#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hx7 s SER 4 N 0.00 -0.09 -0.01 0.00 0.15 -1.26 -1.94 113.70 110.56 2hx7 s SER 4 Ca 0.00 -0.16 -0.01 0.00 0.70 0.00 0.00 55.95 56.48 2hx7 s SER 4 Cb 0.00 0.31 0.01 0.00 -1.71 0.00 0.00 66.02 64.63 2hx7 s SER 4 CO 0.00 -0.53 0.03 0.54 1.20 0.00 0.00 173.24 174.47 2hx7 s VAL 5 N -2.13 -0.01 -0.20 4.45 0.11 -0.27 -4.95 120.40 117.41 2hx7 s VAL 5 Ca -0.08 0.04 -0.15 0.00 -2.93 0.00 0.00 61.98 58.86 2hx7 s VAL 5 Cb -0.03 -0.05 -0.04 0.00 -1.53 0.00 0.00 36.38 34.73 2hx7 s VAL 5 CO -0.01 0.02 0.38 -1.81 -3.33 0.00 0.00 175.10 170.35 2hx7 s ASP 6 N 0.22 6.42 -0.02 3.54 1.01 -1.26 -0.94 116.67 125.65 2hx7 s ASP 6 Ca -0.02 0.50 0.05 0.00 0.71 0.00 0.00 52.55 53.79 2hx7 s ASP 6 Cb -0.03 -2.22 -0.01 0.00 1.01 0.00 0.00 42.92 41.67 2hx7 s ASP 6 CO -0.01 -0.06 -0.19 -0.63 0.21 0.00 0.00 175.17 174.50 2hx7 s ILE 7 N 1.24 1.50 -0.02 0.77 -1.09 0.85 -4.95 121.20 119.49 2hx7 s ILE 7 Ca 0.18 -0.80 0.06 0.00 -2.23 0.00 0.00 60.65 57.87 2hx7 s ILE 7 Cb -0.15 -1.26 -0.02 0.00 -1.58 0.00 0.00 42.46 39.45 2hx7 s ILE 7 CO 0.08 0.43 -0.20 -1.10 -1.23 0.00 0.00 174.94 172.91 2hx7 s GLN 8 N -0.31 2.24 -0.09 2.79 1.11 -1.26 -1.18 119.66 122.97 2hx7 s GLN 8 Ca 0.04 -0.85 0.05 0.00 0.01 0.00 0.00 55.36 54.60 2hx7 s GLN 8 Cb -0.09 -2.19 -0.00 0.00 -1.01 0.00 0.00 33.01 29.72 2hx7 s GLN 8 CO 0.00 0.58 -0.24 0.20 0.01 0.00 0.00 175.29 175.84 2hx7 s GLY 9 N -0.79 1.32 0.10 3.09 0.00 -0.44 -1.27 107.32 109.34 2hx7 s GLY 9 Ca 0.11 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.85 2hx7 s GLY 9 CO 0.00 -0.42 0.10 1.16 0.00 0.00 0.00 173.10 173.95 2hx7 n ASN 10 N 3.36 0.99 0.00 1.64 0.23 -0.64 -3.67 115.26 117.18 2hx7 n ASN 10 Ca -0.19 -1.33 0.11 0.00 -0.53 0.00 0.00 54.58 52.64 2hx7 n ASN 10 Cb 0.53 -0.03 0.55 0.00 -2.08 0.00 0.00 39.78 38.74 2hx7 n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2hx7 n ASP 11 N -2.30 0.00 -1.02 0.53 8.00 -1.25 -3.38 116.55 117.13 2hx7 n ASP 11 Ca 0.01 -0.05 -0.03 0.00 0.71 0.00 0.00 54.79 55.43 2hx7 n ASP 11 Cb 0.11 -0.27 0.17 0.00 -0.02 0.00 0.00 41.12 41.11 2hx7 n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hx7 n GLN 12 N -1.27 2.08 -2.64 -1.24 1.13 -1.26 -4.96 117.38 109.21 2hx7 n GLN 12 Ca 0.10 -3.48 -0.18 0.00 -1.94 0.00 0.00 57.00 51.51 2hx7 n GLN 12 Cb 0.17 -1.80 0.01 0.00 0.11 0.00 0.00 30.24 28.73 2hx7 n GLN 12 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 2hx7 n MET 13 N -1.03 -2.89 -5.16 -1.09 2.81 -1.22 -4.99 117.12 103.55 2hx7 n MET 13 Ca 0.27 0.80 -0.31 0.00 -1.81 0.00 0.00 57.70 56.65 2hx7 n MET 13 Cb 0.81 -5.30 -0.17 0.00 -0.71 0.00 0.00 33.22 27.84 2hx7 n MET 13 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2hx7 s GLN 14 N -5.22 2.91 0.40 0.03 -0.21 -1.26 -4.30 119.66 112.02 2hx7 s GLN 14 Ca 0.14 -0.83 -0.16 0.00 0.02 0.00 0.00 55.36 54.53 2hx7 s GLN 14 Cb -0.06 -2.21 -0.09 0.00 1.00 0.00 0.00 33.01 31.65 2hx7 s GLN 14 CO 0.17 0.17 0.84 -0.06 -2.12 0.00 0.00 175.29 174.29 2hx7 s PHE 15 N 0.37 3.40 -1.13 0.91 0.08 -1.26 -1.62 117.98 118.73 2hx7 s PHE 15 Ca -0.19 1.32 0.22 0.00 0.12 0.00 0.00 56.93 58.41 2hx7 s PHE 15 Cb -0.18 -2.64 1.00 0.00 -0.57 0.00 0.00 43.02 40.64 2hx7 s PHE 15 CO 0.08 -0.09 1.72 0.27 -0.10 0.00 0.00 175.22 177.10 2hx7 n ASN 16 N -0.88 0.00 -3.95 1.36 6.94 -0.39 -4.73 115.26 113.61 2hx7 n ASN 16 Ca 0.05 0.33 -0.10 0.00 -0.02 0.00 0.00 54.58 54.84 2hx7 n ASN 16 Cb 0.54 -0.43 -0.11 0.00 -2.36 0.00 0.00 39.78 37.41 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 -2.87 0.10 -0.14 5.53 -1.32 -1.26 -5.02 115.64 110.66 2hx7 s THR 17 Ca 0.14 -0.81 0.11 0.00 -1.21 0.00 0.00 61.69 59.91 2hx7 s THR 17 Cb 0.15 -0.29 0.20 0.00 -1.51 0.00 0.00 72.50 71.04 2hx7 s THR 17 CO 0.38 -0.45 1.12 -0.46 -2.21 0.00 0.00 174.62 173.01 2hx7 n ASN 18 N 1.63 2.38 -3.32 8.08 0.23 -1.26 -4.86 115.26 118.14 2hx7 n ASN 18 Ca -0.23 -2.57 -0.07 0.00 -0.53 0.00 0.00 54.58 51.18 2hx7 n ASN 18 Cb 0.55 -0.25 -0.07 0.00 -2.08 0.00 0.00 39.78 37.93 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 -1.99 -1.28 -0.10 -2.53 0.00 -1.26 -1.17 121.76 113.43 2hx7 s ALA 19 Ca 0.19 1.04 -0.03 0.00 0.00 0.00 0.00 51.96 53.16 2hx7 s ALA 19 Cb 0.16 -1.77 -0.03 0.00 0.00 0.00 0.00 23.12 21.48 2hx7 s ALA 19 CO 0.03 -1.29 0.02 0.42 0.00 0.00 0.00 175.76 174.94 2hx7 s ILE 20 N 2.60 4.42 -0.10 0.00 1.01 0.28 -4.98 121.20 124.43 2hx7 s ILE 20 Ca 0.14 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.61 2hx7 s ILE 20 Cb -0.15 -2.89 -0.01 0.00 0.01 0.00 0.00 42.46 39.42 2hx7 s ILE 20 CO -0.17 0.58 -0.16 0.42 0.00 0.00 0.00 174.94 175.61 2hx7 s THR 21 N -0.66 2.77 -0.24 2.92 -4.23 -1.26 -1.15 115.64 113.79 2hx7 s THR 21 Ca 0.11 -0.78 -0.05 0.00 -1.18 0.00 0.00 61.69 59.79 2hx7 s THR 21 Cb -0.12 -2.12 -0.01 0.00 1.34 0.00 0.00 72.50 71.60 2hx7 s THR 21 CO 0.02 0.55 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.95 2hx7 s VAL 22 N 0.12 3.59 0.10 2.29 1.01 0.18 -4.94 120.40 122.74 2hx7 s VAL 22 Ca -0.08 -0.49 -0.31 0.00 0.00 0.00 0.00 61.98 61.09 2hx7 s VAL 22 Cb -0.15 -2.68 -0.09 0.00 0.00 0.00 0.00 36.38 33.46 2hx7 s VAL 22 CO 0.05 0.35 1.58 -0.62 0.00 0.00 0.00 175.10 176.46 2hx7 s ASP 23 N 1.50 6.64 0.53 3.32 -1.08 -1.26 -1.10 116.67 125.21 2hx7 s ASP 23 Ca 0.05 2.48 0.35 0.00 -0.52 0.00 0.00 52.55 54.91 2hx7 s ASP 23 Cb -0.15 -2.57 1.91 0.00 -1.46 0.00 0.00 42.92 40.65 2hx7 s ASP 23 CO -0.01 -0.83 2.09 0.07 0.52 0.00 0.00 175.17 177.00 2hx7 h LYS 24 N 7.69 0.00 0.00 4.34 5.09 -0.27 -1.10 116.57 132.32 2hx7 h LYS 24 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.32 2hx7 h LYS 24 Cb 1.20 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.53 2hx7 h LYS 24 CO 0.92 0.00 -0.06 -1.13 -2.09 0.00 0.00 179.45 177.09 2hx7 n SER 25 N -2.76 0.82 -4.76 7.07 3.41 -1.26 -4.84 113.62 111.29 2hx7 n SER 25 Ca -0.02 0.53 -0.41 0.00 -0.26 0.00 0.00 58.87 58.71 2hx7 n SER 25 Cb 0.07 -0.71 -0.02 0.00 -0.26 0.00 0.00 64.21 63.29 2hx7 n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hx7 h LYS 27 N 3.87 0.39 -5.37 0.00 1.79 -1.89 -3.42 116.57 111.95 2hx7 h LYS 27 Ca -0.48 -0.67 -0.40 0.00 -2.18 0.00 0.00 60.65 56.91 2hx7 h LYS 27 Cb 1.22 0.25 -0.14 0.00 -1.58 0.00 0.00 32.23 31.98 2hx7 h LYS 27 CO 0.69 1.32 -0.72 -0.65 -1.08 0.00 0.00 179.45 179.01 2hx7 s GLN 28 N -2.58 1.24 -0.01 3.15 -0.21 -1.26 -0.75 119.66 119.24 2hx7 s GLN 28 Ca -0.16 -1.55 0.02 0.00 0.02 0.00 0.00 55.36 53.70 2hx7 s GLN 28 Cb 0.05 -0.93 -0.00 0.00 1.00 0.00 0.00 33.01 33.13 2hx7 s GLN 28 CO 0.85 0.14 -0.07 0.12 -2.12 0.00 0.00 175.29 174.21 2hx7 s PHE 29 N -3.11 0.67 -0.05 0.91 5.36 -0.10 -4.83 117.98 116.82 2hx7 s PHE 29 Ca 0.21 -0.13 0.05 0.00 -0.96 0.00 0.00 56.93 56.10 2hx7 s PHE 29 Cb 0.01 -0.44 -0.01 0.00 -0.34 0.00 0.00 43.02 42.24 2hx7 s PHE 29 CO 0.05 -0.02 -0.21 0.99 -1.46 0.00 0.00 175.22 174.56 2hx7 s THR 30 N -0.13 1.77 -0.17 0.12 2.01 -0.82 -1.04 115.64 117.38 2hx7 s THR 30 Ca 0.02 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 2hx7 s THR 30 Cb -0.03 -1.51 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 2hx7 s THR 30 CO -0.00 0.50 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.63 2hx7 s VAL 31 N -0.04 3.09 -0.42 3.82 1.01 0.07 -1.11 120.40 126.83 2hx7 s VAL 31 Ca -0.05 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.21 2hx7 s VAL 31 Cb -0.13 -2.34 0.06 0.00 0.00 0.00 0.00 36.38 33.97 2hx7 s VAL 31 CO 0.03 0.49 0.27 0.20 0.00 0.00 0.00 175.10 176.09 2hx7 s ASN 32 N 0.89 5.75 -0.06 3.32 0.01 -0.11 -1.45 114.94 123.28 2hx7 s ASN 32 Ca -0.03 -1.33 -0.13 0.00 -0.71 0.00 0.00 52.86 50.66 2hx7 s ASN 32 Cb -0.15 -2.03 -0.05 0.00 0.41 0.00 0.00 41.25 39.43 2hx7 s ASN 32 CO 0.00 -0.51 0.34 -0.22 -1.51 0.00 0.00 177.10 175.20 2hx7 s LEU 33 N 1.50 4.40 0.23 0.60 2.96 0.48 -0.11 118.68 128.74 2hx7 s LEU 33 Ca 0.03 0.77 0.01 0.00 -0.22 0.00 0.00 54.13 54.71 2hx7 s LEU 33 Cb -0.22 -2.45 -0.04 0.00 0.50 0.00 0.00 46.19 43.98 2hx7 s LEU 33 CO 0.04 0.27 0.18 -0.94 -1.32 0.00 0.00 176.35 174.58 2hx7 s SER 34 N -0.64 0.49 -0.40 3.68 1.04 -0.32 -1.60 113.70 115.95 2hx7 s SER 34 Ca 0.21 -1.46 0.03 0.00 0.48 0.00 0.00 55.95 55.21 2hx7 s SER 34 Cb -0.15 0.43 0.16 0.00 0.10 