#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hx7 s GLU 2 N 0.00 1.45 -0.08 0.00 0.41 -1.26 -5.04 118.70 114.17 2hx7 s GLU 2 Ca 0.00 -0.72 0.15 0.00 -0.41 0.00 0.00 54.97 53.98 2hx7 s GLU 2 Cb 0.00 -1.44 0.30 0.00 -1.78 0.00 0.00 34.13 31.21 2hx7 s GLU 2 CO 0.00 0.39 1.14 0.00 -0.49 0.00 0.00 175.26 176.30 2hx7 s SER 4 N -2.28 0.04 -0.05 0.00 1.04 -1.26 -1.53 113.70 109.66 2hx7 s SER 4 Ca 0.27 -0.81 -0.09 0.00 0.48 0.00 0.00 55.95 55.80 2hx7 s SER 4 Cb 0.27 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.83 2hx7 s SER 4 CO -0.06 -0.86 0.22 0.54 0.98 0.00 0.00 173.24 174.05 2hx7 s VAL 5 N -3.94 0.04 -0.09 5.02 0.11 -0.19 -4.94 120.40 116.39 2hx7 s VAL 5 Ca 0.14 -0.30 -0.11 0.00 -2.93 0.00 0.00 61.98 58.78 2hx7 s VAL 5 Cb 0.03 -0.41 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 2hx7 s VAL 5 CO -0.02 -0.16 0.27 -1.81 -3.33 0.00 0.00 175.10 170.04 2hx7 s ASP 6 N -0.60 6.53 0.02 3.54 1.01 -1.26 -1.12 116.67 124.80 2hx7 s ASP 6 Ca -0.07 0.63 0.02 0.00 0.71 0.00 0.00 52.55 53.84 2hx7 s ASP 6 Cb -0.04 -2.16 -0.02 0.00 1.01 0.00 0.00 42.92 41.71 2hx7 s ASP 6 CO 0.01 0.29 -0.06 -0.51 0.21 0.00 0.00 175.17 175.11 2hx7 s ILE 7 N -0.59 0.42 0.06 0.77 2.07 -0.07 -4.93 121.20 118.94 2hx7 s ILE 7 Ca 0.18 -0.76 0.10 0.00 -1.41 0.00 0.00 60.65 58.76 2hx7 s ILE 7 Cb -0.14 -0.46 -0.03 0.00 0.13 0.00 0.00 42.46 41.96 2hx7 s ILE 7 CO 0.07 -0.23 -0.26 -1.10 -1.91 0.00 0.00 174.94 171.50 2hx7 s GLN 8 N -1.07 1.72 -0.08 3.50 -0.21 -1.26 -1.54 119.66 120.73 2hx7 s GLN 8 Ca -0.07 -1.16 0.04 0.00 0.02 0.00 0.00 55.36 54.20 2hx7 s GLN 8 Cb -0.07 -1.97 -0.00 0.00 1.00 0.00 0.00 33.01 31.97 2hx7 s GLN 8 CO 0.00 0.50 -0.23 0.20 -2.12 0.00 0.00 175.29 173.64 2hx7 s GLY 9 N -1.42 1.26 0.17 3.09 0.00 -0.45 -1.80 107.32 108.18 2hx7 s GLY 9 Ca 0.12 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 43.92 2hx7 s GLY 9 CO 0.03 -0.38 0.11 1.16 0.00 0.00 0.00 173.10 174.02 2hx7 n ASN 10 N 3.37 1.62 0.28 1.64 0.23 -0.81 -3.74 115.26 117.84 2hx7 n ASN 10 Ca -0.19 -1.59 0.17 0.00 -0.53 0.00 0.00 54.58 52.44 2hx7 n ASN 10 Cb 0.53 -0.00 0.70 0.00 -2.08 0.00 0.00 39.78 38.93 2hx7 n ASN 10 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2hx7 h ASP 11 N 0.22 0.00 -0.32 0.53 3.32 -1.91 -2.61 116.42 115.65 2hx7 h ASP 11 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2hx7 h ASP 11 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2hx7 h ASP 11 CO 0.17 0.02 0.00 0.00 -1.72 0.00 0.00 179.24 177.71 2hx7 n GLN 12 N -3.12 1.83 -3.34 3.56 3.00 -1.26 -4.91 117.38 113.13 2hx7 n GLN 12 Ca 0.00 -1.18 -0.18 0.00 -0.01 0.00 0.00 57.00 55.63 2hx7 n GLN 12 Cb 0.30 -1.30 0.06 0.00 0.00 0.00 0.00 30.24 29.31 2hx7 n GLN 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 2hx7 n MET 13 N 0.43 -6.20 -5.05 -1.09 1.56 -0.98 -5.01 117.12 100.78 2hx7 n MET 13 Ca 0.11 0.65 -0.28 0.00 -0.27 0.00 0.00 57.70 57.91 2hx7 n MET 13 Cb 0.30 -5.16 -0.16 0.00 2.15 0.00 0.00 33.22 30.35 2hx7 n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 2hx7 s GLN 14 N -5.95 1.94 0.53 2.12 -0.21 -1.26 -4.61 119.66 112.21 2hx7 s GLN 14 Ca 0.42 -0.76 -0.11 0.00 0.02 0.00 0.00 55.36 54.93 2hx7 s GLN 14 Cb -0.19 -1.76 -0.05 0.00 1.00 0.00 0.00 33.01 32.01 2hx7 s GLN 14 CO 0.57 0.39 0.92 -0.06 -2.12 0.00 0.00 175.29 175.00 2hx7 s PHE 15 N -0.30 3.55 -0.56 0.91 0.08 -1.26 -1.93 117.98 118.47 2hx7 s PHE 15 Ca 0.03 1.19 0.15 0.00 0.12 0.00 0.00 56.93 58.42 2hx7 s PHE 15 Cb -0.10 -2.60 0.77 0.00 -0.57 0.00 0.00 43.02 40.51 2hx7 s PHE 15 CO 0.01 -0.42 1.68 0.27 -0.10 0.00 0.00 175.22 176.65 2hx7 n ASN 16 N -2.11 5.30 -3.65 1.36 6.94 -0.74 -4.84 115.26 117.52 2hx7 n ASN 16 Ca 0.04 -2.75 -0.12 0.00 -0.02 0.00 0.00 54.58 51.73 2hx7 n ASN 16 Cb 0.54 -0.65 -0.06 0.00 -2.36 0.00 0.00 39.78 37.26 2hx7 n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2hx7 s THR 17 N -2.43 0.06 0.00 5.53 -1.32 -1.26 -4.96 115.64 111.26 2hx7 s THR 17 Ca 0.52 -0.50 0.00 0.00 -1.21 0.00 0.00 61.69 60.50 2hx7 s THR 17 Cb 0.38 -1.03 0.00 0.00 -1.51 0.00 0.00 72.50 70.33 2hx7 s THR 17 CO 0.18 -0.28 0.94 -0.46 -2.21 0.00 0.00 174.62 172.80 2hx7 n ASN 18 N 0.23 1.87 -3.66 8.08 0.23 -1.26 -4.80 115.26 115.95 