -4.76 115.29 120.23 1hl5 s HIS 80 Ca -0.01 1.53 0.06 0.00 -0.15 0.00 0.00 55.06 56.48 1hl5 s HIS 80 Cb -0.01 -3.08 0.76 0.00 1.11 0.00 0.00 32.58 31.36 1hl5 s HIS 80 CO -0.01 -1.42 1.99 0.28 -0.85 0.00 0.00 174.74 174.73 1hl5 h VAL 81 N 0.15 1.14 -0.08 -0.90 2.07 -1.79 -2.56 116.25 114.29 1hl5 h VAL 81 Ca -0.47 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1hl5 h VAL 81 Cb 1.23 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1hl5 h VAL 81 CO 0.56 0.16 0.00 0.61 0.02 0.00 0.00 177.57 178.92 1hl5 n GLY 82 N -1.26 -0.54 3.55 2.17 0.00 -0.54 -4.28 105.19 104.29 1hl5 n GLY 82 Ca 0.03 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.26 6.21 -0.12 1.61 1.01 -0.97 -0.78 116.67 122.37 1hl5 s ASP 83 Ca 0.17 -0.59 0.16 0.00 0.71 0.00 0.00 52.55 53.00 1hl5 s ASP 83 Cb 0.09 -2.56 0.58 0.00 1.01 0.00 0.00 42.92 42.03 1hl5 s ASP 83 CO 0.13 -1.79 1.49 0.18 0.21 0.00 0.00 175.17 175.39 1hl5 n LEU 84 N 9.30 4.17 0.00 1.23 4.77 -1.01 -3.70 117.00 131.77 1hl5 n LEU 84 Ca 0.07 -2.59 0.00 0.00 -0.03 0.00 0.00 56.01 53.46 1hl5 n LEU 84 Cb 0.49 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1hl5 n LEU 84 CO 0.70 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 178.10 1hl5 n GLY 85 N 0.39 2.28 3.32 -0.72 0.00 -1.21 -4.77 105.19 104.48 1hl5 n GLY 85 Ca 0.21 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 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 2.75 0.25 1.61 0.01 -1.26 -0.65 114.94 113.65 1hl5 s ASN 86 Ca 0.00 -0.74 0.09 0.00 -0.71 0.00 0.00 52.86 51.50 1hl5 s ASN 86 Cb 0.00 -0.16 -0.04 0.00 0.41 0.00 0.00 41.25 41.46 1hl5 s ASN 86 CO 0.00 0.07 0.03 0.68 -1.51 0.00 0.00 177.10 176.36 1hl5 s VAL 87 N -1.31 3.63 -0.19 1.60 -7.23 -0.11 -4.91 120.40 111.89 1hl5 s VAL 87 Ca 0.10 -1.77 -0.01 0.00 -1.81 0.00 0.00 61.98 58.49 1hl5 s VAL 87 Cb -0.09 -2.93 0.01 0.00 0.56 0.00 0.00 36.38 33.92 1hl5 s VAL 87 CO 0.05 -0.34 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.48 1hl5 s THR 88 N -2.21 2.66 0.08 5.32 2.01 -1.26 -1.04 115.64 121.19 1hl5 s THR 88 Ca 0.31 -0.74 -0.20 0.00 0.31 0.00 0.00 61.69 61.37 1hl5 s THR 88 Cb -0.07 -2.16 -0.07 0.00 0.01 0.00 0.00 72.50 70.21 1hl5 s THR 88 CO 0.20 0.49 0.59 0.00 -0.69 0.00 0.00 174.62 175.22 1hl5 s ALA 89 N 1.28 3.57 0.84 7.40 0.00 0.23 -4.12 121.76 130.96 1hl5 s ALA 89 Ca 0.04 0.07 -0.03 0.00 0.00 0.00 0.00 51.96 52.04 1hl5 s ALA 89 Cb -0.14 -2.68 0.06 0.00 0.00 0.00 0.00 23.12 20.36 1hl5 s ALA 89 CO -0.07 0.38 0.34 -0.40 0.00 0.00 0.00 175.76 176.01 1hl5 n ASP 90 N 1.74 0.14 0.28 0.00 5.68 0.15 -0.48 116.55 124.05 1hl5 n ASP 90 Ca -0.10 -1.19 0.17 0.00 -0.50 0.00 