0.00 0.00 66.02 66.56 2hx7 s SER 34 CO 0.09 -0.90 0.35 -2.28 0.98 0.00 0.00 173.24 171.48 2hx7 s HIS 35 N -3.98 0.61 0.96 5.02 2.46 -1.24 -1.33 115.29 117.79 2hx7 s HIS 35 Ca 0.39 -1.85 -0.12 0.00 0.47 0.00 0.00 55.06 53.95 2hx7 s HIS 35 Cb 0.06 -0.75 0.12 0.00 -0.13 0.00 0.00 32.58 31.88 2hx7 s HIS 35 CO 0.16 -0.88 0.84 -2.30 -2.47 0.00 0.00 174.74 170.08 2hx7 n PRO 36 N 3.27 -0.66 0.00 2.88 -0.02 -1.24 -2.06 135.00 137.18 2hx7 n PRO 36 Ca 0.23 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2hx7 n PRO 36 Cb 0.46 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 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 0.82 -0.86 0.00 -1.23 0.00 -1.26 -3.93 105.19 98.74 2hx7 n GLY 37 Ca 0.09 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.97 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 0.23 -4.82 1.61 4.13 -1.26 -4.62 115.26 110.53 2hx7 n ASN 38 Ca 0.00 -0.65 -0.38 0.00 1.68 0.00 0.00 54.58 55.23 2hx7 n ASN 38 Cb 0.00 0.19 -0.06 0.00 -1.54 0.00 0.00 39.78 38.36 2hx7 n ASN 38 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2hx7 s LEU 39 N -0.37 4.43 0.83 3.41 1.43 -1.26 -4.85 118.68 122.30 2hx7 s LEU 39 Ca 0.00 0.88 -0.13 0.00 -1.03 0.00 0.00 54.13 53.85 2hx7 s LEU 39 Cb 0.00 -2.55 0.10 0.00 0.03 0.00 0.00 46.19 43.77 2hx7 s LEU 39 CO 0.00 0.27 1.20 -2.16 0.23 0.00 0.00 176.35 175.89 2hx7 s PRO 40 N -0.73 1.75 0.54 1.29 0.04 -1.26 -0.81 135.00 135.83 2hx7 s PRO 40 Ca 0.23 0.02 0.33 0.00 0.04 0.00 0.00 61.00 61.62 2hx7 s PRO 40 Cb -0.16 -1.94 1.37 0.00 0.04 0.00 0.00 34.50 33.81 2hx7 s PRO 40 CO 0.12 -1.72 1.99 1.57 0.04 0.00 0.00 177.00 178.99 2hx7 h LYS 41 N -1.15 0.00 -0.08 4.56 2.10 -1.83 0.01 116.57 120.19 2hx7 h LYS 41 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2hx7 h LYS 41 Cb 1.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 2hx7 h LYS 41 CO 0.62 0.03 0.00 0.27 -2.00 0.00 0.00 179.45 178.37 2hx7 n ASN 42 N -3.14 0.77 -0.02 7.07 6.94 -1.26 -2.21 115.26 123.41 2hx7 n ASN 42 Ca 0.00 -1.55 -0.04 0.00 -0.02 0.00 0.00 54.58 52.97 2hx7 n ASN 42 Cb 0.31 -0.05 -0.01 0.00 -2.36 0.00 0.00 39.78 37.66 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 -0.28 0.22 -3.07 3.53 0.31 -0.33 -4.94 118.33 113.77 2hx7 n VAL 43 Ca 0.15 -0.06 -0.16 0.00 -0.01 0.00 0.00 64.34 64.26 2hx7 n VAL 43 Cb 0.19 -1.43 -0.00 0.00 -0.91 0.00 0.00 33.84 31.68 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 -3.10 1.00 -3.10 5.55 0.00 -0.16 -5.02 117.12 112.28 2hx7 n MET 44 Ca -0.08 -3.13 -0.34 0.00 -0.00 0.00 0.00 57.70 54.15 2hx7 n MET 44 Cb 0.56 -1.54 -0.06 0.00 0.00 0.00 0.00 33.22 32.17 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 -2.29 2.48 0.01 -5.12 0.00 -0.94 -4.68 107.32 96.78 2hx7 s GLY 45 Ca 0.36 0.12 0.05 0.00 0.00 0.00 0.00 44.72 45.25 2hx7 s GLY 45 CO -0.07 0.41 -0.14 0.30 0.00 0.00 0.00 173.10 173.60 2hx7 s HIS 46 N -1.75 1.25 0.46 1.90 3.76 -0.11 -4.85 115.29 115.94 2hx7 s HIS 46 Ca 0.49 -0.29 0.04 0.00 -0.15 0.00 0.00 55.06 55.14 2hx7 s HIS 46 Cb -0.14 -0.77 -0.04 0.00 1.11 0.00 0.00 32.58 32.74 2hx7 s HIS 46 CO 0.19 0.01 0.01 0.54 -0.85 0.00 0.00 174.74 174.64 2hx7 s ASN 47 N -0.72 3.96 -0.15 1.40 2.20 -1.26 -0.35 114.94 120.02 2hx7 s ASN 47 Ca 0.04 -1.53 0.01 0.00 -0.94 0.00 0.00 52.86 50.43 2hx7 s ASN 47 Cb -0.07 0.12 0.02 0.00 -2.00 0.00 0.00 41.25 39.33 2hx7 s ASN 47 CO 0.00 -0.68 -0.15 0.86 -2.94 0.00 0.00 177.10 174.19 2hx7 s TRP 48 N -2.82 2.26 -0.02 1.54 -0.00 -1.26 -3.93 118.94 114.71 2hx7 s TRP 48 Ca 0.19 -1.28 0.04 0.00 -0.00 0.00 0.00 56.10 55.06 2hx7 s TRP 48 Cb 0.05 -1.64 -0.01 0.00 -0.00 0.00 0.00 33.47 31.87 2hx7 s TRP 48 CO 0.10 -0.68 -0.15 0.08 -0.00 0.00 0.00 176.95 176.29 2hx7 s VAL 49 N 1.42 1.22 -0.08 5.86 1.01 0.27 -1.05 120.40 129.06 2hx7 s VAL 49 Ca 0.04 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.44 2hx7 s VAL 49 Cb -0.13 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 2hx7 s VAL 49 CO -0.11 0.35 -0.24 -0.22 0.00 0.00 0.00 175.10 174.89 2hx7 s LEU 50 N -0.17 2.12 0.29 3.92 2.96 -0.39 -1.12 118.68 126.28 2hx7 s LEU 50 Ca 0.02 -0.52 -0.11 0.00 -0.22 0.00 0.00 54.13 53.31 2hx7 s LEU 50 Cb -0.08 -1.40 0.00 0.00 0.50 0.00 0.00 46.19 45.22 2hx7 s LEU 50 CO 0.00 0.21 0.52 -0.94 -1.32 0.00 0.00 176.35 174.82 2hx7 s SER 51 N 0.03 0.18 0.80 3.68 1.04 -0.77 -0.50 113.70 118.15 2hx7 s SER 51 Ca -0.09 -1.09 -0.11 0.00 0.48 0.00 0.00 55.95 55.13 2hx7 s SER 51 Cb -0.15 0.64 0.08 0.00 0.10 0.00 0.00 66.02 66.69 2hx7 s SER 51 CO 0.06 -1.25 1.12 0.42 0.98 0.00 0.00 173.24 174.57 2hx7 s THR 52 N -3.57 2.79 0.30 2.02 -4.23 -1.26 -1.16 115.64 110.52 2hx7 s THR 52 Ca 0.24 0.28 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 2hx7 s THR 52 Cb -0.01 -2.62 0.28 0.00 1.34 0.00 0.00 72.50 71.49 2hx7 s THR 52 CO 0.12 -0.31 1.91 0.00 -0.54 0.00 0.00 174.62 175.80 2hx7 h ALA 53 N -1.18 1.50 -0.22 3.99 0.00 -1.05 -2.52 119.26 119.77 2hx7 h ALA 53 Ca -0.44 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2hx7 h ALA 53 Cb 1.25 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2hx7 h ALA 53 CO 0.48 0.37 -0.17 0.00 0.00 0.00 0.00 179.25 179.92 2hx7 h ALA 54 N 1.50 1.29 0.00 0.00 0.00 -1.91 -2.94 119.26 117.20 2hx7 h ALA 54 Ca 0.39 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2hx7 h ALA 54 Cb 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2hx7 h ALA 54 CO -0.15 0.47 -0.45 -0.25 0.00 0.00 0.00 179.25 178.88 2hx7 n ASP 55 N -4.19 0.66 -0.11 0.00 8.00 -0.99 -4.39 116.55 115.53 2hx7 n ASP 55 Ca -0.00 0.20 -0.05 0.00 0.71 0.00 0.00 54.79 55.64 2hx7 n ASP 55 Cb 0.33 -0.07 0.01 0.00 -0.02 0.00 0.00 41.12 41.38 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 0.03 -0.54 -1.24 1.85 -1.27 -1.65 114.93 112.12 2hx7 h MET 56 Ca 0.00 -0.00 0.03 0.00 -0.61 0.00 0.00 59.70 59.12 2hx7 h MET 56 Cb 0.70 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 32.69 2hx7 h MET 56 CO 0.00 0.02 0.31 0.37 -0.40 0.00 0.00 176.91 177.22 2hx7 h GLN 57 N 0.03 0.60 -0.42 0.39 5.75 -1.78 -1.45 115.11 118.23 2hx7 h GLN 57 Ca 0.18 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.60 2hx7 h GLN 57 Cb 0.27 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 2hx7 h GLN 57 CO -0.35 0.40 0.11 0.78 -2.65 0.00 0.00 178.83 177.11 2hx7 h GLY 58 N 0.62 0.71 0.58 2.39 0.00 -1.75 0.20 103.07 105.82 2hx7 h GLY 58 Ca 0.22 -0.44 0.07 0.00 0.00 0.00 0.00 47.33 47.18 2hx7 h GLY 58 CO -0.11 0.41 0.27 -2.08 0.00 0.00 0.00 176.54 175.03 2hx7 h VAL 59 N 0.53 0.88 0.18 4.60 2.07 -1.06 0.06 116.25 123.51 2hx7 h VAL 59 Ca 0.13 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2hx7 h VAL 59 Cb 0.31 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2hx7 h VAL 59 CO 0.00 0.09 -0.09 0.58 0.02 0.00 0.00 177.57 178.18 2hx7 h VAL 60 N 0.50 0.93 -0.28 2.57 2.07 -0.93 0.64 116.25 121.75 2hx7 h VAL 60 Ca 0.27 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 67.16 2hx7 h VAL 60 Cb 0.25 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2hx7 h VAL 60 CO -0.22 0.15 0.07 0.74 0.02 0.00 0.00 177.57 178.33 2hx7 h THR 61 N -0.57 0.89 -0.08 2.57 2.02 -0.83 0.48 112.91 117.39 2hx7 h THR 61 Ca -0.02 -0.06 -0.14 0.00 0.77 0.00 0.00 66.41 66.95 2hx7 h THR 61 Cb 0.43 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 2hx7 h THR 61 CO 0.04 0.03 -0.59 0.44 0.37 0.00 0.00 175.52 175.82 2hx7 h ASP 62 N 0.19 0.31 -0.13 4.18 3.32 -1.00 -2.02 116.42 121.26 2hx7 h ASP 62 Ca 0.13 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 2hx7 h ASP 62 Cb 0.12 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 2hx7 h ASP 62 CO -0.15 0.82 0.01 1.23 -1.72 0.00 0.00 179.24 179.44 2hx7 h GLY 63 N 1.41 0.24 0.77 2.75 0.00 -0.62 -2.14 103.07 105.48 2hx7 h GLY 63 Ca -0.00 -0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.21 2hx7 h GLY 63 CO 0.09 0.15 0.51 -0.33 0.00 0.00 0.00 176.54 176.97 2hx7 h MET 64 N -0.02 0.93 -0.27 4.80 2.86 -0.85 -2.04 114.93 120.34 2hx7 h MET 64 Ca 0.04 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.56 2hx7 h MET 64 Cb 0.32 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 2hx7 h MET 64 CO 0.00 0.62 -0.10 0.00 1.06 0.00 0.00 176.91 178.50 2hx7 h ALA 65 N 1.38 1.34 0.00 6.32 0.00 -1.27 -2.12 119.26 124.90 2hx7 h ALA 65 Ca 0.35 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2hx7 h ALA 65 Cb 0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2hx7 h ALA 65 CO -0.15 0.45 -0.34 0.77 0.00 0.00 0.00 179.25 179.98 2hx7 h SER 66 N 0.42 0.00 -4.24 0.00 0.02 -0.70 -3.49 113.55 105.56 2hx7 h SER 66 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2hx7 h SER 66 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2hx7 h SER 66 CO 0.02 0.34 0.00 0.61 -1.14 0.00 0.00 176.83 176.66 2hx7 n GLY 67 N -0.31 -0.96 0.37 -3.77 0.00 -0.80 -4.10 105.19 95.62 2hx7 n GLY 67 Ca -0.01 -1.66 0.07 0.00 0.00 0.00 0.00 46.02 44.41 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 0.85 -1.27 0.99 5.85 -1.90 0.32 115.31 120.15 2hx7 h LEU 68 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2hx7 h LEU 68 Cb 0.00 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.88 2hx7 h LEU 68 CO 0.00 0.49 0.00 -2.24 -0.34 0.00 0.00 178.44 176.35 2hx7 h ASP 69 N 0.94 0.00 -0.12 1.25 2.03 -2.00 -1.22 116.42 117.29 2hx7 h ASP 69 Ca 0.44 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.74 2hx7 h ASP 69 Cb 0.41 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.91 2hx7 h ASP 69 CO -0.20 0.00 0.00 0.29 -1.03 0.00 0.00 179.24 178.30 2hx7 n LYS 70 N -2.33 2.05 -2.65 4.15 5.02 -0.47 -4.96 118.16 118.97 2hx7 n LYS 70 Ca -0.00 -2.70 -0.20 0.00 -2.02 0.00 0.00 58.31 53.39 2hx7 n LYS 70 Cb 0.11 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 2hx7 n LYS 70 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2hx7 n ASP 71 N -1.00 -5.52 -2.95 4.39 9.92 -0.46 -2.34 116.55 118.59 2hx7 n ASP 71 Ca 0.18 -0.09 -0.22 0.00 -0.53 0.00 0.00 54.79 54.14 2hx7 n ASP 71 Cb 0.76 -4.56 0.02 0.00 -0.64 0.00 0.00 41.12 36.69 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 -4.06 -1.76 -4.36 1.24 4.01 -0.02 -4.77 117.16 107.43 2hx7 n TYR 72 Ca -0.18 0.40 -0.19 0.00 -0.16 0.00 0.00 57.90 57.78 2hx7 n TYR 72 Cb 0.65 -4.02 -0.15 0.00 -0.31 0.00 0.00 39.34 35.51 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 -6.48 2.02 0.14 7.72 1.43 -0.99 -4.04 118.68 118.48 2hx7 s LEU 73 Ca 0.25 -0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 52.87 2hx7 s LEU 73 Cb -0.12 -0.46 -0.09 0.00 0.03 0.00 0.00 46.19 45.55 2hx7 s LEU 73 CO 0.31 0.10 1.51 -0.75 0.23 0.00 0.00 176.35 177.76 2hx7 s LYS 74 N -0.26 4.25 0.43 1.70 2.20 -1.26 -4.83 119.74 121.97 2hx7 s LYS 74 Ca 0.03 2.26 -0.25 0.00 -0.36 0.00 0.00 55.97 57.65 2hx7 s LYS 74 Cb -0.04 -3.22 -0.10 0.00 -1.51 0.00 0.00 37.83 32.96 2hx7 s LYS 74 CO -0.00 -0.56 1.18 -2.30 -0.36 0.00 0.00 175.35 173.31 2hx7 n PRO 75 N 4.10 1.70 -4.18 4.03 -0.02 -1.26 -2.72 135.00 136.66 2hx7 n PRO 75 Ca 0.13 0.61 -0.33 0.00 -2.02 0.00 0.00 63.50 61.89 2hx7 n PRO 75 Cb 0.40 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.57 2hx7 n PRO 75 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2hx7 n ASP 76 N 0.25 -1.77 -4.61 2.55 2.03 -1.26 -4.86 116.55 108.87 2hx7 n ASP 76 Ca 0.08 -1.06 -0.43 0.00 0.52 0.00 0.00 54.79 53.90 2hx7 n ASP 76 Cb 0.40 -2.61 -0.02 0.00 -0.72 0.00 0.00 41.12 38.16 2hx7 n ASP 76 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2hx7 s ASP 77 N -3.75 6.48 0.47 1.67 -1.08 -1.10 -4.88 116.67 114.48 2hx7 s ASP 77 Ca 0.44 1.01 0.32 0.00 -0.52 0.00 0.00 52.55 53.80 2hx7 s ASP 77 Cb -0.24 -2.54 1.53 0.00 -1.46 0.00 0.00 42.92 40.21 2hx7 s ASP 77 CO 0.93 -1.28 1.96 0.77 0.52 0.00 0.00 175.17 178.08 2hx7 h SER 78 N 10.10 0.00 1.22 -0.34 4.64 -1.92 -2.60 113.55 124.65 2hx7 h SER 78 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2hx7 h SER 78 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2hx7 h SER 78 CO 1.06 0.00 -0.28 0.54 -0.87 0.00 0.00 176.83 177.28 2hx7 n ARG 79 N -2.71 0.28 -2.97 4.77 1.74 -1.26 -4.76 116.66 111.76 2hx7 n ARG 79 Ca -0.00 0.16 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 2hx7 n ARG 79 Cb 0.16 -1.76 -0.05 0.00 -1.02 0.00 0.00 32.46 29.79 2hx7 n ARG 79 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2hx7 s VAL 80 N -3.13 4.61 0.17 1.55 1.01 -0.98 -4.47 120.40 119.16 2hx7 s VAL 80 Ca 0.09 0.18 -0.09 0.00 0.00 0.00 0.00 61.98 62.15 2hx7 s VAL 80 Cb 0.13 -4.39 0.04 0.00 0.00 0.00 0.00 36.38 32.16 2hx7 s VAL 80 CO 0.65 -0.86 1.61 0.40 0.00 0.00 0.00 175.10 176.89 2hx7 h ILE 81 N 5.97 1.27 -1.99 2.22 2.04 -1.09 -3.46 117.51 122.46 2hx7 h ILE 81 Ca -0.26 -1.25 -0.04 0.00 1.00 0.00 0.00 64.86 64.32 2hx7 h ILE 81 Cb 1.08 0.92 -0.19 0.00 -0.74 0.00 0.00 36.82 37.89 2hx7 h ILE 81 CO 1.00 0.45 0.25 0.00 0.00 0.00 0.00 178.15 179.84 2hx7 s ALA 82 N -4.89 -1.79 -0.04 1.87 0.00 -1.24 -5.02 121.76 110.66 2hx7 s ALA 82 Ca -0.12 1.32 -0.30 0.00 0.00 0.00 0.00 51.96 52.86 2hx7 s ALA 82 Cb 0.13 -0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.26 2hx7 s ALA 82 CO 0.86 -0.38 0.67 -3.38 0.00 0.00 0.00 175.76 173.53 2hx7 s HIS 83 N -1.32 -0.64 0.83 0.00 -3.43 -1.26 -1.27 115.29 108.20 2hx7 s HIS 83 Ca -0.09 1.06 -0.08 0.00 -0.80 0.00 0.00 55.06 55.16 2hx7 s HIS 83 Cb -0.00 0.41 0.16 0.00 -1.43 0.00 0.00 32.58 31.71 2hx7 s HIS 83 CO 0.07 -0.62 1.14 0.95 -2.00 0.00 0.00 174.74 174.29 2hx7 s THR 84 N -1.33 2.08 0.86 -5.38 -4.23 -0.21 -4.84 115.64 102.58 2hx7 s THR 84 Ca -0.10 -0.30 -0.13 0.00 -1.18 0.00 0.00 61.69 59.97 2hx7 s THR 84 Cb -0.00 -2.78 0.12 0.00 1.34 0.00 0.00 72.50 71.19 2hx7 s THR 84 CO 0.09 0.00 1.22 -1.59 -0.54 0.00 0.00 174.62 173.79 2hx7 s LYS 85 N -5.49 1.48 0.04 3.99 -2.85 -1.26 -4.59 119.74 111.07 2hx7 s LYS 85 Ca 0.69 -0.15 -0.28 0.00 -1.00 0.00 0.00 55.97 55.24 2hx7 s LYS 85 Cb -0.05 -1.94 -0.05 0.00 -2.06 0.00 0.00 37.83 33.73 2hx7 s LYS 85 CO 0.48 -1.87 0.88 -1.17 0.10 0.00 0.00 175.35 173.77 2hx7 s LEU 86 N -5.66 4.43 0.07 2.77 2.96 -1.26 -4.39 118.68 117.60 2hx7 s LEU 86 Ca 0.66 1.59 0.06 0.00 -0.22 0.00 0.00 54.13 56.23 2hx7 s LEU 86 Cb -0.08 -3.43 -0.03 0.00 0.50 0.00 0.00 46.19 43.15 2hx7 s LEU 86 CO 0.50 -0.10 -0.16 0.27 -1.32 0.00 0.00 176.35 175.54 2hx7 s ILE 87 N 0.34 1.24 0.53 6.68 -4.36 0.53 -4.90 121.20 121.26 2hx7 s ILE 87 Ca 0.45 -1.32 0.07 0.00 -0.26 0.00 0.00 60.65 59.59 2hx7 s ILE 87 Cb -0.21 -1.17 0.04 0.00 1.25 0.00 0.00 42.46 42.37 2hx7 s ILE 87 CO 0.26 -0.16 0.48 -0.83 0.24 0.00 0.00 174.94 174.94 2hx7 s GLY 88 N -1.69 2.20 0.30 6.27 0.00 -1.26 -0.94 107.32 112.20 2hx7 s GLY 88 Ca 0.00 -1.56 -0.29 0.00 0.00 0.00 0.00 44.72 42.87 2hx7 s GLY 88 CO 0.03 -1.85 1.39 -1.14 0.00 0.00 0.00 173.10 171.52 2hx7 n SER 89 N -1.83 2.99 0.00 1.64 3.41 0.01 -1.58 113.62 118.27 2hx7 n SER 89 Ca 0.03 1.18 0.00 0.00 -0.26 0.00 0.00 58.87 59.82 2hx7 n SER 89 Cb 0.63 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.09 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 1.41 2.35 3.96 5.00 0.00 -0.87 -4.92 105.19 112.12 2hx7 n GLY 90 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.31 2.70 -0.01 1.61 2.02 -0.61 -4.99 118.70 119.11 2hx7 s GLU 91 Ca 0.00 -0.56 -0.17 0.00 0.02 0.00 0.00 54.97 54.25 2hx7 s GLU 91 Cb 0.00 -2.46 0.03 0.00 0.10 0.00 0.00 34.13 31.81 2hx7 s GLU 91 CO 0.00 -0.63 0.37 0.15 0.02 0.00 0.00 175.26 175.17 2hx7 s LYS 92 N -4.77 0.75 -0.07 1.61 3.01 -1.26 -3.72 119.74 115.30 2hx7 s LYS 92 Ca 0.54 -0.16 -0.22 0.00 -1.01 0.00 0.00 55.97 55.12 2hx7 s LYS 92 Cb -0.10 0.34 0.05 0.00 -1.01 0.00 0.00 37.83 37.10 2hx7 s LYS 92 CO 0.40 -0.22 0.50 0.34 0.51 0.00 0.00 175.35 176.88 2hx7 s ASP 93 N -1.42 -0.45 0.14 2.83 2.15 -0.63 -5.03 116.67 114.27 2hx7 s ASP 93 Ca -0.12 0.55 0.10 0.00 0.43 0.00 0.00 52.55 53.51 2hx7 s ASP 93 Cb -0.04 0.57 -0.04 0.00 -0.30 0.00 0.00 42.92 43.11 2hx7 s ASP 93 CO 0.04 -0.45 -0.24 -0.44 -0.17 0.00 0.00 175.17 173.91 2hx7 s SER 94 N -0.92 3.11 -0.00 -0.34 0.01 -1.26 -0.39 113.70 113.91 2hx7 s SER 94 Ca -0.10 -0.78 0.01 0.00 1.31 0.00 0.00 55.95 56.40 2hx7 s SER 94 Cb -0.03 -0.20 -0.00 0.00 0.21 0.00 0.00 66.02 65.99 2hx7 s SER 94 CO 0.06 0.12 -0.04 0.54 0.41 0.00 0.00 173.24 174.32 2hx7 s VAL 95 N -1.34 0.33 -0.02 3.43 0.11 -0.53 -4.88 120.40 117.49 2hx7 s VAL 95 Ca 0.14 -0.19 0.07 0.00 -2.93 0.00 0.00 61.98 59.07 2hx7 s VAL 95 Cb -0.09 -0.28 -0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2hx7 s VAL 