#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hl5 s ALA 4 N nan 0.87 -0.00 0.00 0.00 -0.21 -1.43 121.76 nan 1hl5 s ALA 4 Ca nan -1.51 -0.19 0.00 0.00 0.00 0.00 51.96 nan 1hl5 s ALA 4 Cb nan 1.24 0.03 0.00 0.00 0.00 0.00 23.12 nan 1hl5 s ALA 4 CO nan -0.61 0.40 0.54 0.00 0.00 0.00 175.76 nan 1hl5 s VAL 5 N -4.11 0.05 -0.05 0.00 0.11 0.02 0.09 120.40 116.50 1hl5 s VAL 5 Ca 0.33 -0.40 -0.02 0.00 -2.93 0.00 0.00 61.98 58.96 1hl5 s VAL 5 Cb 0.06 -0.80 0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1hl5 s VAL 5 CO 0.09 -0.22 0.12 0.00 -3.33 0.00 0.00 175.10 171.76 1hl5 s VAL 7 N 0.95 4.66 -0.11 0.00 1.01 -1.26 -0.85 120.40 124.79 1hl5 s VAL 7 Ca -0.07 -0.34 -0.18 0.00 0.00 0.00 0.00 61.98 61.39 1hl5 s VAL 7 Cb -0.10 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1hl5 s VAL 7 CO -0.04 0.11 0.47 -0.76 0.00 0.00 0.00 175.10 174.87 1hl5 s LEU 8 N 1.63 4.28 0.07 3.92 1.02 0.00 -3.96 118.68 125.64 1hl5 s LEU 8 Ca 0.05 0.81 -0.08 0.00 0.02 0.00 0.00 54.13 54.94 1hl5 s LEU 8 Cb -0.17 -2.68 -0.01 0.00 0.02 0.00 0.00 46.19 43.35 1hl5 s LEU 8 CO 0.07 0.02 0.16 -0.54 0.02 0.00 0.00 176.35 176.07 1hl5 s LYS 9 N 0.55 0.76 0.00 1.70 1.02 -0.21 -1.70 119.74 121.86 1hl5 s LYS 9 Ca 0.26 -0.89 0.00 0.00 0.02 0.00 0.00 55.97 55.36 1hl5 s LYS 9 Cb -0.15 0.31 0.00 0.00 -0.52 0.00 0.00 37.83 37.46 1hl5 s LYS 9 CO 0.10 -0.22 0.00 0.41 -0.92 0.00 0.00 175.35 174.72 1hl5 n GLY 10 N 0.21 4.43 0.14 -3.33 0.00 -1.25 -1.05 105.19 104.35 1hl5 n GLY 10 Ca -0.16 -1.00 0.12 0.00 0.00 0.00 0.00 46.02 44.98 1hl5 n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1hl5 n ASP 11 N 0.00 0.86 0.00 1.61 8.00 -1.26 -4.93 116.55 120.83 1hl5 n ASP 11 Ca 0.00 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.83 1hl5 n ASP 11 Cb 0.00 0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1hl5 n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hl5 n GLY 12 N 1.42 4.23 0.01 0.44 0.00 -1.26 -5.04 105.19 104.99 1hl5 n GLY 12 Ca 0.09 -1.82 0.14 0.00 0.00 0.00 0.00 46.02 44.43 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 0.15 -2.45 1.61 -0.04 -1.26 -4.90 135.00 128.11 1hl5 n PRO 13 Ca 0.00 -0.02 -0.42 0.00 -0.04 0.00 0.00 63.50 63.02 1hl5 n PRO 13 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.94 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 -2.86 4.26 -0.02 0.52 1.01 -1.26 -4.41 120.40 117.63 1hl5 s VAL 14 Ca 0.18 1.56 -0.00 0.00 0.00 0.00 0.00 61.98 63.72 1hl5 s VAL 14 Cb 0.19 -4.01 0.02 0.00 0.00 0.00 0.00 36.38 32.58 1hl5 s VAL 14 CO 0.53 -0.05 0.03 0.00 0.00 0.00 0.00 175.10 175.61 1hl5 s GLN 15 N 2.63 -0.00 0.15 2.72 0.00 -0.91 -3.79 119.66 120.46 1hl5 s GLN 15 Ca 0.56 0.13 -0.11 0.00 -0.00 0.00 0.00 55.36 55.94 1hl5 s GLN 15 Cb -0.24 -0.13 0.00 0.00 0.00 0.00 0.00 33.01 32.65 1hl5 s GLN 15 CO 0.20 -0.09 0.31 0.20 0.00 0.00 0.00 175.29 175.90 1hl5 s GLY 16 N 0.59 0.29 -0.04 2.60 0.00 -0.69 -0.43 107.32 109.64 1hl5 s GLY 16 Ca -0.05 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 43.99 1hl5 s GLY 16 CO -0.02 -0.72 -0.07 -0.42 0.00 0.00 0.00 173.10 171.88 1hl5 s ILE 17 N -3.93 0.67 -0.04 0.90 1.01 -0.69 -0.82 121.20 118.31 1hl5 s ILE 17 Ca 0.13 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.59 1hl5 s ILE 17 Cb 0.03 -0.66 0.00 0.00 0.01 0.00 0.00 42.46 41.84 1hl5 s ILE 17 CO -0.03 0.25 -0.13 -0.63 0.00 0.00 0.00 174.94 174.40 1hl5 s ILE 18 N 0.74 1.09 0.09 2.92 -1.09 -0.03 -2.21 121.20 122.70 1hl5 s ILE 18 Ca -0.11 -0.51 0.04 0.00 -2.23 0.00 0.00 60.65 57.83 1hl5 s ILE 18 Cb -0.14 -0.96 -0.04 0.00 -1.58 0.00 0.00 42.46 39.74 1hl5 s ILE 18 CO 0.01 0.33 0.04 0.20 -1.23 0.00 0.00 174.94 174.28 1hl5 s ASN 19 N 0.22 5.26 0.03 3.58 -0.87 0.12 -0.42 114.94 122.85 1hl5 s ASN 19 Ca -0.05 -0.10 0.05 0.00 -1.57 0.00 0.00 52.86 51.19 1hl5 s ASN 19 Cb -0.11 -1.33 -0.02 0.00 -0.02 0.00 0.00 41.25 39.77 1hl5 s ASN 19 CO 0.02 0.17 -0.15 -0.36 -2.57 0.00 0.00 177.10 174.20 1hl5 s PHE 20 N -1.35 1.36 0.05 2.20 0.40 0.11 -1.46 117.98 119.29 1hl5 s PHE 20 Ca 0.27 -0.33 -0.28 0.00 -0.60 0.00 0.00 56.93 55.99 1hl5 s PHE 20 Cb -0.12 -0.82 0.09 0.00 0.51 0.00 0.00 43.02 42.68 1hl5 s PHE 20 CO 0.20 0.03 1.07 -2.00 0.70 0.00 0.00 175.22 175.23 1hl5 s GLU 21 N -0.94 0.81 -0.00 0.44 2.56 -0.53 -1.04 118.70 119.99 1hl5 s GLU 21 Ca 0.04 -0.42 -0.03 0.00 0.00 0.00 0.00 54.97 54.56 1hl5 s GLU 21 Cb -0.07 0.29 -0.00 0.00 2.00 0.00 0.00 34.13 36.35 1hl5 s GLU 21 CO 0.01 -0.37 