2hx7 n ASN 18 Ca -0.18 -1.88 -0.06 0.00 -0.53 0.00 0.00 54.58 51.93 2hx7 n ASN 18 Cb 0.61 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.24 2hx7 n ASN 18 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2hx7 s ALA 19 N -0.88 -1.54 -0.08 -2.53 0.00 -1.26 -2.02 121.76 113.43 2hx7 s ALA 19 Ca 0.00 1.91 0.01 0.00 0.00 0.00 0.00 51.96 53.87 2hx7 s ALA 19 Cb 0.00 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 2hx7 s ALA 19 CO 0.00 -0.74 -0.10 0.42 0.00 0.00 0.00 175.76 175.35 2hx7 s ILE 20 N 2.51 3.44 -0.04 0.00 1.01 -0.14 -4.97 121.20 123.01 2hx7 s ILE 20 Ca -0.05 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.08 2hx7 s ILE 20 Cb -0.11 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.93 2hx7 s ILE 20 CO -0.16 0.57 -0.15 0.42 0.00 0.00 0.00 174.94 175.63 2hx7 s THR 21 N -0.47 3.03 -0.20 2.92 -4.23 -1.26 -1.63 115.64 113.80 2hx7 s THR 21 Ca 0.06 -0.76 -0.02 0.00 -1.18 0.00 0.00 61.69 59.79 2hx7 s THR 21 Cb -0.12 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.53 2hx7 s THR 21 CO 0.02 0.57 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.87 2hx7 s VAL 22 N -0.75 2.82 -0.03 2.29 1.01 0.06 -4.93 120.40 120.87 2hx7 s VAL 22 Ca 0.12 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 2hx7 s VAL 22 Cb -0.11 -2.25 -0.06 0.00 0.00 0.00 0.00 36.38 33.96 2hx7 s VAL 22 CO 0.01 0.47 1.68 -0.62 0.00 0.00 0.00 175.10 176.64 2hx7 s ASP 23 N 1.40 6.64 0.61 3.32 -1.08 -1.26 -0.87 116.67 125.44 2hx7 s ASP 23 Ca 0.05 2.30 0.30 0.00 -0.52 0.00 0.00 52.55 54.69 2hx7 s ASP 23 Cb -0.14 -2.54 1.65 0.00 -1.46 0.00 0.00 42.92 40.44 2hx7 s ASP 23 CO -0.07 -0.93 2.01 0.07 0.52 0.00 0.00 175.17 176.77 2hx7 h LYS 24 N 9.49 0.00 0.00 4.34 5.09 -1.20 -0.70 116.57 133.59 2hx7 h LYS 24 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.33 2hx7 h LYS 24 Cb 1.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.52 2hx7 h LYS 24 CO 0.95 0.00 0.00 0.77 -2.09 0.00 0.00 179.45 179.08 2hx7 h SER 25 N 0.00 0.00 -3.12 7.07 0.02 -1.89 -3.46 113.55 112.16 2hx7 h SER 25 Ca 0.10 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.52 2hx7 h SER 25 Cb 0.70 0.00 0.07 0.00 0.14 0.00 0.00 62.40 63.31 2hx7 h SER 25 CO -0.00 0.00 0.90 0.00 -1.14 0.00 0.00 176.83 176.59 2hx7 h LYS 27 N 5.53 0.66 -4.17 0.00 3.64 -1.89 -3.42 116.57 116.93 2hx7 h LYS 27 Ca -0.45 -0.37 -0.13 0.00 -1.27 0.00 0.00 60.65 58.42 2hx7 h LYS 27 Cb 1.21 0.02 -0.17 0.00 -0.41 0.00 0.00 32.23 32.89 2hx7 h LYS 27 CO 0.84 0.98 -0.68 -0.65 -2.27 0.00 0.00 179.45 177.67 2hx7 s GLN 28 N -4.27 0.53 -0.01 1.90 -0.21 -1.26 -1.38 119.66 114.96 2hx7 s GLN 28 Ca -0.12 -1.06 0.05 0.00 0.02 0.00 0.00 55.36 54.25 2hx7 s GLN 28 Cb 0.08 0.18 -0.01 0.00 1.00 0.00 0.00 33.01 34.26 2hx7 s GLN 28 CO 0.83 -0.09 -0.17 0.12 -2.12 0.00 0.00 175.29 173.85 2hx7 s PHE 29 N -3.28 1.50 -0.05 0.91 5.36 -0.42 -4.86 117.98 117.14 2hx7 s PHE 29 Ca 0.01 -0.28 0.05 0.00 -0.96 0.00 0.00 56.93 55.75 2hx7 s PHE 29 Cb 0.03 -0.96 -0.01 0.00 -0.34 0.00 0.00 43.02 41.74 2hx7 s PHE 29 CO -0.08 -0.02 -0.21 0.99 -1.46 0.00 0.00 175.22 174.44 2hx7 s THR 30 N -0.40 1.72 -0.17 0.12 2.01 -0.58 -1.16 115.64 117.19 2hx7 s THR 30 Ca 0.06 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.18 2hx7 s THR 30 Cb -0.06 -1.47 -0.01 0.00 0.01 0.00 0.00 72.50 70.97 2hx7 s THR 30 CO -0.01 0.49 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.60 2hx7 s VAL 31 N -0.02 2.94 -0.44 3.82 1.01 0.02 -1.02 120.40 126.71 2hx7 s VAL 31 Ca -0.05 -0.67 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 2hx7 s VAL 31 Cb -0.13 -2.27 0.08 0.00 0.00 0.00 0.00 36.38 34.06 2hx7 s VAL 31 CO 0.03 0.50 0.30 0.20 0.00 0.00 0.00 175.10 176.13 2hx7 s ASN 32 N 0.88 5.79 -0.07 3.32 0.01 -0.27 -1.36 114.94 123.23 2hx7 s ASN 32 Ca -0.03 -1.49 -0.13 0.00 -0.71 0.00 0.00 52.86 50.50 2hx7 s ASN 32 Cb -0.15 -2.04 -0.05 0.00 0.41 0.00 0.00 41.25 39.42 2hx7 s ASN 32 CO -0.00 -0.58 0.32 -0.22 -1.51 0.00 0.00 177.10 175.10 2hx7 s LEU 33 N 1.48 4.40 0.28 0.60 2.96 0.19 -0.89 118.68 127.71 2hx7 s LEU 33 Ca 0.03 0.74 0.03 0.00 -0.22 0.00 0.00 54.13 54.72 2hx7 s LEU 33 Cb -0.24 -2.42 -0.03 0.00 0.50 0.00 0.00 46.19 44.01 2hx7 s LEU 33 CO 0.03 0.29 0.24 -0.94 -1.32 0.00 0.00 176.35 174.65 2hx7 s SER 34 N -0.67 1.06 -0.43 3.68 1.04 -0.59 -1.54 113.70 116.26 2hx7 s SER 34 Ca 0.20 -1.60 0.04 0.00 0.48 0.00 0.00 55.95 55.08 2hx7 s SER 34 Cb -0.15 0.50 0.17 0.00 0.10 0.00 0.00 66.02 66.65 2hx7 s SER 34 CO 0.09 -1.00 0.41 -2.28 0.98 0.00 0.00 173.24 171.43 2hx7 s HIS 35 N -3.68 0.52 0.86 5.02 2.46 -1.24 -1.33 115.29 117.89 2hx7 s HIS 35 Ca 0.39 -1.92 -0.13 0.00 0.47 0.00 0.00 55.06 53.87 2hx7 s HIS 35 Cb 0.04 -0.67 0.04 0.00 -0.13 0.00 0.00 32.58 31.86 2hx7 s HIS 35 CO 0.21 -0.92 0.70 -2.30 -2.47 0.00 0.00 174.74 169.96 2hx7 n PRO 36 N 2.97 -0.05 0.00 2.88 -0.02 -1.25 -1.95 135.00 137.59 2hx7 n PRO 36 Ca 0.26 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2hx7 n PRO 36 Cb 0.49 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2hx7 n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hx7 n GLY 37 N 1.19 -0.57 0.00 -1.23 0.00 -1.26 -3.71 105.19 99.61 2hx7 n GLY 37 Ca 0.10 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.93 2hx7 n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hx7 n ASN 38 N 0.00 0.14 -4.79 1.61 5.03 -1.26 -4.58 115.26 111.41 2hx7 n ASN 38 Ca 0.00 -0.47 -0.39 0.00 0.87 0.00 0.00 54.58 54.59 2hx7 n ASN 38 Cb 0.00 0.51 -0.06 0.00 -1.02 0.00 0.00 39.78 39.21 2hx7 n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2hx7 s LEU 39 N -1.01 4.57 0.83 3.41 1.43 -1.26 -4.85 118.68 121.79 2hx7 s LEU 39 Ca 0.00 1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 54.49 2hx7 s LEU 39 Cb 0.00 -3.16 0.11 0.00 0.03 0.00 0.00 46.19 43.17 2hx7 s LEU 39 CO 0.00 0.23 1.18 -2.16 0.23 0.00 0.00 176.35 175.83 2hx7 s PRO 40 N -1.15 1.64 0.38 1.29 0.04 -1.26 -1.30 135.00 134.64 2hx7 s PRO 40 Ca 0.33 -0.14 0.05 0.00 0.04 0.00 0.00 61.00 61.29 2hx7 s PRO 40 Cb -0.22 -1.98 0.76 0.00 0.04 0.00 0.00 34.50 33.11 2hx7 s PRO 40 CO 0.24 -1.75 2.02 -0.22 0.04 0.00 0.00 177.00 177.33 2hx7 h LYS 41 N -1.11 0.68 -0.00 4.56 3.64 -1.84 -0.95 116.57 121.54 2hx7 h LYS 41 Ca -0.45 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2hx7 h LYS 41 Cb 1.30 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2hx7 h LYS 41 CO 0.57 0.45 -0.00 0.27 -2.27 0.00 0.00 179.45 178.46 2hx7 n ASN 42 N -4.46 0.02 -0.04 4.20 6.94 -1.26 -2.19 115.26 118.46 2hx7 n ASN 42 Ca 0.06 -0.25 -0.07 0.00 -0.02 0.00 0.00 54.58 54.30 2hx7 n ASN 42 Cb 0.10 -0.25 -0.04 0.00 -2.36 0.00 0.00 39.78 37.23 2hx7 n ASN 42 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 2hx7 n VAL 43 N -1.24 0.49 -3.04 3.53 0.31 -0.72 -4.90 118.33 112.75 2hx7 n VAL 43 Ca 0.15 -0.17 -0.15 0.00 -0.01 0.00 0.00 64.34 64.16 2hx7 n VAL 43 Cb 0.23 -1.03 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 2hx7 n VAL 43 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2hx7 n MET 44 N -2.93 1.00 -2.84 5.55 0.00 -0.44 -5.03 117.12 112.42 2hx7 n MET 44 Ca -0.16 -3.02 -0.37 0.00 -0.00 0.00 0.00 57.70 54.15 2hx7 n MET 44 Cb 0.65 -1.49 -0.06 0.00 0.00 0.00 0.00 33.22 32.32 2hx7 n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2hx7 s GLY 45 N -2.19 2.83 0.01 -5.12 0.00 -0.93 -4.71 107.32 97.21 2hx7 s GLY 45 Ca 0.35 0.47 0.06 0.00 0.00 0.00 0.00 44.72 45.60 2hx7 s GLY 45 CO -0.07 0.92 -0.18 0.30 0.00 0.00 0.00 173.10 174.08 2hx7 s HIS 46 N -1.49 1.62 0.43 1.90 3.76 -0.28 -4.87 115.29 116.35 2hx7 s HIS 46 Ca 0.46 -0.33 0.04 0.00 -0.15 0.00 0.00 55.06 55.08 2hx7 s HIS 46 Cb -0.20 -1.01 -0.04 0.00 1.11 0.00 0.00 32.58 32.44 2hx7 s HIS 46 CO 0.25 0.01 0.05 0.54 -0.85 0.00 0.00 174.74 174.73 2hx7 s ASN 47 N -0.70 3.39 -0.11 1.40 2.20 -1.26 -0.21 114.94 119.65 2hx7 s ASN 47 Ca 0.06 -1.54 0.01 0.00 -0.94 0.00 0.00 52.86 50.46 2hx7 s ASN 47 Cb -0.07 0.18 0.02 0.00 -2.00 0.00 0.00 41.25 39.38 2hx7 s ASN 47 CO 0.00 -0.73 -0.13 0.86 -2.94 0.00 0.00 177.10 174.17 2hx7 s TRP 48 N -3.00 1.83 -0.01 1.54 -0.00 -1.26 -3.95 118.94 114.08 2hx7 s TRP 48 Ca 0.23 -0.89 0.03 0.00 -0.00 0.00 0.00 56.10 55.46 2hx7 s TRP 48 Cb 0.05 -1.37 -0.00 0.00 -0.00 0.00 0.00 33.47 32.15 2hx7 s TRP 48 CO 0.12 -0.50 -0.09 0.08 -0.00 0.00 0.00 176.95 176.56 2hx7 s VAL 49 N 1.23 0.70 -0.08 5.86 1.01 0.44 -1.03 120.40 128.54 2hx7 s VAL 49 Ca -0.02 