95 CO 0.07 0.08 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.80 2hx7 s THR 96 N -0.12 1.83 0.05 5.04 2.01 -1.26 -0.75 115.64 122.45 2hx7 s THR 96 Ca 0.01 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 61.01 2hx7 s THR 96 Cb -0.02 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.93 2hx7 s THR 96 CO -0.00 0.52 -0.01 0.72 -0.69 0.00 0.00 174.62 175.15 2hx7 s PHE 97 N -0.47 0.49 0.01 4.92 -0.71 -0.21 -4.96 117.98 117.04 2hx7 s PHE 97 Ca 0.07 -1.02 -0.30 0.00 -1.04 0.00 0.00 56.93 54.64 2hx7 s PHE 97 Cb -0.10 -0.36 -0.03 0.00 -1.21 0.00 0.00 43.02 41.32 2hx7 s PHE 97 CO -0.00 -0.39 1.01 -0.51 -1.34 0.00 0.00 175.22 173.99 2hx7 s ASP 98 N -2.87 7.33 0.61 1.98 1.01 -1.26 -0.92 116.67 122.55 2hx7 s ASP 98 Ca 0.06 1.71 0.38 0.00 0.71 0.00 0.00 52.55 55.41 2hx7 s ASP 98 Cb 0.07 -2.57 1.96 0.00 1.01 0.00 0.00 42.92 43.39 2hx7 s ASP 98 CO -0.10 -0.29 2.22 0.58 0.21 0.00 0.00 175.17 177.80 2hx7 h VAL 99 N 4.76 0.14 0.00 -1.27 2.07 -1.20 -0.56 116.25 120.19 2hx7 h VAL 99 Ca -0.41 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2hx7 h VAL 99 Cb 1.22 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 2hx7 h VAL 99 CO 0.76 0.02 0.00 0.77 0.02 0.00 0.00 177.57 179.14 2hx7 h SER 100 N 0.00 0.00 1.06 0.57 4.64 -1.89 -0.82 113.55 117.11 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 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2hx7 h SER 100 CO 0.00 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.07 2hx7 h LYS 101 N 0.00 0.00 -5.81 4.77 1.79 -1.48 -3.44 116.57 112.41 2hx7 h LYS 101 Ca 0.00 0.00 -0.66 0.00 -2.18 0.00 0.00 60.65 57.81 2hx7 h LYS 101 Cb 0.06 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.62 2hx7 h LYS 101 CO 0.00 0.00 -0.52 -0.51 -1.08 0.00 0.00 179.45 177.34 2hx7 s LEU 102 N -5.01 4.16 0.14 2.94 1.43 -0.32 -5.11 118.68 116.91 2hx7 s LEU 102 Ca 0.05 0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.56 2hx7 s LEU 102 Cb 0.09 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 2hx7 s LEU 102 CO 0.49 0.34 -0.20 -0.75 0.23 0.00 0.00 176.35 176.47 2hx7 s LYS 103 N -1.37 1.21 0.35 1.70 2.36 -1.26 -5.03 119.74 117.69 2hx7 s LYS 103 Ca 0.19 -1.29 -0.27 0.00 -2.55 0.00 0.00 55.97 52.05 2hx7 s LYS 103 Cb -0.12 -1.37 -0.09 0.00 -1.05 0.00 0.00 37.83 35.20 2hx7 s LYS 103 CO 0.09 0.30 1.14 -1.83 1.55 0.00 0.00 175.35 176.60 2hx7 s GLU 104 N -2.37 4.32 0.00 4.03 1.03 -1.26 -3.22 118.70 121.23 2hx7 s GLU 104 Ca 0.11 1.81 0.00 0.00 0.03 0.00 0.00 54.97 56.92 2hx7 s GLU 104 Cb -0.08 -2.88 0.00 0.00 -0.80 0.00 0.00 34.13 30.37 2hx7 s GLU 104 CO 0.06 -0.08 0.00 0.41 -1.33 0.00 0.00 175.26 174.32 2hx7 n GLY 105 N 0.81 2.25 3.90 -3.83 0.00 -1.26 -5.04 105.19 102.02 2hx7 n GLY 105 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.20 3.64 -0.15 1.61 2.56 -1.20 -5.09 118.70 119.88 2hx7 s GLU 106 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 54.97 55.00 2hx7 s GLU 106 Cb 0.00 -2.59 -0.03 0.00 2.00 0.00 0.00 34.13 33.51 2hx7 s GLU 106 CO 0.00 0.15 -0.05 -0.65 -0.56 0.00 0.00 175.26 174.15 2hx7 s GLN 107 N -3.71 3.62 0.07 4.30 -0.21 -1.26 -4.96 119.66 117.51 2hx7 s GLN 107 Ca 0.45 -0.53 0.08 0.00 0.02 0.00 0.00 55.36 55.38 2hx7 s GLN 107 Cb -0.11 -2.88 -0.04 0.00 1.00 0.00 0.00 33.01 30.99 2hx7 s GLN 107 CO 0.31 0.26 -0.18 0.71 -2.12 0.00 0.00 175.29 174.28 2hx7 s TYR 108 N 0.30 2.56 0.01 0.91 2.02 -1.25 -0.46 117.35 121.45 2hx7 s TYR 108 Ca -0.04 -0.25 0.05 0.00 -0.37 0.00 0.00 57.07 56.46 2hx7 s TYR 108 Cb -0.14 -1.42 -0.02 0.00 -0.40 0.00 0.00 41.96 39.98 2hx7 s TYR 108 CO 0.03 0.32 -0.17 -1.64 -1.57 0.00 0.00 175.55 172.52 2hx7 s MET 109 N -1.75 1.24 0.17 -0.62 -1.94 -0.31 -1.94 119.30 114.14 2hx7 s MET 109 Ca 0.16 -0.69 0.06 0.00 -1.71 0.00 0.00 55.69 53.52 2hx7 s MET 109 Cb -0.11 -1.24 -0.04 0.00 2.01 0.00 0.00 34.83 35.45 2hx7 s MET 109 CO 0.08 0.33 0.05 -0.59 -0.01 0.00 0.00 175.02 174.88 2hx7 s PHE 110 N -0.56 2.97 0.02 -0.03 -0.12 0.07 -1.85 117.98 118.48 2hx7 s PHE 110 Ca 0.05 -0.09 -0.28 0.00 -0.05 0.00 0.00 56.93 56.56 2hx7 s PHE 110 Cb -0.07 -1.43 0.10 0.00 -0.63 