0.00 54.79 53.17 1hl5 n ASP 90 Cb 0.50 -0.25 0.77 0.00 -1.14 0.00 0.00 41.12 41.00 1hl5 n ASP 90 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1hl5 h LYS 91 N 0.00 0.00 -0.18 0.11 1.57 -1.96 -0.93 116.57 115.17 1hl5 h LYS 91 Ca -0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1hl5 h LYS 91 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1hl5 h LYS 91 CO 0.09 0.05 0.00 -0.25 -0.57 0.00 0.00 179.45 178.77 1hl5 n ASP 92 N -3.21 1.80 0.00 0.86 8.00 -1.26 -4.89 116.55 117.85 1hl5 n ASP 92 Ca -0.01 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.76 1hl5 n ASP 92 Cb 0.27 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 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 1.16 0.63 3.68 0.44 0.00 -0.35 -4.71 105.19 106.03 1hl5 n GLY 93 Ca 0.16 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 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 5.01 -0.28 1.61 1.01 -1.26 -2.04 120.40 122.45 1hl5 s VAL 94 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 1hl5 s VAL 94 Cb 0.00 -3.26 0.03 0.00 0.00 0.00 0.00 36.38 33.15 1hl5 s VAL 94 CO 0.00 0.47 0.02 0.00 0.00 0.00 0.00 175.10 175.58 1hl5 s ALA 95 N 0.26 2.88 -0.29 5.51 0.00 0.11 0.31 121.76 130.54 1hl5 s ALA 95 Ca 0.05 -1.55 -0.20 0.00 0.00 0.00 0.00 51.96 50.26 1hl5 s ALA 95 Cb -0.12 -1.96 -0.01 0.00 0.00 0.00 0.00 23.12 21.03 1hl5 s ALA 95 CO -0.00 -1.00 0.64 -0.51 0.00 0.00 0.00 175.76 174.89 1hl5 s ASP 96 N 1.38 6.53 -0.20 0.00 -0.00 -1.26 -1.41 116.67 121.72 1hl5 s ASP 96 Ca -0.00 0.54 -0.12 0.00 -0.00 0.00 0.00 52.55 52.97 1hl5 s ASP 96 Cb -0.18 -2.34 -0.05 0.00 -0.00 0.00 0.00 42.92 40.36 1hl5 s ASP 96 CO -0.01 -0.45 0.22 -0.69 -0.00 0.00 0.00 175.17 174.24 1hl5 s VAL 97 N 2.59 5.34 -0.31 -1.27 1.01 0.19 -4.79 120.40 123.16 1hl5 s VAL 97 Ca 0.26 0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.62 1hl5 s VAL 97 Cb -0.15 -3.55 0.16 0.00 0.00 0.00 0.00 36.38 32.84 1hl5 s VAL 97 CO 0.11 0.38 0.42 -0.55 0.00 0.00 0.00 175.10 175.46 1hl5 s SER 98 N 0.63 0.40 0.17 3.32 0.15 -1.25 -1.39 113.70 115.72 1hl5 s SER 98 Ca 0.12 -0.63 0.08 0.00 0.70 0.00 0.00 55.95 56.22 1hl5 s SER 98 Cb -0.13 1.06 -0.04 0.00 -1.71 0.00 0.00 66.02 65.21 1hl5 s SER 98 CO 0.02 -0.33 -0.17 -0.63 1.20 0.00 0.00 173.24 173.33 1hl5 s ILE 99 N 2.30 1.78 -0.04 6.45 1.01 -0.32 -5.01 121.20 127.37 1hl5 s ILE 99 Ca 0.11 -1.95 0.02 0.00 0.00 0.00 0.00 60.65 58.84 1hl5 s ILE 99 Cb -0.12 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.51 1hl5 s ILE 99 CO -0.24 -0.36 -0.10 -0.70 0.00 0.00 0.00 174.94 173.54 1hl5 s GLU 100 N -2.91 1.24 -0.10 2.79 2.12 -1.26 -1.46 118.70 119.11 