0.05 -2.14 -0.56 0.00 0.00 175.26 172.25 1hl5 s PRO 28 N -2.91 0.25 -0.20 4.30 0.02 -1.26 0.00 135.00 135.19 1hl5 s PRO 28 Ca 0.11 -0.28 -0.07 0.00 0.02 0.00 0.00 61.00 60.79 1hl5 s PRO 28 Cb 0.01 0.10 -0.03 0.00 0.02 0.00 0.00 34.50 34.59 1hl5 s PRO 28 CO -0.02 -0.05 0.04 0.08 -0.33 0.00 0.00 177.00 176.73 1hl5 s VAL 29 N -0.83 4.42 -0.06 3.83 1.01 0.12 -4.93 120.40 123.95 1hl5 s VAL 29 Ca -0.09 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 61.51 1hl5 s VAL 29 Cb -0.06 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1hl5 s VAL 29 CO 0.00 0.42 0.65 -0.54 0.00 0.00 0.00 175.10 175.63 1hl5 s LYS 30 N 0.84 4.41 -0.06 2.72 1.02 -1.26 -0.28 119.74 127.13 1hl5 s LYS 30 Ca 0.03 0.80 0.03 0.00 0.02 0.00 0.00 55.97 56.85 1hl5 s LYS 30 Cb -0.14 -3.43 0.01 0.00 -0.52 0.00 0.00 37.83 33.75 1hl5 s LYS 30 CO 0.02 0.12 -0.14 0.54 -0.92 0.00 0.00 175.35 174.97 1hl5 s VAL 31 N 0.63 1.28 0.03 3.17 0.11 0.69 -1.46 120.40 124.86 1hl5 s VAL 31 Ca 0.35 -0.58 -0.20 0.00 -2.93 0.00 0.00 61.98 58.61 1hl5 s VAL 31 Cb -0.17 -1.14 0.04 0.00 -1.53 0.00 0.00 36.38 33.58 1hl5 s VAL 31 CO 0.17 0.38 0.46 -1.66 -3.33 0.00 0.00 175.10 171.12 1hl5 s TRP 32 N 0.46 -0.34 -3.28 1.54 -2.14 -0.53 -0.37 118.94 114.28 1hl5 s TRP 32 Ca -0.12 0.37 0.00 0.00 2.66 0.00 0.00 56.10 59.01 1hl5 s TRP 32 Cb -0.15 0.26 0.00 0.00 -3.10 0.00 0.00 33.47 30.49 1hl5 s TRP 32 CO 0.04 -0.59 0.00 0.41 -2.66 0.00 0.00 176.95 174.15 1hl5 n GLY 33 N 0.55 -0.57 3.08 3.67 0.00 -0.23 0.10 105.19 111.79 1hl5 n GLY 33 Ca -0.19 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.22 -0.04 1.61 0.15 -0.94 -0.78 113.70 109.48 1hl5 s SER 34 Ca 0.00 0.43 0.05 0.00 0.70 0.00 0.00 55.95 57.13 1hl5 s SER 34 Cb 0.00 0.41 -0.01 0.00 -1.71 0.00 0.00 66.02 64.71 1hl5 s SER 34 CO 0.00 -0.09 -0.18 -0.63 1.20 0.00 0.00 173.24 173.54 1hl5 s ILE 35 N 0.34 1.45 0.35 6.45 1.01 -0.31 -1.70 121.20 128.79 1hl5 s ILE 35 Ca -0.02 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 59.93 1hl5 s ILE 35 Cb -0.03 -1.23 -0.07 0.00 0.01 0.00 0.00 42.46 41.13 1hl5 s ILE 35 CO -0.01 0.42 0.04 -0.54 0.00 0.00 0.00 174.94 174.84 1hl5 s LYS 36 N -0.10 1.75 0.00 2.79 3.01 0.43 -0.19 119.74 127.44 1hl5 s LYS 36 Ca -0.01 -1.98 0.00 0.00 -1.01 0.00 0.00 55.97 52.97 1hl5 s LYS 36 Cb -0.10 -1.12 0.00 0.00 -1.01 0.00 0.00 37.83 35.60 1hl5 s LYS 36 CO 0.01 -0.14 0.00 0.41 0.51 0.00 0.00 175.35 176.14 1hl5 n GLY 37 N -0.78 0.44 3.91 -3.33 0.00 -0.92 -2.14 105.19 102.37 1hl5 n GLY 37 Ca -0.03 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 45.07 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 4.19 0.32 0.99 1.43 -0.40 -4.32 118.68 120.88 1hl5 s LEU 38 Ca 0.00 0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 53.36 1hl5 s LEU 38 Cb 0.00 -3.32 -0.10 0.00 0.03 0.00 0.00 46.19 42.80 1hl5 s LEU 38 CO 0.00 -0.06 1.22 0.42 0.23 0.00 0.00 176.35 178.16 1hl5 s THR 39 N -1.87 3.02 0.24 5.49 -4.23 -1.26 -4.07 115.64 112.96 1hl5 s THR 39 Ca 0.41 1.01 -0.30 0.00 -1.18 0.00 0.00 61.69 61.63 1hl5 s THR 39 Cb -0.11 -3.64 -0.14 0.00 1.34 0.00 0.00 72.50 69.95 1hl5 s THR 39 CO 0.28 0.23 1.16 1.21 -0.54 0.00 0.00 174.62 176.95 1hl5 n GLU 40 N 0.85 1.48 0.00 3.99 2.13 -1.26 -4.63 120.64 123.20 1hl5 n GLU 40 Ca 0.00 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.34 1hl5 n GLU 40 Cb 0.43 -2.01 0.00 0.00 0.27 0.00 0.00 31.44 30.14 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 0.31 3.80 8.31 0.00 -0.33 -4.92 105.19 114.01 1hl5 n GLY 41 Ca 0.11 -2.30 -0.37 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 4.44 -0.04 0.99 1.02 -1.26 -1.10 118.68 122.72 1hl5 s LEU 42 Ca 0.00 1.46 -0.00 0.00 0.02 0.00 0.00 54.13 55.61 1hl5 s LEU 42 Cb 0.00 -3.41 0.03 0.00 0.02 0.00 0.00 46.19 42.82 1hl5 s LEU 42 CO 0.00 0.12 0.00 -1.00 0.02 0.00 0.00 176.35 175.49 1hl5 s HIS 43 N -1.36 0.43 0.46 0.29 3.76 0.00 -3.06 115.29 115.81 1hl5 s HIS 43 Ca 0.39 -0.03 -0.23 0.00 -0.15 0.00 0.00 55.06 55.03 1hl5 s HIS 43 Cb -0.19 -0.56 -0.09 0.00 1.11 0.00 0.00 32.58 32.85 1hl5 s HIS 43 CO 0.22 -0.20 1.07 0.41 -0.85 0.00 0.00 174.74 175.40 1hl5 n GLY 44 N 4.57 -0.02 2.66 -2.22 0.00 0.16 -0.94 105.19 109.40 1hl5 n GLY 44 Ca -0.18 0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.30 -0.00 0.06 1.61 5.36 0.23 -0.42 117.98 123.52 1hl5 s PHE 45 Ca 0.65 -0.24 0.01 0.00 -0.96 0.00 0.00 56.93 56.40 1hl5 s PHE 45 Cb -0.52 -0.60 -0.03 0.00 -0.34 0.00 0.00 43.02 41.53 1hl5 s