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.65 2hx7 s VAL 49 Cb -0.14 -0.60 -0.00 0.00 0.00 0.00 0.00 36.38 35.64 2hx7 s VAL 49 CO -0.05 0.21 -0.22 -0.22 0.00 0.00 0.00 175.10 174.82 2hx7 s LEU 50 N -0.05 2.00 0.25 3.92 2.96 -0.39 -1.07 118.68 126.31 2hx7 s LEU 50 Ca 0.01 -0.50 -0.08 0.00 -0.22 0.00 0.00 54.13 53.35 2hx7 s LEU 50 Cb -0.05 -1.28 -0.01 0.00 0.50 0.00 0.00 46.19 45.34 2hx7 s LEU 50 CO -0.00 0.15 0.38 -0.94 -1.32 0.00 0.00 176.35 174.62 2hx7 s SER 51 N 0.28 0.16 0.77 3.68 1.04 -0.95 -0.87 113.70 117.81 2hx7 s SER 51 Ca -0.15 -1.16 -0.13 0.00 0.48 0.00 0.00 55.95 55.00 2hx7 s SER 51 Cb -0.16 0.54 0.06 0.00 0.10 0.00 0.00 66.02 66.56 2hx7 s SER 51 CO 0.07 -1.09 1.17 0.42 0.98 0.00 0.00 173.24 174.79 2hx7 s THR 52 N -3.89 2.48 0.26 2.02 -4.23 -1.26 -1.38 115.64 109.65 2hx7 s THR 52 Ca 0.28 0.21 -0.03 0.00 -1.18 0.00 0.00 61.69 60.97 2hx7 s THR 52 Cb 0.01 -2.62 0.25 0.00 1.34 0.00 0.00 72.50 71.48 2hx7 s THR 52 CO 0.12 -0.16 1.86 0.00 -0.54 0.00 0.00 174.62 175.90 2hx7 h ALA 53 N -0.75 1.31 -0.19 3.99 0.00 -0.73 -2.03 119.26 120.87 2hx7 h ALA 53 Ca -0.46 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 2hx7 h ALA 53 Cb 1.27 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2hx7 h ALA 53 CO 0.48 0.35 -0.14 0.00 0.00 0.00 0.00 179.25 179.95 2hx7 h ALA 54 N 1.44 1.41 0.00 0.00 0.00 -1.91 -2.56 119.26 117.65 2hx7 h ALA 54 Ca 0.41 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2hx7 h ALA 54 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2hx7 h ALA 54 CO -0.18 0.41 -0.25 -0.25 0.00 0.00 0.00 179.25 178.97 2hx7 n ASP 55 N -4.24 0.74 -0.09 0.00 8.00 -0.80 -4.35 116.55 115.81 2hx7 n ASP 55 Ca -0.00 0.38 -0.06 0.00 0.71 0.00 0.00 54.79 55.82 2hx7 n ASP 55 Cb 0.29 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 2hx7 n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 2hx7 h MET 56 N 0.00 -0.10 -0.63 -1.24 1.85 -1.08 -0.84 114.93 112.89 2hx7 h MET 56 Ca 0.00 0.01 0.01 0.00 -0.61 0.00 0.00 59.70 59.11 2hx7 h MET 56 Cb 0.73 0.02 -0.03 0.00 0.43 0.00 0.00 31.60 32.75 2hx7 h MET 56 CO 0.00 -0.07 0.42 0.37 -0.40 0.00 0.00 176.91 177.23 2hx7 h GLN 57 N -0.11 0.82 -0.20 0.39 5.75 -1.78 -0.64 115.11 119.35 2hx7 h GLN 57 Ca 0.17 -0.05 -0.19 0.00 -0.15 0.00 0.00 58.65 58.43 2hx7 h GLN 57 Cb 0.37 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.74 2hx7 h GLN 57 CO -0.41 0.54 -0.64 0.78 -2.65 0.00 0.00 178.83 176.45 2hx7 h GLY 58 N 0.85 0.79 0.97 2.39 0.00 -1.79 -0.46 103.07 105.82 2hx7 h GLY 58 Ca 0.24 -1.01 0.01 0.00 0.00 0.00 0.00 47.33 46.57 2hx7 h GLY 58 CO -0.06 0.90 0.45 -2.08 0.00 0.00 0.00 176.54 175.75 2hx7 h VAL 59 N 0.53 1.15 0.11 4.60 2.07 -0.87 -0.91 116.25 122.94 2hx7 h VAL 59 Ca -0.01 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2hx7 h VAL 59 Cb 1.24 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2hx7 h VAL 59 CO 0.13 0.17 -0.05 0.58 0.02 0.00 0.00 177.57 178.41 2hx7 h VAL 60 N 0.91 0.97 0.01 2.57 2.07 -1.02 0.10 116.25 121.86 2hx7 h VAL 60 Ca 0.26 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2hx7 h VAL 60 Cb -0.07 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2hx7 h VAL 60 CO -0.07 0.07 -0.00 0.74 0.02 0.00 0.00 177.57 178.32 2hx7 h THR 61 N -0.27 1.15 -0.88 2.57 2.02 -0.95 0.18 112.91 116.73 2hx7 h THR 61 Ca -0.02 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.69 2hx7 h THR 61 Cb 0.22 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.07 2hx7 h THR 61 CO 0.02 0.13 0.58 0.44 0.37 0.00 0.00 175.52 177.06 2hx7 h ASP 62 N -0.22 1.01 0.18 4.18 3.32 -1.24 -2.15 116.42 121.49 2hx7 h ASP 62 Ca -0.00 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2hx7 h ASP 62 Cb 0.22 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2hx7 h ASP 62 CO 0.00 0.73 -0.08 1.23 -1.72 0.00 0.00 179.24 179.40 2hx7 h GLY 63 N 1.19 -0.25 0.53 2.75 0.00 -0.50 -1.59 103.07 105.20 2hx7 h GLY 63 Ca 0.32 0.09 0.08 0.00 0.00 0.00 0.00 47.33 47.83 2hx7 h GLY 63 CO -0.07 -0.09 0.35 -0.33 0.00 0.00 0.00 176.54 176.40 2hx7 h MET 64 N -0.40 0.59 0.00 4.80 2.86 -0.58 -0.85 114.93 121.35 2hx7 h MET 64 Ca -0.02 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 2hx7 h MET 64 Cb 0.31 