1hl5 s GLU 100 Ca 0.16 -0.32 -0.06 0.00 0.36 0.00 0.00 54.97 55.12 1hl5 s GLU 100 Cb -0.05 -1.10 0.04 0.00 0.26 0.00 0.00 34.13 33.28 1hl5 s GLU 100 CO 0.06 0.05 0.24 0.34 -0.54 0.00 0.00 175.26 175.42 1hl5 s ASP 101 N 0.50 -0.26 -0.03 -1.70 2.15 -0.94 -5.01 116.67 111.39 1hl5 s ASP 101 Ca -0.09 0.52 0.15 0.00 0.43 0.00 0.00 52.55 53.55 1hl5 s ASP 101 Cb -0.13 0.42 0.44 0.00 -0.30 0.00 0.00 42.92 43.35 1hl5 s ASP 101 CO 0.02 -0.15 1.37 -1.20 -0.17 0.00 0.00 175.17 175.03 1hl5 n SER 102 N 4.06 3.44 -0.12 -0.34 7.64 -1.26 -0.76 113.62 126.27 1hl5 n SER 102 Ca -0.24 -2.16 -0.20 0.00 1.01 0.00 0.00 58.87 57.28 1hl5 n SER 102 Cb 0.54 -0.35 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 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 0.69 1.51 -1.06 0.44 0.31 -1.26 -4.87 118.33 114.08 1hl5 n VAL 103 Ca 0.17 -0.15 -0.32 0.00 -0.01 0.00 0.00 64.34 64.02 1hl5 n VAL 103 Cb 0.57 -2.08 0.13 0.00 -0.91 0.00 0.00 33.84 31.54 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 -2.68 2.29 0.18 2.52 -4.36 -1.26 -4.81 121.20 113.08 1hl5 s ILE 104 Ca -0.34 0.11 -0.09 0.00 -0.26 0.00 0.00 60.65 60.07 1hl5 s ILE 104 Cb 0.10 -2.42 -0.01 0.00 1.25 0.00 0.00 42.46 41.38 1hl5 s ILE 104 CO 0.46 -0.10 0.31 -0.55 0.24 0.00 0.00 174.94 175.30 1hl5 s SER 105 N -2.47 0.02 -0.12 4.36 0.15 -0.45 -4.60 113.70 110.58 1hl5 s SER 105 Ca 0.69 -0.91 0.16 0.00 0.70 0.00 0.00 55.95 56.59 1hl5 s SER 105 Cb -0.25 0.46 0.58 0.00 -1.71 0.00 0.00 66.02 65.10 1hl5 s SER 105 CO 0.52 -0.93 1.50 0.18 1.20 0.00 0.00 173.24 175.71 1hl5 n LEU 106 N -0.25 4.20 -3.75 3.45 4.77 -1.26 -1.73 117.00 122.43 1hl5 n LEU 106 Ca -0.06 -2.58 -0.06 0.00 -0.03 0.00 0.00 56.01 53.28 1hl5 n LEU 106 Cb 0.63 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 1hl5 n LEU 106 CO 0.24 0.74 0.58 -0.94 -1.33 0.00 0.00 177.39 176.68 1hl5 s SER 107 N -1.24 -0.26 0.52 -1.43 1.04 -1.26 -4.86 113.70 106.20 1hl5 s SER 107 Ca 0.43 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.44 1hl5 s SER 107 Cb 0.30 0.59 0.00 0.00 0.10 0.00 0.00 66.02 67.01 1hl5 s SER 107 CO 0.17 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.93 1hl5 n GLY 108 N -0.44 -0.45 0.37 7.32 0.00 -1.26 -3.51 105.19 107.21 1hl5 n GLY 108 Ca -0.06 -1.09 0.19 0.00 0.00 0.00 0.00 46.02 45.06 1hl5 n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1hl5 h ASP 109 N 0.00 0.00 -0.61 1.61 3.45 -2.00 -2.14 116.42 116.74 1hl5 h ASP 109 Ca 0.00 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.24 1hl5 h ASP 109 Cb 0.00 0.00 -0.13 0.00 -0.56 0.00 0.00 39.33 38.64 1hl5 h ASP 109 CO 0.00 0.00 0.21 1.41 -1.57 0.00 0.00 179.24 