PHE 45 CO 0.55 -0.64 -0.06 -1.01 -1.46 0.00 0.00 175.22 172.60 1hl5 s HIS 46 N 2.21 0.67 -0.25 10.12 3.76 -0.84 -2.29 115.29 128.68 1hl5 s HIS 46 Ca 0.06 -0.80 -0.14 0.00 -0.15 0.00 0.00 55.06 54.03 1hl5 s HIS 46 Cb -0.16 -0.42 -0.04 0.00 1.11 0.00 0.00 32.58 33.07 1hl5 s HIS 46 CO -0.18 -0.19 0.31 0.08 -0.85 0.00 0.00 174.74 173.91 1hl5 s VAL 47 N -2.86 5.24 0.27 -0.90 1.01 -0.14 -0.24 120.40 122.77 1hl5 s VAL 47 Ca 0.02 0.46 0.04 0.00 0.00 0.00 0.00 61.98 62.50 1hl5 s VAL 47 Cb 0.00 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1hl5 s VAL 47 CO -0.04 0.23 0.41 -1.00 0.00 0.00 0.00 175.10 174.70 1hl5 s HIS 48 N 1.64 3.43 0.07 5.22 3.76 0.76 -1.24 115.29 128.92 1hl5 s HIS 48 Ca 0.13 0.03 -0.21 0.00 -0.15 0.00 0.00 55.06 54.86 1hl5 s HIS 48 Cb -0.15 -1.68 -0.12 0.00 1.11 0.00 0.00 32.58 31.74 1hl5 s HIS 48 CO 0.09 0.33 1.54 1.49 -0.85 0.00 0.00 174.74 177.33 1hl5 h GLU 49 N 1.06 0.24 -5.81 1.40 4.81 -0.62 -2.60 114.58 113.06 1hl5 h GLU 49 Ca -0.51 -0.06 -0.67 0.00 -0.13 0.00 0.00 59.36 57.99 1hl5 h GLU 49 Cb 1.23 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 30.48 1hl5 h GLU 49 CO 0.60 0.42 -0.54 -0.06 -0.73 0.00 0.00 179.01 178.70 1hl5 s PHE 50 N -5.19 3.41 -0.77 0.92 0.08 -0.44 -4.63 117.98 111.37 1hl5 s PHE 50 Ca -0.14 0.37 -0.04 0.00 0.12 0.00 0.00 56.93 57.24 1hl5 s PHE 50 Cb 0.06 -1.86 0.13 0.00 -0.57 0.00 0.00 43.02 40.78 1hl5 s PHE 50 CO 0.71 0.62 2.53 0.41 -0.10 0.00 0.00 175.22 179.38 1hl5 n GLY 51 N 1.90 4.83 3.10 4.36 0.00 -1.10 -3.60 105.19 114.67 1hl5 n GLY 51 Ca -0.18 -2.04 -0.33 0.00 0.00 0.00 0.00 46.02 43.47 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 0.09 4.34 -0.11 1.61 -1.08 -1.26 -4.96 116.67 115.30 1hl5 s ASP 52 Ca 0.56 -1.25 0.14 0.00 -0.52 0.00 0.00 52.55 51.48 1hl5 s ASP 52 Cb 0.32 -1.57 0.45 0.00 -1.46 0.00 0.00 42.92 40.66 1hl5 s ASP 52 CO -0.21 -0.17 1.36 -3.20 0.52 0.00 0.00 175.17 173.47 1hl5 n ASN 53 N 4.50 3.53 -0.03 -0.34 5.15 -1.26 -2.76 115.26 124.05 1hl5 n ASN 53 Ca -0.15 -2.61 0.10 0.00 -0.60 0.00 0.00 54.58 51.32 1hl5 n ASN 53 Cb 0.44 -0.42 0.50 0.00 -0.53 0.00 0.00 39.78 39.76 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 1.93 0.96 -0.86 -0.44 1.35 -1.93 -1.26 112.91 112.66 1hl5 h THR 54 Ca 0.00 -0.14 -0.59 0.00 -0.55 0.00 0.00 66.41 65.13 1hl5 h THR 54 Cb 1.17 0.52 -0.39 0.00 -1.73 0.00 0.00 68.15 67.72 1hl5 h THR 54 CO 0.14 0.07 -0.31 0.00 -0.25 0.00 0.00 175.52 175.17 1hl5 n ALA 55 N -2.51 5.42 -0.56 6.62 0.00 -1.26 -5.06 120.51 123.15 1hl5 n ALA 55 Ca 0.07 -3.72 0.00 0.00 0.00 0.00 0.00 53.44 49.79 1hl5 n ALA 55 Cb 0.27 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.76 0.15 0.30 0.00 0.00 -0.48 -3.56 105.19 100.84 1hl5 n GLY 56 Ca 0.49 -0.93 0.19 0.00 0.00 0.00 0.00 46.02 45.77 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 1.25 0.00 0.00 2.02 -1.90 -2.47 112.91 111.81 1hl5 h THR 58 Ca -0.00 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1hl5 h THR 58 Cb 0.33 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1hl5 h THR 58 CO 0.00 0.28 0.00 -1.54 0.37 0.00 0.00 175.52 174.63 1hl5 n SER 59 N -4.34 0.00 0.05 4.18 3.41 -1.07 -2.86 113.62 113.00 1hl5 n SER 59 Ca 0.09 -0.75 0.10 0.00 -0.26 0.00 0.00 58.87 58.05 1hl5 n SER 59 Cb 0.10 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.96 1.87 -0.20 7.33 0.00 -0.93 -4.45 120.51 123.16 1hl5 n ALA 60 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1hl5 n ALA 60 Cb 0.07 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 0.46 -1.03 0.24 0.00 0.00 -1.13 -1.33 105.19 102.39 1hl5 n GLY 61 Ca 0.04 -1.22 -0.02 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.02 0.26 -2.15 1.61 -0.04 -1.26 -4.63 135.00 128.78 1hl5 n PRO 62 Ca 0.00 -0.15 -0.39 0.00 -0.04 0.00 0.00 63.50 62.92 1hl5 n PRO 62 Cb 0.00 -0.06 -0.01 0.00 -0.04 0.00 0.00 33.50 33.39 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 -0.54 2.96 0.03 0.54 3.76 -1.26 -0.45 115.29 120.32 1hl5 s HIS 63 Ca 0.04 1.46 -0.30 0.00 -0.15 0.00 0.00 55.06 56.12 1hl5 s HIS 63 Cb -0.00 -3.58 -0.08 0.00 1.11 0.00 0.00 32.58 30.03 1hl5 s HIS 63 CO 0.03 -1.77 1.84 0.12 -0.85 0.00 0.00 174.74 174.12 1hl5 s PHE 64 N -1.28 1.68 -0.42 1.40 5.36 -0.38 -4.48 117.98 119.86 1hl5 s PHE 64 Ca 0.55 -0.17 0.08 0.00 -0.96 0.00 0.00 56.93 56.43 1hl5 s PHE 64 Cb -0.36 -4.13 0.30 0.00 -0.34 0.00 0.00 43.02 38.49 1hl5 s PHE 64 CO 0.46 -4.91 0.84 -1.71 -1.46 0.00 0.00 175.22 168.44 1hl5 