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 2hx7 h MET 64 CO 0.04 0.39 -0.10 0.00 1.06 0.00 0.00 176.91 178.30 2hx7 h ALA 65 N 1.40 1.43 0.00 6.32 0.00 -1.22 -1.41 119.26 125.78 2hx7 h ALA 65 Ca 0.33 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2hx7 h ALA 65 Cb 0.31 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2hx7 h ALA 65 CO -0.24 0.13 -0.23 0.77 0.00 0.00 0.00 179.25 179.67 2hx7 h SER 66 N 0.00 0.00 -4.53 0.00 0.02 -0.13 -3.49 113.55 105.42 2hx7 h SER 66 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2hx7 h SER 66 Cb 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2hx7 h SER 66 CO 0.01 0.23 0.00 0.61 -1.14 0.00 0.00 176.83 176.54 2hx7 n GLY 67 N -0.05 -0.20 0.29 -3.77 0.00 -0.53 -4.16 105.19 96.76 2hx7 n GLY 67 Ca -0.00 -1.76 0.01 0.00 0.00 0.00 0.00 46.02 44.26 2hx7 n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2hx7 h LEU 68 N 0.00 0.50 -2.33 0.99 5.85 -1.92 -0.39 115.31 118.01 2hx7 h LEU 68 Ca 0.00 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2hx7 h LEU 68 Cb 0.00 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 40.90 2hx7 h LEU 68 CO 0.00 0.49 -0.02 -2.24 -0.34 0.00 0.00 178.44 176.33 2hx7 h ASP 69 N 0.54 0.00 -0.31 1.25 2.03 -2.00 -1.23 116.42 116.70 2hx7 h ASP 69 Ca 0.13 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.40 2hx7 h ASP 69 Cb 0.18 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.66 2hx7 h ASP 69 CO -0.01 0.02 0.01 0.29 -1.03 0.00 0.00 179.24 178.52 2hx7 n LYS 70 N -3.23 2.95 -2.47 4.15 4.76 -0.61 -4.94 118.16 118.77 2hx7 n LYS 70 Ca -0.02 -2.90 -0.16 0.00 -2.87 0.00 0.00 58.31 52.36 2hx7 n LYS 70 Cb 0.17 -1.88 -0.01 0.00 -1.84 0.00 0.00 35.03 31.47 2hx7 n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2hx7 n ASP 71 N -0.50 -4.73 -3.03 4.39 9.92 -0.46 -2.10 116.55 120.04 2hx7 n ASP 71 Ca 0.24 0.08 -0.22 0.00 -0.53 0.00 0.00 54.79 54.36 2hx7 n ASP 71 Cb 0.95 -3.97 0.02 0.00 -0.64 0.00 0.00 41.12 37.47 2hx7 n ASP 71 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2hx7 n TYR 72 N -3.67 -1.81 -4.70 1.24 4.01 -0.26 -4.76 117.16 107.21 2hx7 n TYR 72 Ca -0.18 0.43 -0.23 0.00 -0.16 0.00 0.00 57.90 57.76 2hx7 n TYR 72 Cb 0.64 -3.92 -0.15 0.00 -0.31 0.00 0.00 39.34 35.60 2hx7 n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2hx7 s LEU 73 N -6.51 2.05 0.08 7.72 1.43 -0.89 -3.71 118.68 118.85 2hx7 s LEU 73 Ca 0.29 -0.30 -0.31 0.00 -1.03 0.00 0.00 54.13 52.78 2hx7 s LEU 73 Cb -0.14 -0.79 -0.08 0.00 0.03 0.00 0.00 46.19 45.21 2hx7 s LEU 73 CO 0.35 0.18 1.60 -0.75 0.23 0.00 0.00 176.35 177.96 2hx7 s LYS 74 N -0.45 4.21 0.25 1.70 2.20 -1.26 -4.83 119.74 121.57 2hx7 s LYS 74 Ca 0.06 2.29 -0.31 0.00 -0.36 0.00 0.00 55.97 57.65 2hx7 s LYS 74 Cb -0.06 -3.49 -0.13 0.00 -1.51 0.00 0.00 37.83 32.64 2hx7 s LYS 74 CO -0.00 -0.68 1.46 -2.30 -0.36 0.00 0.00 175.35 173.47 2hx7 n PRO 75 N 5.17 2.23 -1.47 4.03 -0.02 -1.26 -2.08 135.00 141.61 2hx7 n PRO 75 Ca 0.15 0.79 -0.16 0.00 -2.02 0.00 0.00 63.50 62.26 2hx7 n PRO 75 Cb 0.40 -2.49 -0.07 0.00 -0.02 0.00 0.00 33.50 31.33 2hx7 n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2hx7 n ASP 76 N 2.16 -4.94 -4.57 2.55 8.00 -1.26 -4.89 116.55 113.61 2hx7 n ASP 76 Ca 0.11 0.40 -0.46 0.00 0.71 0.00 0.00 54.79 55.54 2hx7 n ASP 76 Cb 0.33 -3.85 -0.05 0.00 -0.02 0.00 0.00 41.12 37.54 2hx7 n ASP 76 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2hx7 n ASP 77 N -0.59 3.01 0.08 -2.24 -0.08 -0.88 -4.80 116.55 111.05 2hx7 n ASP 77 Ca -0.16 0.43 0.09 0.00 -1.51 0.00 0.00 54.79 53.64 2hx7 n ASP 77 Cb 0.53 -1.44 0.40 0.00 2.34 0.00 0.00 41.12 42.95 2hx7 n ASP 77 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2hx7 n SER 78 N 10.07 0.38 0.09 1.67 3.41 -1.26 -2.46 113.62 125.51 2hx7 n SER 78 Ca 0.32 0.61 0.12 0.00 -0.26 0.00 0.00 58.87 59.66 2hx7 n SER 78 Cb 0.35 -0.68 0.27 0.00 -0.26 0.00 0.00 64.21 63.89 2hx7 n SER 78 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2hx7 h ARG 79 N 0.00 0.00 -5.84 4.33 3.08 -1.97 -3.43 114.38 110.54 2hx7 h ARG 79 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 2hx7 h ARG 79 Cb 0.25 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.18 2hx7 h ARG 79 CO 0.00 0.00 0.40 