179.29 1hl5 n HIS 110 N -4.13 1.97 -1.93 4.55 8.25 -1.25 -4.95 115.22 117.72 1hl5 n HIS 110 Ca 0.07 -1.36 -0.42 0.00 -0.26 0.00 0.00 57.72 55.76 1hl5 n HIS 110 Cb 0.54 -0.62 -0.03 0.00 1.12 0.00 0.00 29.99 31.00 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 3.76 0.25 -1.87 0.00 -5.35 -0.71 -4.91 119.36 110.53 1hl5 n ILE 112 Ca 0.13 -0.63 -0.41 0.00 -0.27 0.00 0.00 62.75 61.57 1hl5 n ILE 112 Cb 0.39 1.11 -0.01 0.00 -1.74 0.00 0.00 39.64 39.38 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 -1.20 2.25 0.00 7.28 -1.09 -1.26 -1.68 121.20 125.50 1hl5 s ILE 113 Ca 0.21 0.22 0.00 0.00 -2.23 0.00 0.00 60.65 58.85 1hl5 s ILE 113 Cb 0.14 -3.14 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 1hl5 s ILE 113 CO 0.20 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 174.56 1hl5 n GLY 114 N 1.49 0.89 2.66 6.18 0.00 0.10 -5.00 105.19 111.52 1hl5 n GLY 114 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.02 0.78 -4.52 1.61 1.74 -0.67 -2.38 116.66 111.19 1hl5 n ARG 115 Ca 0.00 -2.19 -0.33 0.00 -0.77 0.00 0.00 57.85 54.55 1hl5 n ARG 115 Cb 0.00 -0.06 -0.14 0.00 -1.02 0.00 0.00 32.46 31.24 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 -1.56 3.16 0.03 0.55 2.01 -1.10 -0.03 115.64 118.69 1hl5 s THR 116 Ca 0.37 -0.61 -0.20 0.00 0.31 0.00 0.00 61.69 61.56 1hl5 s THR 116 Cb -0.03 -2.36 -0.06 0.00 0.01 0.00 0.00 72.50 70.06 1hl5 s THR 116 CO 0.23 0.50 0.57 -0.22 -0.69 0.00 0.00 174.62 175.01 1hl5 s LEU 117 N 0.64 4.47 -0.03 4.42 2.96 -0.43 -0.19 118.68 130.52 1hl5 s LEU 117 Ca -0.06 1.19 0.02 0.00 -0.22 0.00 0.00 54.13 55.06 1hl5 s LEU 117 Cb -0.15 -2.88 0.01 0.00 0.50 0.00 0.00 46.19 43.66 1hl5 s LEU 117 CO 0.03 0.20 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.49 1hl5 s VAL 118 N -0.66 0.67 -0.11 1.68 1.01 0.64 -2.23 120.40 121.40 1hl5 s VAL 118 Ca 0.29 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1hl5 s VAL 118 Cb -0.19 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.55 1hl5 s VAL 118 CO 0.18 0.22 -0.08 0.54 0.00 0.00 0.00 175.10 175.96 1hl5 s VAL 119 N 0.33 3.53 0.44 2.92 0.11 -0.79 -1.67 120.40 125.26 1hl5 s VAL 119 Ca -0.05 -0.51 0.08 0.00 -2.93 0.00 0.00 61.98 58.57 1hl5 s VAL 119 Cb -0.09 -2.48 -0.01 0.00 -1.53 0.00 0.00 36.38 32.27 1hl5 s VAL 119 CO 0.00 0.54 0.42 -1.00 -3.33 0.00 0.00 175.10 171.74 1hl5 s HIS 120 N -0.10 2.51 0.04 1.54 3.76 0.00 -1.22 115.29 121.82 1hl5 s HIS 120 Ca 0.00 -0.54 -0.19 0.00 -0.15 0.00 0.00 55.06 54.18 1hl5 s HIS 120 Cb -0.13 -2.16 -0.15 0.00 1.11 0.00 0.00 32.58 31.25 1hl5 s HIS 120 CO 0.03 -0.25 1.30 1.49 -0.85 0.00 0.00 174.74 176.47 1hl5 h GLU 121 