n ASN 65 N 6.98 -0.92 0.26 6.13 5.15 -1.26 -1.39 115.26 130.22 1hl5 n ASN 65 Ca 0.19 -3.21 0.12 0.00 -0.60 0.00 0.00 54.58 51.07 1hl5 n ASN 65 Cb 0.41 0.58 0.71 0.00 -0.53 0.00 0.00 39.78 40.96 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 3.36 0.00 -0.45 1.20 0.13 -1.93 -2.15 132.00 132.17 1hl5 h PRO 66 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1hl5 h PRO 66 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1hl5 h PRO 66 CO 0.35 0.12 0.00 1.28 -0.23 0.00 0.00 178.00 179.52 1hl5 n LEU 67 N -3.70 2.30 -4.05 1.56 4.77 -1.26 -4.94 117.00 111.68 1hl5 n LEU 67 Ca -0.02 -1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 54.52 1hl5 n LEU 67 Cb 0.24 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 1hl5 n LEU 67 CO 0.30 0.51 -0.18 -1.20 -1.33 0.00 0.00 177.39 175.50 1hl5 n SER 68 N 0.60 -1.23 -4.86 -1.43 7.64 -0.81 -4.97 113.62 108.56 1hl5 n SER 68 Ca 0.13 -1.02 -0.21 0.00 1.01 0.00 0.00 58.87 58.78 1hl5 n SER 68 Cb 0.39 -2.91 0.09 0.00 -1.01 0.00 0.00 64.21 60.76 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 -6.71 1.98 0.46 1.43 1.81 -1.26 -5.11 118.95 111.54 1hl5 s ARG 69 Ca 0.23 -1.44 -0.07 0.00 -1.72 0.00 0.00 55.73 52.73 1hl5 s ARG 69 Cb -0.13 -2.50 -0.05 0.00 -0.45 0.00 0.00 34.95 31.83 1hl5 s ARG 69 CO 0.90 -1.16 0.78 0.15 -0.68 0.00 0.00 175.30 175.29 1hl5 s LYS 70 N -4.90 3.62 0.35 3.54 3.01 -1.26 -4.78 119.74 119.32 1hl5 s LYS 70 Ca 0.64 0.30 -0.28 0.00 -1.01 0.00 0.00 55.97 55.62 1hl5 s LYS 70 Cb -0.05 -2.38 -0.10 0.00 -1.01 0.00 0.00 37.83 34.29 1hl5 s LYS 70 CO 0.42 -0.16 1.30 -1.58 0.51 0.00 0.00 175.35 175.84 1hl5 s HIS 71 N -2.63 3.00 0.19 3.18 2.46 -0.46 -3.12 115.29 117.91 1hl5 s HIS 71 Ca 0.49 1.42 -0.02 0.00 0.47 0.00 0.00 55.06 57.42 1hl5 s HIS 71 Cb -0.10 -3.66 0.01 0.00 -0.13 0.00 0.00 32.58 28.70 1hl5 s HIS 71 CO 0.41 -1.87 0.29 0.41 -2.47 0.00 0.00 174.74 171.50 1hl5 n GLY 72 N 0.76 2.38 3.90 1.59 0.00 -1.24 -4.39 105.19 108.19 1hl5 n GLY 72 Ca 0.01 -1.44 -0.28 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.14 1.62 0.56 -0.02 0.00 -1.16 -4.67 107.32 101.50 1hl5 s GLY 73 Ca 0.14 -0.56 0.25 0.00 0.00 0.00 0.00 44.72 44.56 1hl5 s GLY 73 CO 0.10 -0.23 2.11 -0.56 0.00 0.00 0.00 173.10 174.52 1hl5 h PRO 74 N -0.40 0.00 -0.02 2.90 0.13 -1.88 -1.87 132.00 130.86 1hl5 h PRO 74 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1hl5 h PRO 74 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1hl5 h PRO 74 CO 0.62 0.00 -0.11 1.63 -0.23 0.00 0.00 178.00 179.91 1hl5 n LYS 75 N -4.10 1.49 -3.00 0.86 5.02 -1.26 -4.90 118.16 112.27 1hl5 n LYS 75 Ca 0.02 -0.97 -0.36 0.00 -2.02 0.00 0.00 58.31 54.98 1hl5 n LYS 75 Cb 0.31 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 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 -2.18 7.10 0.10 4.39 1.01 -0.71 -4.96 116.67 121.42 1hl5 s ASP 76 Ca 0.31 1.53 -0.18 0.00 0.71 0.00 0.00 52.55 54.92 1hl5 s ASP 76 Cb 0.20 -2.46 -0.06 0.00 1.01 0.00 0.00 42.92 41.61 1hl5 s ASP 76 CO 0.40 -0.04 1.61 -0.08 0.21 0.00 0.00 175.17 177.27 1hl5 h GLU 77 N 3.15 0.45 -5.86 8.23 4.22 -1.90 -3.38 114.58 119.49 1hl5 h GLU 77 Ca -0.48 -0.10 -0.60 0.00 0.08 0.00 0.00 59.36 58.26 1hl5 h GLU 77 Cb 1.19 -0.06 -0.12 0.00 0.50 0.00 0.00 28.75 30.26 1hl5 h GLU 77 CO 0.65 0.52 0.65 -2.00 -2.18 0.00 0.00 179.01 176.64 1hl5 s GLU 78 N -5.34 3.27 0.17 1.92 2.56 -1.26 -4.96 118.70 115.06 1hl5 s GLU 78 Ca -0.13 -0.38 -0.22 0.00 0.00 0.00 0.00 54.97 54.23 1hl5 s GLU 78 Cb 0.08 -4.11 0.06 0.00 2.00 0.00 0.00 34.13 32.16 1hl5 s GLU 78 CO 0.74 -1.67 0.60 -0.98 -0.56 0.00 0.00 175.26 173.39 1hl5 s ARG 79 N 4.26 1.33 0.44 4.30 1.04 -1.19 -3.70 118.95 125.44 1hl5 s ARG 79 Ca 0.30 -0.55 -0.21 0.00 -1.04 0.00 0.00 55.73 54.23 1hl5 s ARG 79 Cb -0.13 0.59 -0.10 0.00 -2.04 0.00 0.00 34.95 33.27 1hl5 s ARG 79 CO 0.17 -0.58 0.99 -1.01 -0.04 0.00 0.00 175.30 174.82 1hl5 s HIS 80 N -3.77 3.22 0.30 5.89 3.76 -1.18 -4.69 115.29 118.81 1hl5 s HIS 80 Ca 0.02 1.61 0.05 0.00 -0.15 0.00 0.00 55.06 56.59 1hl5 s HIS 80 Cb -0.01 -2.95 0.69 0.00 1.11 0.00 0.00 32.58 31.42 1hl5 s HIS 80 CO -0.11 -0.38 1.79 0.28 -0.85 0.00 0.00 174.74 175.48 1hl5 h VAL 81 N 1.85 0.76 0.00 -0.90 2.07 -1.87 -1.39 116.25 116.76 1hl5 h VAL 81 Ca -0.49 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.75 1hl5 h VAL 81 Cb 1.20 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1hl5 h VAL 81 CO 0.61 0.15 0.00 0.61 0.02 0.00 0.00 177.57 