0.00 0.00 43.02 40.98 2hx7 s PHE 110 CO 0.00 0.52 0.98 -0.59 -0.05 0.00 0.00 175.22 176.08 2hx7 s PHE 111 N -1.74 -0.23 -0.27 3.49 -0.71 -0.27 -0.79 117.98 117.46 2hx7 s PHE 111 Ca 0.29 0.06 -0.10 0.00 -1.04 0.00 0.00 56.93 56.14 2hx7 s PHE 111 Cb -0.10 0.57 -0.05 0.00 -1.21 0.00 0.00 43.02 42.23 2hx7 s PHE 111 CO 0.20 -0.57 0.16 0.00 -1.34 0.00 0.00 175.22 173.68 2hx7 h SER 113 N 8.22 0.66 0.68 0.00 4.64 -1.88 0.31 113.55 126.17 2hx7 h SER 113 Ca -0.36 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 60.69 2hx7 h SER 113 Cb 1.18 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2hx7 h SER 113 CO 0.57 0.76 0.00 1.55 -0.87 0.00 0.00 176.83 178.84 2hx7 h PRO 114 N 0.53 0.00 -0.00 4.77 0.13 -1.89 -3.24 132.00 132.30 2hx7 h PRO 114 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2hx7 h PRO 114 Cb 0.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.52 2hx7 h PRO 114 CO 0.01 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.50 2hx7 n HIS 115 N -2.61 0.00 -0.13 1.56 8.25 -0.92 -4.68 115.22 116.68 2hx7 n HIS 115 Ca 0.01 -0.26 0.01 0.00 -0.26 0.00 0.00 57.72 57.22 2hx7 n HIS 115 Cb 0.22 -0.03 0.30 0.00 1.12 0.00 0.00 29.99 31.60 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 0.01 0.82 0.00 -0.41 -0.00 -0.42 -1.02 115.11 114.10 2hx7 h GLN 116 Ca 0.00 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.65 58.57 2hx7 h GLN 116 Cb 0.27 -0.18 -0.00 0.00 0.00 0.00 0.00 27.48 27.56 2hx7 h GLN 116 CO 0.00 0.56 -0.10 0.78 0.00 0.00 0.00 178.83 180.07 2hx7 h GLY 117 N 0.86 0.00 -2.00 2.39 0.00 -1.83 -1.23 103.07 101.26 2hx7 h GLY 117 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2hx7 h GLY 117 CO -0.05 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.49 2hx7 n ALA 118 N -2.27 2.42 0.00 3.60 0.00 -0.44 -4.93 120.51 118.90 2hx7 n ALA 118 Ca -0.02 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.47 2hx7 n ALA 118 Cb 0.23 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 1.39 0.78 3.54 0.00 0.00 -0.46 -5.02 105.19 105.42 2hx7 n GLY 119 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2hx7 n GLY 119 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2hx7 n MET 120 N -1.82 3.23 -3.88 1.61 0.00 -0.84 -4.84 117.12 110.59 2hx7 n MET 120 Ca 0.00 -3.39 -0.08 0.00 -0.00 0.00 0.00 57.70 54.22 2hx7 n MET 120 Cb 0.00 -3.40 -0.03 0.00 0.00 0.00 0.00 33.22 29.79 2hx7 n MET 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 2hx7 s LYS 121 N 3.64 1.64 0.07 2.12 -2.85 -1.26 -1.89 119.74 121.20 2hx7 s LYS 121 Ca 0.52 -1.05 -0.23 0.00 -1.00 0.00 0.00 55.97 54.21 2hx7 s LYS 121 Cb 0.03 0.55 0.08 0.00 -2.06 0.00 0.00 37.83 36.42 2hx7 s LYS 121 CO 0.06 -0.72 1.04 0.41 0.10 0.00 0.00 175.35 176.24 2hx7 n GLY 122 N -0.42 0.45 3.93 0.59 0.00 0.03 -4.76 105.19 105.01 2hx7 n GLY 122 Ca -0.04 -1.07 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 2hx7 n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hx7 s THR 123 N -2.07 5.16 -0.07 2.61 -4.23 -0.32 -0.75 115.64 115.99 2hx7 s THR 123 Ca 0.24 -0.38 0.02 0.00 -1.18 0.00 0.00 61.69 60.39 2hx7 s THR 123 Cb -0.02 -3.77 0.02 0.00 1.34 0.00 0.00 72.50 70.07 2hx7 s THR 123 CO 0.02 -0.29 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.49 2hx7 s LEU 124 N -3.62 1.55 -0.02 4.79 0.20 -0.82 -0.56 118.68 120.21 2hx7 s LEU 124 Ca 0.39 -0.27 0.01 0.00 0.69 0.00 0.00 54.13 54.96 2hx7 s LEU 124 Cb -0.10 -0.76 0.01 0.00 -0.43 0.00 0.00 46.19 44.90 2hx7 s LEU 124 CO 0.31 0.01 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.44 2hx7 s THR 125 N 0.79 0.41 0.42 3.68 2.01 -0.30 -3.80 115.64 118.86 2hx7 s THR 125 Ca -0.12 -0.15 -0.24 0.00 0.31 0.00 0.00 61.69 61.49 2hx7 s THR 125 Cb -0.15 -0.39 -0.08 0.00 0.01 0.00 0.00 72.50 71.88 2hx7 s THR 125 CO 0.02 0.15 1.13 -0.76 -0.69 0.00 0.00 174.62 174.47 2hx7 s LEU 126 N 0.31 4.10 0.00 4.42 1.43 -1.26 -0.65 118.68 127.04 2hx7 s LEU 126 Ca -0.03 2.24 0.00 0.00 -1.03 0.00 0.00 54.13 55.30 2hx7 s LEU 126 Cb -0.07 -4.16 0.00 0.00 0.03 0.00 0.00 46.19 41.99 2hx7 s LEU 126 CO -0.00 -0.72 0.00 0.29 0.23 0.00 0.00 176.35 176.15