N 0.92 0.43 -5.47 1.40 4.81 -0.71 -3.38 114.58 112.59 1hl5 h GLU 121 Ca -0.40 -0.26 -0.64 0.00 -0.13 0.00 0.00 59.36 57.92 1hl5 h GLU 121 Cb 1.27 0.03 -0.10 0.00 0.63 0.00 0.00 28.75 30.58 1hl5 h GLU 121 CO 0.56 0.86 -0.46 0.15 -0.73 0.00 0.00 179.01 179.39 1hl5 s LYS 122 N -4.07 2.20 0.45 1.92 1.02 0.42 -4.90 119.74 116.78 1hl5 s LYS 122 Ca -0.14 -2.25 -0.23 0.00 0.02 0.00 0.00 55.97 53.37 1hl5 s LYS 122 Cb 0.05 -1.72 -0.07 0.00 -0.52 0.00 0.00 37.83 35.57 1hl5 s LYS 122 CO 0.78 -0.40 1.17 0.00 -0.92 0.00 0.00 175.35 175.98 1hl5 s ALA 123 N -2.82 3.00 -0.10 5.17 0.00 -1.17 -0.75 121.76 125.08 1hl5 s ALA 123 Ca 0.17 0.95 -0.23 0.00 0.00 0.00 0.00 51.96 52.85 1hl5 s ALA 123 Cb 0.01 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 1hl5 s ALA 123 CO 0.10 -0.65 0.70 0.34 0.00 0.00 0.00 175.76 176.24 1hl5 s ASP 124 N -1.32 6.93 0.00 0.00 -1.08 -1.26 -3.94 116.67 116.00 1hl5 s ASP 124 Ca 0.63 1.12 0.05 0.00 -0.52 0.00 0.00 52.55 53.83 1hl5 s ASP 124 Cb -0.29 -2.40 0.30 0.00 -1.46 0.00 0.00 42.92 39.07 1hl5 s ASP 124 CO 0.35 -0.17 1.20 -0.90 0.52 0.00 0.00 175.17 176.17 1hl5 n ASP 125 N 4.15 0.05 -0.81 -0.34 5.68 0.09 -4.87 116.55 120.50 1hl5 n ASP 125 Ca -0.01 -1.85 -0.11 0.00 -0.50 0.00 0.00 54.79 52.33 1hl5 n ASP 125 Cb 0.51 -0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 40.44 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 -0.55 -0.66 -0.33 -2.12 4.77 -1.26 -2.44 117.00 114.40 1hl5 n LEU 126 Ca 0.04 0.26 -0.04 0.00 -0.03 0.00 0.00 56.01 56.24 1hl5 n LEU 126 Cb 0.02 -1.90 -0.01 0.00 -2.33 0.00 0.00 43.42 39.21 1hl5 n LEU 126 CO 0.03 -0.65 -0.04 0.61 -1.33 0.00 0.00 177.39 176.01 1hl5 n GLY 127 N -1.28 0.49 0.93 -0.72 0.00 -1.25 -2.46 105.19 100.90 1hl5 n GLY 127 Ca -0.11 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.31 0.92 -0.18 1.61 5.02 -1.02 -4.75 118.16 117.45 1hl5 n LYS 128 Ca -0.04 -2.72 0.11 0.00 -2.02 0.00 0.00 58.31 53.64 1hl5 n LYS 128 Cb 0.28 -0.96 0.27 0.00 -0.02 0.00 0.00 35.03 34.60 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 -0.47 1.24 5.03 0.72 0.00 -1.26 -5.02 105.19 105.43 1hl5 n GLY 129 Ca 0.13 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 1.36 1.62 0.00 -0.02 0.00 -1.26 -4.99 105.19 101.89 1hl5 n GLY 130 Ca 0.18 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1hl5 n GLY 130 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1hl5 n ASN 131 N 6.90 0.00 -0.14 1.61 6.94 -1.26 -4.46 115.26 124.85 1hl5 n ASN 131 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 54.58 54.47 1hl5 n ASN 131 Cb 0.00 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.41 1hl5 n