178.96 1hl5 n GLY 82 N -1.33 -0.84 3.51 2.17 0.00 -0.48 -4.36 105.19 103.85 1hl5 n GLY 82 Ca 0.22 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.24 6.46 -0.20 1.61 1.01 -0.53 -0.97 116.67 122.81 1hl5 s ASP 83 Ca 0.04 -1.47 0.15 0.00 0.71 0.00 0.00 52.55 51.98 1hl5 s ASP 83 Cb 0.02 -2.49 0.75 0.00 1.01 0.00 0.00 42.92 42.21 1hl5 s ASP 83 CO 0.03 -1.39 1.67 0.18 0.21 0.00 0.00 175.17 175.87 1hl5 n LEU 84 N 7.97 5.20 0.00 1.23 4.77 -0.97 -3.47 117.00 131.72 1hl5 n LEU 84 Ca 0.21 -2.82 0.00 0.00 -0.03 0.00 0.00 56.01 53.36 1hl5 n LEU 84 Cb 0.49 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1hl5 n LEU 84 CO 0.61 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.96 1hl5 n GLY 85 N 0.56 1.67 3.25 -0.72 0.00 -1.20 -4.76 105.19 103.98 1hl5 n GLY 85 Ca 0.26 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 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 2.29 0.23 1.61 0.01 -1.26 -0.60 114.94 113.22 1hl5 s ASN 86 Ca 0.00 -0.66 0.07 0.00 -0.71 0.00 0.00 52.86 51.56 1hl5 s ASN 86 Cb 0.00 -0.12 -0.04 0.00 0.41 0.00 0.00 41.25 41.51 1hl5 s ASN 86 CO 0.00 0.03 0.15 0.68 -1.51 0.00 0.00 177.10 176.44 1hl5 s VAL 87 N -1.17 4.27 -0.17 1.60 -7.23 -0.12 -4.90 120.40 112.68 1hl5 s VAL 87 Ca 0.04 -1.41 0.01 0.00 -1.81 0.00 0.00 61.98 58.81 1hl5 s VAL 87 Cb -0.10 -3.27 0.01 0.00 0.56 0.00 0.00 36.38 33.58 1hl5 s VAL 87 CO 0.04 -0.29 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.45 1hl5 s THR 88 N -2.06 2.18 -0.02 5.32 2.01 -1.26 -0.82 115.64 120.99 1hl5 s THR 88 Ca 0.32 -0.91 -0.14 0.00 0.31 0.00 0.00 61.69 61.27 1hl5 s THR 88 Cb -0.08 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.46 1hl5 s THR 88 CO 0.24 0.53 0.38 0.00 -0.69 0.00 0.00 174.62 175.08 1hl5 s ALA 89 N 1.17 3.70 0.80 7.40 0.00 -0.26 -4.16 121.76 130.40 1hl5 s ALA 89 Ca 0.02 -0.27 -0.02 0.00 0.00 0.00 0.00 51.96 51.69 1hl5 s ALA 89 Cb -0.14 -2.36 0.04 0.00 0.00 0.00 0.00 23.12 20.66 1hl5 s ALA 89 CO -0.09 0.46 0.25 -0.40 0.00 0.00 0.00 175.76 175.97 1hl5 n ASP 90 N 2.00 0.12 0.28 0.00 5.68 -0.40 -1.18 116.55 123.04 1hl5 n ASP 90 Ca -0.14 -1.15 0.12 0.00 -0.50 0.00 0.00 54.79 53.12 1hl5 n ASP 90 Cb 0.53 -0.18 0.80 0.00 -1.14 0.00 0.00 41.12 41.12 1hl5 n ASP 90 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1hl5 h LYS 91 N 0.00 0.00 -0.27 0.11 5.09 -1.98 0.34 116.57 119.86 1hl5 h LYS 91 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.66 1hl5 h LYS 91 Cb 0.25 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.58 1hl5 h LYS 91 CO 0.07 0.00 0.00 -0.25 -2.09 0.00 0.00 179.45 177.18 1hl5 n ASP 92 N -4.15 1.72 0.00 7.07 8.00 -1.26 -4.81 116.55 123.12 1hl5 n ASP 92 Ca -0.03 -1.88 0.00 0.00 0.71 0.00 0.00 54.79 53.59 1hl5 n ASP 92 Cb 0.09 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 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 1.07 0.62 3.56 0.44 0.00 0.11 -4.75 105.19 106.24 1hl5 n GLY 93 Ca 0.13 0.00 -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 -2.22 4.49 -0.31 1.61 1.01 -1.26 -1.28 120.40 122.45 1hl5 s VAL 94 Ca 0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 1hl5 s VAL 94 Cb 0.00 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.37 1hl5 s VAL 94 CO 0.00 0.44 0.08 0.00 0.00 0.00 0.00 175.10 175.62 1hl5 s ALA 95 N 0.63 3.04 -0.22 5.51 0.00 0.74 -1.27 121.76 130.20 1hl5 s ALA 95 Ca 0.02 -1.54 -0.24 0.00 0.00 0.00 0.00 51.96 50.20 1hl5 s ALA 95 Cb -0.13 -2.17 -0.01 0.00 0.00 0.00 0.00 23.12 20.81 1hl5 s ALA 95 CO 0.02 -1.04 0.78 -0.51 0.00 0.00 0.00 175.76 175.01 1hl5 s ASP 96 N 1.46 6.81 -0.20 0.00 -0.00 -1.26 -1.17 116.67 122.33 1hl5 s ASP 96 Ca 0.01 1.01 -0.07 0.00 -0.00 0.00 0.00 52.55 53.50 1hl5 s ASP 96 Cb -0.18 -2.42 -0.04 0.00 -0.00 0.00 0.00 42.92 40.29 1hl5 s ASP 96 CO 0.02 -0.44 0.05 -0.69 -0.00 0.00 0.00 175.17 174.12 1hl5 s VAL 97 N 2.51 4.55 -0.28 -1.27 1.01 0.04 -4.79 120.40 122.18 1hl5 s VAL 97 Ca 0.34 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1hl5 s VAL 97 Cb -0.16 -3.06 0.15 0.00 0.00 0.00 0.00 36.38 33.30 1hl5 s VAL 97 CO 0.09 0.43 0.37 -0.55 0.00 0.00 0.00 175.10 175.43 1hl5 s SER 98 N 0.73 0.72 0.07 3.32 0.15 -1.25 -1.07 113.70 116.37 1hl5 s SER 98 Ca 0.03 -0.33 0.04 0.00 0.70 0.00 0.00 55.95 56.39 1hl5 s SER 98 Cb -0.13 0.93 -0.03 0.00 -1.71 0.00 0.00 66.02 65.07 1hl5 s SER 98 CO 0.02 -0.35 -0.12 -0.63 1.20 0.00 0.00 173.24 173.36 1hl5 s ILE 99 N 2.49 0.98 -0.05 6.45 1.01 0.50 -5.01 121.20 127.57 