0.08 -1.07 0.00 0.00 179.97 179.38 2hx7 s VAL 80 N -3.14 4.66 0.17 2.04 1.01 -1.03 -4.44 120.40 119.66 2hx7 s VAL 80 Ca 0.08 0.67 -0.07 0.00 0.00 0.00 0.00 61.98 62.66 2hx7 s VAL 80 Cb 0.12 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2hx7 s VAL 80 CO 0.66 -0.62 1.51 0.40 0.00 0.00 0.00 175.10 177.06 2hx7 h ILE 81 N 5.90 1.29 -2.01 2.22 2.04 -1.29 -3.47 117.51 122.18 2hx7 h ILE 81 Ca -0.25 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.00 2hx7 h ILE 81 Cb 1.09 1.50 -0.19 0.00 -0.74 0.00 0.00 36.82 38.48 2hx7 h ILE 81 CO 0.95 0.52 0.30 0.00 0.00 0.00 0.00 178.15 179.93 2hx7 s ALA 82 N -4.27 -1.80 0.02 1.87 0.00 -1.24 -5.00 121.76 111.35 2hx7 s ALA 82 Ca -0.09 1.28 -0.28 0.00 0.00 0.00 0.00 51.96 52.87 2hx7 s ALA 82 Cb 0.11 -0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.24 2hx7 s ALA 82 CO 0.86 -0.42 0.64 -3.38 0.00 0.00 0.00 175.76 173.46 2hx7 s HIS 83 N -1.56 -0.60 0.82 0.00 -3.43 -1.26 -1.26 115.29 108.00 2hx7 s HIS 83 Ca -0.06 0.82 -0.06 0.00 -0.80 0.00 0.00 55.06 54.96 2hx7 s HIS 83 Cb -0.00 0.45 0.17 0.00 -1.43 0.00 0.00 32.58 31.76 2hx7 s HIS 83 CO 0.04 -0.68 1.12 0.95 -2.00 0.00 0.00 174.74 174.17 2hx7 s THR 84 N -2.08 2.04 0.84 -5.38 -4.23 -0.19 -4.85 115.64 101.79 2hx7 s THR 84 Ca -0.07 -0.41 -0.11 0.00 -1.18 0.00 0.00 61.69 59.91 2hx7 s THR 84 Cb -0.00 -2.62 0.13 0.00 1.34 0.00 0.00 72.50 71.34 2hx7 s THR 84 CO 0.02 0.00 1.19 -1.59 -0.54 0.00 0.00 174.62 173.70 2hx7 s LYS 85 N -5.42 1.41 -0.10 3.99 -2.85 -1.26 -4.61 119.74 110.89 2hx7 s LYS 85 Ca 0.70 -0.33 -0.25 0.00 -1.00 0.00 0.00 55.97 55.10 2hx7 s LYS 85 Cb -0.04 -1.99 -0.03 0.00 -2.06 0.00 0.00 37.83 33.71 2hx7 s LYS 85 CO 0.48 -1.86 0.77 -1.17 0.10 0.00 0.00 175.35 173.66 2hx7 s LEU 86 N -5.60 4.26 0.13 2.77 2.96 -1.26 -4.38 118.68 117.57 2hx7 s LEU 86 Ca 0.67 1.21 0.10 0.00 -0.22 0.00 0.00 54.13 55.90 2hx7 s LEU 86 Cb -0.07 -3.17 -0.04 0.00 0.50 0.00 0.00 46.19 43.41 2hx7 s LEU 86 CO 0.49 -0.23 -0.25 0.27 -1.32 0.00 0.00 176.35 175.31 2hx7 s ILE 87 N 1.34 2.09 0.57 6.68 -4.36 0.71 -4.88 121.20 123.35 2hx7 s ILE 87 Ca 0.39 -1.72 0.09 0.00 -0.26 0.00 0.00 60.65 59.15 2hx7 s ILE 87 Cb -0.18 -1.87 0.09 0.00 1.25 0.00 0.00 42.46 41.76 2hx7 s ILE 87 CO 0.17 0.02 0.79 0.61 0.24 0.00 0.00 174.94 176.77 2hx7 n GLY 88 N 0.90 1.96 3.72 6.27 0.00 -1.26 -1.13 105.19 115.64 2hx7 n GLY 88 Ca -0.18 -2.23 -0.43 0.00 0.00 0.00 0.00 46.02 43.19 2hx7 n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2hx7 n SER 89 N -2.34 3.22 0.00 1.61 3.41 -0.42 -2.11 113.62 116.99 2hx7 n SER 89 Ca 0.16 1.18 0.00 0.00 -0.26 0.00 0.00 58.87 59.95 2hx7 n SER 89 Cb 0.59 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 2hx7 n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hx7 n GLY 90 N 1.42 2.58 3.95 5.00 0.00 -0.82 -4.94 105.19 112.37 2hx7 n GLY 90 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2hx7 n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hx7 s GLU 91 N -0.56 2.89 0.01 1.61 2.02 -0.90 -4.96 118.70 118.81 2hx7 s GLU 91 Ca 0.00 -0.40 -0.07 0.00 0.02 0.00 0.00 54.97 54.53 2hx7 s GLU 91 Cb 0.00 -2.45 -0.00 0.00 0.10 0.00 0.00 34.13 31.78 2hx7 s GLU 91 CO 0.00 -0.51 0.12 0.15 0.02 0.00 0.00 175.26 175.04 2hx7 s LYS 92 N -4.74 0.48 -0.10 1.61 3.01 -1.26 -3.61 119.74 115.13 2hx7 s LYS 92 Ca 0.52 -0.46 -0.23 0.00 -1.01 0.00 0.00 55.97 54.79 2hx7 s LYS 92 Cb -0.10 0.20 0.05 0.00 -1.01 0.00 0.00 37.83 36.97 2hx7 s LYS 92 CO 0.40 -0.11 0.55 0.34 0.51 0.00 0.00 175.35 177.04 2hx7 s ASP 93 N -1.47 -0.53 0.18 2.83 2.15 -0.59 -5.02 116.67 114.22 2hx7 s ASP 93 Ca -0.14 0.74 0.10 0.00 0.43 0.00 0.00 52.55 53.68 2hx7 s ASP 93 Cb -0.07 0.73 -0.04 0.00 -0.30 0.00 0.00 42.92 43.23 2hx7 s ASP 93 CO 0.01 -0.42 -0.22 -0.44 -0.17 0.00 0.00 175.17 173.93 2hx7 s SER 94 N -0.66 3.13 -0.01 -0.34 0.01 -1.26 -0.63 113.70 113.94 2hx7 s SER 94 Ca -0.07 -0.86 0.01 0.00 1.31 0.00 0.00 55.95 56.34 2hx7 s SER 94 Cb -0.03 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.99 2hx7 s SER 94 CO 0.05 0.06 -0.04 0.54 0.41 0.00 0.00 173.24 174.26 2hx7 s VAL 95 N -1.80 0.37 -0.05 3.43 0.11 -0.46 -4.90 120.40 117.11 2hx7 s VAL 95 Ca 0.18 -0.16 0.05 0.00 -2.93 0.00 0.00 