ASN 131 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1hl5 h GLU 132 N 0.00 0.60 -1.00 -3.83 4.81 -2.02 -2.61 114.58 110.53 1hl5 h GLU 132 Ca 0.00 -0.10 0.21 0.00 -0.13 0.00 0.00 59.36 59.34 1hl5 h GLU 132 Cb 0.00 -0.10 -0.11 0.00 0.63 0.00 0.00 28.75 29.17 1hl5 h GLU 132 CO 0.00 0.54 0.61 1.49 -0.73 0.00 0.00 179.01 180.92 1hl5 h GLU 133 N 0.51 0.69 -0.39 1.92 4.57 -2.01 -0.20 114.58 119.68 1hl5 h GLU 133 Ca 0.14 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 58.32 1hl5 h GLU 133 Cb 0.16 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1hl5 h GLU 133 CO -0.01 0.45 0.26 1.03 -1.18 0.00 0.00 179.01 179.56 1hl5 h SER 134 N 0.71 0.29 0.95 1.04 0.87 -1.68 0.48 113.55 116.20 1hl5 h SER 134 Ca 0.59 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.15 1hl5 h SER 134 Cb 1.00 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1hl5 h SER 134 CO -0.40 0.20 0.00 0.35 -0.53 0.00 0.00 176.83 176.45 1hl5 n THR 135 N -4.48 0.44 -0.07 2.23 -2.24 -0.09 -2.64 114.28 107.44 1hl5 n THR 135 Ca 0.04 0.03 -0.13 0.00 -2.27 0.00 0.00 64.05 61.72 1hl5 n THR 135 Cb 0.21 -0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 67.69 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 -1.73 0.29 0.00 -0.78 5.02 -0.41 0.16 118.16 120.71 1hl5 n LYS 136 Ca 0.05 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1hl5 n LYS 136 Cb 0.31 -1.03 0.00 0.00 -0.02 0.00 0.00 35.03 34.29 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 -3.44 0.00 -1.00 -0.18 -2.24 0.02 -4.67 114.28 102.77 1hl5 n THR 137 Ca -0.25 -0.11 -0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1hl5 n THR 137 Cb 0.70 0.60 -0.00 0.00 -2.10 0.00 0.00 70.33 69.52 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 2.00 0.45 3.17 3.38 0.00 -1.08 -3.75 105.19 109.35 1hl5 n GLY 138 Ca 0.00 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.22 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 1.04 -4.48 0.00 1.61 3.02 -1.26 -0.73 115.26 114.47 1hl5 n ASN 139 Ca -0.00 -0.30 0.13 0.00 -0.03 0.00 0.00 54.58 54.38 1hl5 n ASN 139 Cb 0.01 -3.68 0.75 0.00 -0.61 0.00 0.00 39.78 36.25 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 -3.41 2.43 -0.72 5.41 0.00 -1.25 -4.74 120.51 118.24 1hl5 n ALA 140 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1hl5 n ALA 140 Cb 0.57 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 0.75 0.55 3.39 0.00 0.00 -1.26 -0.44 105.19 108.19 1hl5 n GLY 141 Ca 0.17 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 1hl5 n GLY 141 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1hl5 n SER 142 N -1.93 -2.07 -4.39 1.61 7.64 -1.26 -4.54 113.62 108.68 1hl5 n SER 142 Ca 0.00 0.47 -0.44 0.00 1.01 0.00 0.00 58.87 59.91 1hl5 n SER 142 Cb 0.00 -1.15 -0.06 0.00 -1.01 0.00 0.00 64.21 61.98 1hl5 n SER 142 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hl5 s ARG 143 N -2.88 3.03 0.09 1.43 0.52 -1.26 -0.72 118.95 119.17 1hl5 s ARG 143 Ca 0.60 -1.26 -0.09 0.00 -0.52 0.00 0.00 55.73 54.47 1hl5 s ARG 143 Cb -0.30 -4.16 -0.20 0.00 0.52 0.00 0.00 34.95 30.81 1hl5 s ARG 143 CO 0.64 -1.20 1.20 -0.07 0.02 0.00 0.00 175.30 175.89 1hl5 h LEU 144 N 9.23 0.67 -7.30 2.53 3.38 -1.46 -3.47 115.31 118.89 1hl5 h LEU 144 Ca -0.28 -0.59 -0.06 0.00 0.09 0.00 0.00 57.88 57.03 1hl5 h LEU 144 Cb 1.10 -0.21 -0.15 0.00 0.09 0.00 0.00 40.66 41.49 1hl5 h LEU 144 CO 0.96 1.41 -0.03 0.00 0.09 0.00 0.00 178.44 180.86 1hl5 s ALA 145 N -3.08 -1.13 0.26 1.53 0.00 -1.16 -4.05 121.76 114.12 1hl5 s ALA 145 Ca -0.07 0.33 -0.21 0.00 0.00 0.00 0.00 51.96 52.01 1hl5 s ALA 145 Cb 0.07 0.47 0.03 0.00 0.00 0.00 0.00 23.12 23.69 1hl5 s ALA 145 CO 0.90 -0.53 0.69 0.00 0.00 0.00 0.00 175.76 176.81 1hl5 s GLY 147 N -2.89 -0.52 0.15 0.00 0.00 -0.95 -1.62 107.32 101.49 1hl5 s GLY 147 Ca 0.09 0.79 -0.25 0.00 0.00 0.00 0.00 44.72 45.35 1hl5 s GLY 147 CO 0.03 0.26 0.77 0.14 0.00 0.00 0.00 173.10 174.31 1hl5 s VAL 148 N -3.38 4.41 -0.29 1.40 1.01 -1.26 -1.32 120.40 120.97 1hl5 s VAL 148 Ca 0.03 1.69 -0.29 0.00 0.00 0.00 0.00 61.98 63.42 1hl5 s VAL 148 Cb -0.01 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.25 1hl5 s VAL 148 CO -0.10 0.51 1.09 -0.63 0.00 0.00 0.00 175.10 175.96 1hl5 s ILE 149 N -1.03 4.52 0.26 2.22 1.01 0.96 -4.51 121.20 124.63 1hl5 s ILE 149 Ca 0.36 1.78 0.09 0.00 0.00 0.00 0.00 60.65 62.89 1hl5 s ILE 149 Cb -0.23 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 37.84 1hl5 s ILE 149 CO 0.26 -0.39 -0.01 -0.83 0.00 0.00 0.00 174.94 173.98 1hl5 s GLY 150 N 1.61 1.66 0.18 6.18 0.00 0.22 -0.72 107.32 116.44 1hl5 s GLY 150 Ca 0.46 -1.64 -0.30 0.00 0.00 0.00 0.00 44.72 43.24 1hl5 s GLY 150 CO 0.13 -1.70 1.21 -0.42 0.00 0.00 0.00 173.10 172.32 1hl5 s ILE 151 N -2.28 3.57 0.26 0.90 1.01 -1.26 -0.42 121.20 122.97 1hl5 s ILE 151 Ca 0.31 1.30 0.12 0.00 0.00 0.00 0.00 60.65 62.38 1hl5 s ILE 151 Cb -0.07 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 1hl5 s ILE 151 CO 0.20 0.20 -0.20 0.00 0.00 0.00 0.00 174.94 175.14 1hl5 s ALA 152 N 0.02 2.65 -2.00 9.38 0.00 -0.26 -4.77 121.76 126.78 1hl5 s ALA 152 Ca 0.53 -1.82 0.13 0.00 0.00 0.00 0.00 51.96 50.81 1hl5 s ALA 152 Cb -0.33 -0.26 0.79 0.00 0.00 0.00 0.00 23.12 23.33 1hl5 s ALA 152 CO 0.36 0.29 1.22 0.94 0.00 0.00 0.00 175.76 178.57