1hl5 s ILE 99 Ca 0.10 -1.34 0.04 0.00 0.00 0.00 0.00 60.65 59.45 1hl5 s ILE 99 Cb -0.14 -1.05 0.00 0.00 0.01 0.00 0.00 42.46 41.28 1hl5 s ILE 99 CO -0.27 -0.32 -0.16 -0.70 0.00 0.00 0.00 174.94 173.49 1hl5 s GLU 100 N -1.93 1.84 0.00 2.79 2.12 -1.26 -0.22 118.70 122.04 1hl5 s GLU 100 Ca -0.02 -0.58 -0.00 0.00 0.36 0.00 0.00 54.97 54.73 1hl5 s GLU 100 Cb -0.09 -1.56 -0.00 0.00 0.26 0.00 0.00 34.13 32.74 1hl5 s GLU 100 CO 0.02 0.18 -0.00 0.34 -0.54 0.00 0.00 175.26 175.26 1hl5 s ASP 101 N 0.21 0.04 0.00 -1.70 2.15 0.61 -4.96 116.67 113.02 1hl5 s ASP 101 Ca -0.08 -0.08 0.09 0.00 0.43 0.00 0.00 52.55 52.91 1hl5 s ASP 101 Cb -0.13 0.03 0.12 0.00 -0.30 0.00 0.00 42.92 42.63 1hl5 s ASP 101 CO 0.03 -0.06 0.90 -1.20 -0.17 0.00 0.00 175.17 174.67 1hl5 n SER 102 N 2.80 2.01 -0.10 -0.34 7.64 -1.26 0.16 113.62 124.54 1hl5 n SER 102 Ca -0.14 -1.54 -0.23 0.00 1.01 0.00 0.00 58.87 57.97 1hl5 n SER 102 Cb 0.59 -0.05 -0.12 0.00 -1.01 0.00 0.00 64.21 63.62 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 0.45 1.57 -1.17 0.44 0.31 -1.26 -4.91 118.33 113.76 1hl5 n VAL 103 Ca 0.06 -0.45 -0.30 0.00 -0.01 0.00 0.00 64.34 63.64 1hl5 n VAL 103 Cb 0.27 -1.72 0.12 0.00 -0.91 0.00 0.00 33.84 31.60 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 -2.50 2.93 0.12 2.52 -4.36 -1.26 -4.84 121.20 113.81 1hl5 s ILE 104 Ca -0.33 0.30 -0.11 0.00 -0.26 0.00 0.00 60.65 60.26 1hl5 s ILE 104 Cb 0.10 -2.74 0.01 0.00 1.25 0.00 0.00 42.46 41.08 1hl5 s ILE 104 CO 0.60 -0.39 0.28 -0.55 0.24 0.00 0.00 174.94 175.11 1hl5 s SER 105 N -3.32 0.00 -0.11 4.36 0.15 -0.84 -4.68 113.70 109.26 1hl5 s SER 105 Ca 0.63 -0.63 0.17 0.00 0.70 0.00 0.00 55.95 56.82 1hl5 s SER 105 Cb -0.18 0.41 0.64 0.00 -1.71 0.00 0.00 66.02 65.17 1hl5 s SER 105 CO 0.57 -0.82 1.55 0.18 1.20 0.00 0.00 173.24 175.93 1hl5 n LEU 106 N -0.15 4.42 -3.76 3.45 4.77 -1.26 -1.89 117.00 122.58 1hl5 n LEU 106 Ca -0.13 -2.49 -0.04 0.00 -0.03 0.00 0.00 56.01 53.32 1hl5 n LEU 106 Cb 0.63 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 1hl5 n LEU 106 CO 0.21 0.78 0.67 -0.94 -1.33 0.00 0.00 177.39 176.78 1hl5 s SER 107 N -1.08 -0.20 0.00 -1.43 1.04 -1.26 -4.88 113.70 105.89 1hl5 s SER 107 Ca 0.46 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.47 1hl5 s SER 107 Cb 0.31 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.95 1hl5 s SER 107 CO 0.21 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.07 1hl5 n GLY 108 N -0.46 -1.67 0.10 7.32 0.00 -1.26 -4.01 105.19 105.20 1hl5 n GLY 108 Ca -0.06 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.50 1hl5 n GLY 108 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1hl5 h ASP 109 N 0.00 0.00 -0.75 1.61 3.58 -2.00 -3.04 116.42 115.83 1hl5 h ASP 109 Ca 0.00 -0.11 -0.24 0.00 0.42 0.00 0.00 57.03 57.10 1hl5 h ASP 109 Cb 0.00 0.00 -0.14 0.00 1.72 0.00 0.00 39.33 40.91 1hl5 h ASP 109 CO 0.00 0.06 0.31 1.41 -2.88 0.00 0.00 179.24 178.13 1hl5 n HIS 110 N -2.32 2.46 -2.09 0.28 8.25 -1.26 -4.96 115.22 115.57 1hl5 n HIS 110 Ca 0.04 -1.23 -0.42 0.00 -0.26 0.00 0.00 57.72 55.85 1hl5 n HIS 110 Cb 0.46 -0.70 -0.03 0.00 1.12 0.00 0.00 29.99 30.84 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 3.53 0.00 -1.90 0.00 -5.35 -0.79 -4.93 119.36 109.91 1hl5 n ILE 112 Ca 0.11 -0.48 -0.41 0.00 -0.27 0.00 0.00 62.75 61.69 1hl5 n ILE 112 Cb 0.41 1.29 -0.02 0.00 -1.74 0.00 0.00 39.64 39.58 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 -1.31 2.39 0.00 7.28 -1.09 -1.26 -1.63 121.20 125.58 1hl5 s ILE 113 Ca 0.17 0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.91 1hl5 s ILE 113 Cb 0.12 -3.21 0.00 0.00 -1.58 0.00 0.00 42.46 37.80 1hl5 s ILE 113 CO 0.21 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.58 1hl5 n GLY 114 N 2.31 0.83 1.80 6.18 0.00 0.65 -5.00 105.19 111.96 1hl5 n GLY 114 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.09 1.01 -4.75 1.61 1.74 -0.65 -2.72 116.66 110.82 1hl5 n ARG 115 Ca 0.00 -1.56 -0.33 0.00 -0.77 0.00 0.00 57.85 55.19 1hl5 n ARG 115 Cb 0.00 0.07 -0.15 0.00 -1.02 0.00 0.00 32.46 31.36 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 -1.06 2.89 -0.03 0.55 2.01 -0.98 -0.41 115.64 118.61 1hl5 s THR 116 Ca 0.20 -0.71 -0.21 0.00 0.31 0.00 0.00 61.69 61.28 1hl5 s THR 116 Cb -0.02 -2.21 -0.05 0.00 0.01 0.00 0.00 72.50 70.24 1hl5 s THR 116 CO 0.12 0.52 0.60 -0.22 -0.69 0.00 0.00 174.62 174.96 1hl5 s LEU 117 N 0.47 4.38 -0.02 4.42 2.96 -0.36 -0.17 118.68 