61.98 59.13 2hx7 s VAL 95 Cb -0.07 -0.35 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 2hx7 s VAL 95 CO 0.09 0.13 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.89 2hx7 s THR 96 N 0.17 2.54 0.04 5.04 2.01 -1.26 -0.80 115.64 123.38 2hx7 s THR 96 Ca -0.02 -0.91 -0.00 0.00 0.31 0.00 0.00 61.69 61.07 2hx7 s THR 96 Cb -0.05 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 2hx7 s THR 96 CO -0.00 0.58 -0.03 0.72 -0.69 0.00 0.00 174.62 175.19 2hx7 s PHE 97 N -0.52 0.46 0.03 4.92 -0.71 -0.31 -4.97 117.98 116.89 2hx7 s PHE 97 Ca 0.07 -0.88 -0.30 0.00 -1.04 0.00 0.00 56.93 54.77 2hx7 s PHE 97 Cb -0.11 -0.33 -0.06 0.00 -1.21 0.00 0.00 43.02 41.30 2hx7 s PHE 97 CO 0.01 -0.30 1.37 -0.51 -1.34 0.00 0.00 175.22 174.45 2hx7 s ASP 98 N -2.44 6.87 0.58 1.98 1.01 -1.26 -1.30 116.67 122.11 2hx7 s ASP 98 Ca -0.00 2.14 0.36 0.00 0.71 0.00 0.00 52.55 55.75 2hx7 s ASP 98 Cb 0.02 -2.57 1.69 0.00 1.01 0.00 0.00 42.92 43.07 2hx7 s ASP 98 CO -0.07 -0.68 2.11 0.58 0.21 0.00 0.00 175.17 177.33 2hx7 h VAL 99 N 4.75 0.11 0.00 -1.27 2.07 -1.47 -1.26 116.25 119.17 2hx7 h VAL 99 Ca -0.39 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 66.74 2hx7 h VAL 99 Cb 1.19 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2hx7 h VAL 99 CO 0.89 0.03 0.00 0.77 0.02 0.00 0.00 177.57 179.27 2hx7 h SER 100 N 0.00 0.00 0.60 0.57 4.64 -1.89 -0.50 113.55 116.97 2hx7 h SER 100 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2hx7 h SER 100 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2hx7 h SER 100 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 2hx7 n LYS 101 N -2.63 0.08 -3.86 4.77 5.02 -0.47 -4.72 118.16 116.35 2hx7 n LYS 101 Ca 0.00 0.15 -0.35 0.00 -2.02 0.00 0.00 58.31 56.09 2hx7 n LYS 101 Cb 0.19 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.62 2hx7 n LYS 101 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2hx7 s LEU 102 N -2.89 4.05 -0.03 -0.35 1.43 -0.20 -5.10 118.68 115.60 2hx7 s LEU 102 Ca 0.12 0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 2hx7 s LEU 102 Cb 0.13 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2hx7 s LEU 102 CO 0.34 0.19 -0.05 -0.54 0.23 0.00 0.00 176.35 176.52 2hx7 s LYS 103 N 0.27 2.68 0.36 1.70 1.02 -1.26 -5.04 119.74 119.47 2hx7 s LYS 103 Ca 0.06 -0.62 -0.28 0.00 0.02 0.00 0.00 55.97 55.15 2hx7 s LYS 103 Cb -0.12 -2.57 -0.11 0.00 -0.52 0.00 0.00 37.83 34.51 2hx7 s LYS 103 CO -0.01 0.64 1.48 -1.83 -0.92 0.00 0.00 175.35 174.70 2hx7 s GLU 104 N -1.17 4.14 0.00 1.68 4.04 -1.26 -2.28 118.70 123.85 2hx7 s GLU 104 Ca 0.15 2.53 0.00 0.00 0.04 0.00 0.00 54.97 57.69 2hx7 s GLU 104 Cb -0.11 -2.99 0.00 0.00 0.02 0.00 0.00 34.13 31.05 2hx7 s GLU 104 CO 0.05 -0.50 0.00 0.41 -1.84 0.00 0.00 175.26 173.38 2hx7 n GLY 105 N 0.71 2.10 3.88 -3.83 0.00 -1.26 -5.02 105.19 101.76 2hx7 n GLY 105 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2hx7 n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hx7 s GLU 106 N -0.07 3.77 -0.15 1.61 2.56 -0.97 -5.09 118.70 120.36 2hx7 s GLU 106 Ca 0.00 0.42 -0.05 0.00 0.00 0.00 0.00 54.97 55.34 2hx7 s GLU 106 Cb 0.00 -2.42 -0.04 0.00 2.00 0.00 0.00 34.13 33.67 2hx7 s GLU 106 CO 0.00 -0.00 0.03 -0.65 -0.56 0.00 0.00 175.26 174.07 2hx7 s GLN 107 N -3.79 3.60 0.12 4.30 -1.52 -1.26 -4.96 119.66 116.16 2hx7 s GLN 107 Ca 0.50 -0.39 0.09 0.00 -1.95 0.00 0.00 55.36 53.61 2hx7 s GLN 107 Cb -0.10 -3.02 -0.04 0.00 -0.22 0.00 0.00 33.01 29.63 2hx7 s GLN 107 CO 0.31 0.41 -0.22 0.71 -0.25 0.00 0.00 175.29 176.25 2hx7 s TYR 108 N -0.06 1.94 0.02 0.91 2.02 -1.25 -0.03 117.35 120.90 2hx7 s TYR 108 Ca 0.05 -0.41 0.05 0.00 -0.37 0.00 0.00 57.07 56.39 2hx7 s TYR 108 Cb -0.12 -1.04 -0.02 0.00 -0.40 0.00 0.00 41.96 40.38 2hx7 s TYR 108 CO 0.02 0.27 -0.16 -1.64 -1.57 0.00 0.00 175.55 172.47 2hx7 s MET 109 N -2.11 1.12 0.20 -0.62 -1.94 -0.48 -1.99 119.30 113.48 2hx7 s MET 109 Ca 0.10 -0.69 0.06 0.00 -1.71 0.00 0.00 55.69 53.46 2hx7 s MET 109 Cb -0.09 -1.13 -0.04 0.00 2.01 0.00 0.00 34.83 35.58 2hx7 s MET 109 CO 0.05 0.29 0.12 -0.59 -0.01 0.00 0.00 175.02 174.88 2hx7 s PHE 110 N -0.63 3.04 0.05 -0.03 -0.12 0.38 -2.23 117.98 118.44 2hx7 s PHE 110 Ca 0.04 -0.08 -0.28 0.00 -0.05 0.00 0.00 56.93 56.56 2hx7 s PHE 110 Cb -0.07 -1.43 0.09 0.00 -0.63 0.00 0.00 43.02 40.98 2hx7 s PHE 110 CO 0.01 0.53 0.98 -0.59 -0.05 0.00 0.00 175.22 176.10 2hx7 s PHE 111 N -1.91 -0.21 -0.33 3.49 -0.71 -0.23 -1.04 117.98 117.05 2hx7 s PHE 111 Ca 0.31 0.01 -0.16 0.00 -1.04 0.00 0.00 56.93 56.06 2hx7 s PHE 111 Cb -0.09 0.58 -0.02 0.00 -1.21 0.00 0.00 43.02 42.28 2hx7 s PHE 111 CO 0.23 -0.61 0.39 0.00 -1.34 0.00 0.00 175.22 173.89 2hx7 h SER 113 N 8.40 0.89 0.49 0.00 4.64 -1.87 0.10 113.55 126.21 2hx7 h SER 113 Ca -0.30 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 60.96 2hx7 h SER 113 Cb 1.14 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 2hx7 h SER 113 CO 0.70 0.64 -0.18 1.55 -0.87 0.00 0.00 176.83 178.67 2hx7 h PRO 114 N 1.06 0.00 -0.04 4.77 0.13 -1.90 -3.32 132.00 132.70 2hx7 h PRO 114 Ca 0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.42 2hx7 h PRO 114 Cb -0.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.02 2hx7 h PRO 114 CO -0.07 0.18 0.00 0.72 -0.23 0.00 0.00 178.00 178.61 2hx7 n HIS 115 N -3.67 0.05 -0.33 1.56 8.25 -1.02 -4.66 115.22 115.40 2hx7 n HIS 115 Ca -0.01 -0.27 0.10 0.00 -0.26 0.00 0.00 57.72 57.28 2hx7 n HIS 115 Cb 0.31 -0.02 0.30 0.00 1.12 0.00 0.00 29.99 31.70 2hx7 n HIS 115 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2hx7 h GLN 116 N 0.38 0.82 0.00 -0.41 -0.00 -0.91 -0.93 115.11 114.07 2hx7 h GLN 116 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2hx7 h GLN 116 Cb 0.33 -0.19 0.00 0.00 0.00 0.00 0.00 27.48 27.63 2hx7 h GLN 116 CO 0.00 0.55 0.00 0.41 0.00 0.00 0.00 178.83 179.79 2hx7 n GLY 117 N -1.37 -1.07 0.59 2.39 0.00 -1.26 -2.39 105.19 102.07 2hx7 n GLY 117 Ca 0.19 -0.09 0.06 0.00 0.00 0.00 0.00 46.02 46.19 2hx7 n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hx7 n ALA 118 N -1.36 2.46 0.00 4.61 0.00 -0.39 -4.99 120.51 120.83 2hx7 n ALA 118 Ca 0.08 -1.69 0.00 0.00 0.00 0.00 0.00 53.44 51.83 2hx7 n ALA 118 Cb 0.20 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.17 2hx7 n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hx7 n GLY 119 N -0.18 1.17 3.52 0.00 0.00 -1.00 -5.04 105.19 103.66 2hx7 n GLY 119 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2hx7 n GLY 119 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2hx7 s MET 120 N -0.17 3.91 0.04 1.61 -1.94 -1.00 -4.84 119.30 116.91 2hx7 s MET 120 Ca 0.00 -2.04 -0.28 0.00 -1.71 0.00 0.00 55.69 51.66 2hx7 s MET 120 Cb 0.00 -5.26 0.09 0.00 2.01 0.00 0.00 34.83 31.67 2hx7 s MET 120 CO 0.00 -2.01 0.98 -1.59 -0.01 0.00 0.00 175.02 172.39 2hx7 s LYS 121 N 3.20 0.89 0.11 2.03 -2.85 -1.26 -1.58 119.74 120.29 2hx7 s LYS 121 Ca 0.46 -0.42 -0.25 0.00 -1.00 0.00 0.00 55.97 54.75 2hx7 s LYS 121 Cb -0.00 0.35 0.08 0.00 -2.06 0.00 0.00 37.83 36.20 2hx7 s LYS 121 CO 0.00 -0.40 1.09 0.20 0.10 0.00 0.00 175.35 176.34 2hx7 s GLY 122 N -2.69 -0.14 0.40 0.59 0.00 -0.21 -4.73 107.32 100.54 2hx7 s GLY 122 Ca 0.09 0.08 -0.17 0.00 0.00 0.00 0.00 44.72 44.72 2hx7 s GLY 122 CO -0.04 1.34 0.86 -0.51 0.00 0.00 0.00 173.10 174.76 2hx7 s THR 123 N -2.61 4.54 -0.08 0.90 -4.23 -0.86 -0.47 115.64 112.84 2hx7 s THR 123 Ca 0.17 1.19 0.04 0.00 -1.18 0.00 0.00 61.69 61.91 2hx7 s THR 123 Cb -0.00 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.21 2hx7 s THR 123 CO 0.02 -0.33 -0.20 -0.22 -0.54 0.00 0.00 174.62 173.35 2hx7 s LEU 124 N -3.26 1.93 -0.03 4.79 0.20 -0.84 -0.97 118.68 120.49 2hx7 s LEU 124 Ca 0.58 -0.45 0.00 0.00 0.69 0.00 0.00 54.13 54.95 2hx7 s LEU 124 Cb -0.10 -1.17 0.03 0.00 -0.43 0.00 0.00 46.19 44.52 2hx7 s LEU 124 CO 0.18 0.13 0.00 -0.89 -0.29 0.00 0.00 176.35 175.48 2hx7 s THR 125 N 0.36 0.17 0.33 3.68 2.01 -0.65 -3.85 115.64 117.68 2hx7 s THR 125 Ca -0.14 0.09 -0.29 0.00 0.31 0.00 0.00 61.69 61.67 2hx7 s THR 125 Cb -0.16 -0.27 -0.10 0.00 0.01 0.00 0.00 72.50 71.98 2hx7 s THR 125 CO 0.06 0.14 1.27 -0.76 -0.69 0.00 0.00 174.62 174.65 2hx7 s LEU 126 N 1.04 4.43 0.00 4.42 1.43 -1.26 -0.76 118.68 127.99 2hx7 s LEU 126 Ca -0.09 2.62 0.00 0.00 -1.03 0.00 0.00 54.13 55.62 2hx7 s LEU 126 Cb -0.13 -3.67 0.00 0.00 0.03 0.00 0.00 46.19 42.42 2hx7 s LEU 126 CO -0.02 -0.49 0.08 1.17 0.23 0.00 0.00 176.35 177.32