130.36 1hl5 s LEU 117 Ca -0.10 1.12 0.05 0.00 -0.22 0.00 0.00 54.13 54.98 1hl5 s LEU 117 Cb -0.16 -2.93 -0.01 0.00 0.50 0.00 0.00 46.19 43.59 1hl5 s LEU 117 CO 0.05 0.04 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.26 1hl5 s VAL 118 N 0.14 1.32 -0.09 1.68 1.01 0.66 -2.22 120.40 122.90 1hl5 s VAL 118 Ca 0.32 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.61 1hl5 s VAL 118 Cb -0.18 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1hl5 s VAL 118 CO 0.16 0.38 -0.14 0.54 0.00 0.00 0.00 175.10 176.04 1hl5 s VAL 119 N -0.28 3.04 0.27 2.92 0.11 -0.66 -1.98 120.40 123.83 1hl5 s VAL 119 Ca 0.04 -0.70 0.06 0.00 -2.93 0.00 0.00 61.98 58.45 1hl5 s VAL 119 Cb -0.08 -2.23 -0.03 0.00 -1.53 0.00 0.00 36.38 32.51 1hl5 s VAL 119 CO -0.00 0.56 0.31 -1.00 -3.33 0.00 0.00 175.10 171.64 1hl5 s HIS 120 N -0.20 3.23 0.23 1.54 3.76 0.44 -1.12 115.29 123.17 1hl5 s HIS 120 Ca 0.00 -0.11 -0.07 0.00 -0.15 0.00 0.00 55.06 54.73 1hl5 s HIS 120 Cb -0.13 -1.59 0.25 0.00 1.11 0.00 0.00 32.58 32.21 1hl5 s HIS 120 CO 0.03 0.38 1.88 1.49 -0.85 0.00 0.00 174.74 177.67 1hl5 h GLU 121 N 1.25 1.06 -5.04 1.40 4.81 -0.91 -3.38 114.58 113.77 1hl5 h GLU 121 Ca -0.49 -0.06 -0.54 0.00 -0.13 0.00 0.00 59.36 58.14 1hl5 h GLU 121 Cb 1.24 -0.24 -0.13 0.00 0.63 0.00 0.00 28.75 30.25 1hl5 h GLU 121 CO 0.59 0.70 -0.52 0.15 -0.73 0.00 0.00 179.01 179.20 1hl5 s LYS 122 N -6.10 1.88 0.39 1.92 1.02 0.40 -4.92 119.74 114.33 1hl5 s LYS 122 Ca -0.13 -2.13 -0.26 0.00 0.02 0.00 0.00 55.97 53.47 1hl5 s LYS 122 Cb 0.17 -0.56 -0.09 0.00 -0.52 0.00 0.00 37.83 36.83 1hl5 s LYS 122 CO 0.79 -0.46 1.24 0.00 -0.92 0.00 0.00 175.35 176.00 1hl5 s ALA 123 N -3.25 3.24 -0.18 5.17 0.00 -1.17 -0.66 121.76 124.90 1hl5 s ALA 123 Ca 0.26 1.11 -0.28 0.00 0.00 0.00 0.00 51.96 53.04 1hl5 s ALA 123 Cb 0.03 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 1hl5 s ALA 123 CO 0.15 -0.65 0.99 0.34 0.00 0.00 0.00 175.76 176.59 1hl5 s ASP 124 N -0.89 7.11 -0.00 0.00 -1.08 -1.26 -3.89 116.67 116.66 1hl5 s ASP 124 Ca 0.56 1.38 0.02 0.00 -0.52 0.00 0.00 52.55 53.99 1hl5 s ASP 124 Cb -0.35 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 38.65 1hl5 s ASP 124 CO 0.44 -0.55 0.98 -0.90 0.52 0.00 0.00 175.17 175.67 1hl5 n ASP 125 N 5.72 0.56 -1.79 -0.34 5.68 0.23 -4.88 116.55 121.73 1hl5 n ASP 125 Ca 0.09 -2.01 -0.19 0.00 -0.50 0.00 0.00 54.79 52.18 1hl5 n ASP 125 Cb 0.47 -0.12 -0.06 0.00 -1.14 0.00 0.00 41.12 40.27 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 -0.23 -1.48 0.00 -2.12 4.77 -1.26 -1.99 117.00 114.68 1hl5 n LEU 126 Ca 0.02 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1hl5 n LEU 126 Cb 0.11 -2.67 0.00 0.00 -2.33 0.00 0.00 43.42 38.52 1hl5 n LEU 126 CO 0.02 -0.77 0.00 0.61 -1.33 0.00 0.00 177.39 175.92 1hl5 n GLY 127 N -0.52 0.60 1.07 -0.72 0.00 -1.25 -2.99 105.19 101.37 1hl5 n GLY 127 Ca -0.20 -0.20 0.08 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.76 3.29 0.00 1.61 5.02 -0.84 -4.62 118.16 119.86 1hl5 n LYS 128 Ca 0.00 -2.84 0.14 0.00 -2.02 0.00 0.00 58.31 53.59 1hl5 n LYS 128 Cb 0.00 -1.87 0.64 0.00 -0.02 0.00 0.00 35.03 33.77 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 -0.17 -0.96 3.84 0.72 0.00 -1.26 -4.95 105.19 102.42 1hl5 n GLY 129 Ca 0.22 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 1.27 1.50 3.79 -0.02 0.00 -1.26 -4.95 105.19 105.51 1hl5 n GLY 130 Ca 0.15 -0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 4.70 0.26 1.61 4.22 -1.26 -4.94 114.94 119.54 1hl5 s ASN 131 Ca 0.00 1.64 -0.02 0.00 -2.14 0.00 0.00 52.86 52.34 1hl5 s ASN 131 Cb 0.00 -2.40 0.46 0.00 1.28 0.00 0.00 41.25 40.59 1hl5 s ASN 131 CO 0.00 -1.88 1.81 -0.08 -2.04 0.00 0.00 177.10 174.91 1hl5 h GLU 132 N -1.02 0.81 -0.32 3.55 4.81 -2.00 -1.92 114.58 118.48 1hl5 h GLU 132 Ca -0.45 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.71 1hl5 h GLU 132 Cb 1.23 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 1hl5 h GLU 132 CO 0.55 0.54 0.10 1.49 -0.73 0.00 0.00 179.01 180.95 1hl5 h GLU 133 N 0.84 0.46 -0.87 1.92 4.57 -1.99 -1.11 114.58 118.40 1hl5 h GLU 133 Ca 0.44 -0.06 0.09 0.00 -1.18 0.00 0.00 59.36 58.65 1hl5 h GLU 133 Cb 0.44 -0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 28.87 1hl5 h GLU 133 CO -0.27 0.41 0.52 1.03 -1.18 0.00 0.00 179.01 179.52 1hl5 h SER 134 N 0.46 0.76 0.27 1.04 0.87 -1.69 0.13 113.55 115.38 1hl5 h SER 134 Ca 0.11 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1hl5 h SER 134 Cb 0.15 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1hl5 h SER 134 CO -0.01 0.44 0.00 0.35 -0.53 0.00 0.00 176.83 177.08 1hl5 n THR 135 N -4.69 0.24 -0.07 2.23 -2.24 -0.43 -1.94 114.28 107.37 1hl5 n THR 135 Ca 0.14 0.06 -0.14 0.00 -2.27 0.00 0.00 64.05 61.84 1hl5 n THR 135 Cb 0.27 -0.72 -0.05 0.00 -2.10 0.00 0.00 70.33 67.73 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 -1.20 0.31 0.00 -0.78 5.02 0.24 -1.36 118.16 120.39 1hl5 n LYS 136 Ca 0.12 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 1hl5 n LYS 136 Cb 0.14 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 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 -3.49 0.00 -1.18 -0.18 -2.24 -0.07 -4.66 114.28 102.45 1hl5 n THR 137 Ca -0.27 -0.28 -0.06 0.00 -2.27 0.00 0.00 64.05 61.17 1hl5 n THR 137 Cb 0.71 1.36 -0.03 0.00 -2.10 0.00 0.00 70.33 70.27 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 0.11 0.83 2.46 3.38 0.00 -0.82 -3.28 105.19 107.87 1hl5 n GLY 138 Ca 0.00 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.44 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 0.16 -5.11 0.00 1.61 3.02 -1.25 -0.60 115.26 113.08 1hl5 n ASN 139 Ca -0.06 0.05 0.12 0.00 -0.03 0.00 0.00 54.58 54.65 1hl5 n ASN 139 Cb 0.28 -4.27 0.67 0.00 -0.61 0.00 0.00 39.78 35.85 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 -2.20 2.32 -0.09 5.41 0.00 -1.21 -4.74 120.51 120.01 1hl5 n ALA 140 Ca -0.20 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1hl5 n ALA 140 Cb 0.65 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 0.64 -0.52 3.83 0.00 0.00 -1.26 -0.45 105.19 107.42 1hl5 n GLY 141 Ca 0.15 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 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 3.74 -0.38 1.61 1.04 -1.26 -4.68 113.70 109.77 1hl5 s SER 142 Ca 0.00 0.85 -0.13 0.00 0.48 0.00 0.00 55.95 57.14 1hl5 s SER 142 Cb 0.00 -1.35 0.01 0.00 0.10 0.00 0.00 66.02 64.78 1hl5 s SER 142 CO 0.00 -2.39 0.26 -0.13 0.98 0.00 0.00 173.24 171.96 1hl5 s ARG 143 N -5.42 3.09 0.02 4.02 0.52 -1.26 -0.73 118.95 119.18 1hl5 s ARG 143 Ca 0.64 -0.92 -0.07 0.00 -0.52 0.00 0.00 55.73 54.85 1hl5 s ARG 143 Cb -0.13 -3.87 -0.30 0.00 0.52 0.00 0.00 34.95 31.17 1hl5 s ARG 143 CO 0.52 -0.65 0.93 -0.07 0.02 0.00 0.00 175.30 176.05 1hl5 h LEU 144 N 8.54 0.53 -7.35 2.53 3.38 -1.42 -3.48 115.31 118.05 1hl5 h LEU 144 Ca -0.28 -0.66 -0.07 0.00 0.09 0.00 0.00 57.88 56.96 1hl5 h LEU 144 Cb 1.13 -0.17 -0.16 0.00 0.09 0.00 0.00 40.66 41.54 1hl5 h LEU 144 CO 0.69 1.53 -0.08 0.00 0.09 0.00 0.00 178.44 180.68 1hl5 s ALA 145 N -2.62 -1.06 0.33 1.53 0.00 -1.18 -4.06 121.76 114.70 1hl5 s ALA 145 Ca -0.09 0.33 -0.17 0.00 0.00 0.00 0.00 51.96 52.03 1hl5 s ALA 145 Cb 0.06 0.38 0.03 0.00 0.00 0.00 0.00 23.12 23.60 1hl5 s ALA 145 CO 0.88 -0.48 0.72 0.00 0.00 0.00 0.00 175.76 176.88 1hl5 s GLY 147 N -3.01 -0.36 0.07 0.00 0.00 -0.94 -1.04 107.32 102.03 1hl5 s GLY 147 Ca 0.15 1.41 -0.23 0.00 0.00 0.00 0.00 44.72 46.04 1hl5 s GLY 147 CO 0.10 0.52 0.70 0.14 0.00 0.00 0.00 173.10 174.56 1hl5 s VAL 148 N -2.54 4.68 -0.33 1.40 1.01 -1.26 -1.22 120.40 122.14 1hl5 s VAL 148 Ca 0.06 1.51 -0.29 0.00 0.00 0.00 0.00 61.98 63.25 1hl5 s VAL 148 Cb -0.01 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.33 1hl5 s VAL 148 CO -0.06 0.44 1.21 -0.63 0.00 0.00 0.00 175.10 176.06 1hl5 s ILE 149 N -0.49 4.27 0.20 2.22 1.01 0.45 -4.45 121.20 124.42 1hl5 s ILE 149 Ca 0.35 1.42 0.10 0.00 0.00 0.00 0.00 60.65 62.51 1hl5 s ILE 149 Cb -0.20 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 37.91 1hl5 s ILE 149 CO 0.22 -0.56 -0.12 -0.83 0.00 0.00 0.00 174.94 173.65 1hl5 s GLY 150 N 2.40 1.73 0.24 6.18 0.00 0.42 -0.26 107.32 118.03 1hl5 s GLY 150 Ca 0.52 -1.57 -0.30 0.00 0.00 0.00 0.00 44.72 43.37 1hl5 s GLY 150 CO 0.22 -1.60 1.44 -0.42 0.00 0.00 0.00 173.10 172.74 1hl5 s ILE 151 N -1.87 2.68 0.33 0.90 1.01 -1.26 -0.80 121.20 122.19 1hl5 s ILE 151 Ca 0.26 0.56 0.09 0.00 0.00 0.00 0.00 60.65 61.56 1hl5 s ILE 151 Cb -0.08 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 38.98 1hl5 s ILE 151 CO 0.15 0.09 0.07 0.00 0.00 0.00 0.00 174.94 175.24 1hl5 s ALA 152 N 0.09 3.33 -2.00 9.38 0.00 -0.51 -4.78 121.76 127.26 1hl5 s ALA 152 Ca 0.60 -1.88 0.28 0.00 0.00 0.00 0.00 51.96 50.96 1hl5 s ALA 152 Cb -0.42 -0.56 1.68 0.00 0.00 0.00 0.00 23.12 23.82 1hl5 s ALA 152 CO 0.42 0.07 2.02 0.94 0.00 0.00 0.00 175.76 179.21