#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xa7 s TYR 9 N 0.00 1.77 -0.13 -2.53 5.04 0.92 -4.91 117.35 117.51 1xa7 s TYR 9 Ca 0.00 0.37 0.07 0.00 -2.44 0.00 0.00 57.07 55.07 1xa7 s TYR 9 Cb 0.00 -4.02 -0.23 0.00 0.35 0.00 0.00 41.96 38.05 1xa7 s TYR 9 CO 0.00 -3.62 0.34 1.63 -1.34 0.00 0.00 175.55 172.56 1xa7 n LYS 10 N 7.87 0.68 -1.67 4.97 4.76 -1.26 -4.86 118.16 128.65 1xa7 n LYS 10 Ca 0.21 0.21 -0.47 0.00 -2.87 0.00 0.00 58.31 55.39 1xa7 n LYS 10 Cb 0.44 -1.68 -0.04 0.00 -1.84 0.00 0.00 35.03 31.91 1xa7 n LYS 10 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1xa7 n LYS 11 N -3.14 2.12 -1.31 1.97 4.81 -1.26 -4.90 118.16 116.45 1xa7 n LYS 11 Ca -0.28 0.77 -0.33 0.00 -0.87 0.00 0.00 58.31 57.60 1xa7 n LYS 11 Cb 1.06 -2.56 0.10 0.00 0.02 0.00 0.00 35.03 33.65 1xa7 n LYS 11 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1xa7 s PRO 12 N 2.09 2.07 -0.42 1.64 0.04 -1.26 -4.98 135.00 134.18 1xa7 s PRO 12 Ca 0.84 1.50 -0.07 0.00 0.04 0.00 0.00 61.00 63.32 1xa7 s PRO 12 Cb -0.70 -1.85 0.09 0.00 0.04 0.00 0.00 34.50 32.09 1xa7 s PRO 12 CO 0.43 -1.84 0.24 -1.17 0.04 0.00 0.00 177.00 174.71 1xa7 s LEU 13 N -5.57 5.20 -1.13 -3.56 2.96 -1.26 -5.01 118.68 110.32 1xa7 s LEU 13 Ca 0.68 -1.72 -0.04 0.00 -0.22 0.00 0.00 54.13 52.84 1xa7 s LEU 13 Cb -0.23 -1.93 0.26 0.00 0.50 0.00 0.00 46.19 44.79 1xa7 s LEU 13 CO 0.49 -0.55 1.84 1.41 -1.32 0.00 0.00 176.35 178.22 1xa7 n HIS 14 N 4.80 2.60 -3.71 5.38 8.25 -1.26 -4.92 115.22 126.36 1xa7 n HIS 14 Ca -0.08 -2.63 -0.14 0.00 -0.26 0.00 0.00 57.72 54.61 1xa7 n HIS 14 Cb 0.42 -1.41 -0.09 0.00 1.12 0.00 0.00 29.99 30.03 1xa7 n HIS 14 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1xa7 s ASN 15 N -0.92 -0.35 0.28 0.41 3.84 -1.26 -5.14 114.94 111.81 1xa7 s ASN 15 Ca 0.40 0.44 -0.30 0.00 0.21 0.00 0.00 52.86 53.60 1xa7 s ASN 15 Cb 0.14 0.53 -0.13 0.00 -0.55 0.00 0.00 41.25 41.24 1xa7 s ASN 15 CO -0.04 -0.37 1.40 -0.67 -2.79 0.00 0.00 177.10 174.63 1xa7 n ASP 16 N 1.74 2.97 -4.12 -4.21 -0.08 -1.26 -4.87 116.55 106.72 1xa7 n ASP 16 Ca -0.18 1.17 -0.23 0.00 -1.51 0.00 0.00 54.79 54.03 1xa7 n ASP 16 Cb 0.56 -1.48 -0.09 0.00 2.34 0.00 0.00 41.12 42.46 1xa7 n ASP 16 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1xa7 s TYR 17 N -0.40 1.76 -0.27 -0.67 5.04 -1.26 -1.77 117.35 119.77 1xa7 s TYR 17 Ca 0.63 -1.26 -0.10 0.00 -2.44 0.00 0.00 57.07 53.89 1xa7 s TYR 17 Cb -0.59 -1.08 0.11 0.00 0.35 0.00 0.00 41.96 40.75 1xa7 s TYR 17 CO 0.54 -0.33 0.61 -1.14 -1.34 0.00 0.00 175.55 173.89 1xa7 s GLN 18 N -3.77 0.55 0.41 4.97 0.74 -0.51 -4.85 119.66 117.20 1xa7 s GLN 18 Ca 0.30 1.32 -0.25 0.00 0.05 0.00 0.00 55.36 56.77 1xa7 s GLN 18 Cb 0.04 0.62 -0.08 0.00 1.10 0.00 0.00 33.01 34.69 1xa7 s GLN 18 CO 0.16 -0.20 1.21 -1.50 -0.55 0.00 0.00 175.29 174.41 1xa7 s ILE 19 N 2.57 2.98 0.16 -2.34 -1.16 -1.26 -1.83 121.20 120.31 1xa7 s ILE 19 Ca -0.06 0.83 0.07 0.00 -0.51 0.00 0.00 60.65 60.98 1xa7 s ILE 19 Cb -0.11 -3.47 -0.04 0.00 0.61 0.00 0.00 42.46 39.45 1xa7 s ILE 19 CO -0.18 0.08 -0.15 -0.76 -2.81 0.00 0.00 174.94 171.13 1xa7 s LEU 20 N -2.52 2.46 -0.40 8.50 1.02 0.68 -4.88 118.68 123.54 1xa7 s LEU 20 Ca 0.58 -0.90 0.02 0.00 0.02 0.00 0.00 54.13 53.85 1xa7 s LEU 20 Cb -0.33 -0.64 0.12 0.00 0.02 0.00 0.00 46.19 45.36 1xa7 s LEU 20 CO 0.41 -0.14 0.17 -0.62 0.02 0.00 0.00 176.35 176.20 1xa7 s ASP 21 N -2.79 4.03 -0.20 2.29 3.68 -1.26 -4.36 116.67 118.06 1xa7 s ASP 21 Ca 0.15 -2.33 0.15 0.00 2.13 0.00 0.00 52.55 52.65 1xa7 s ASP 21 Cb -0.03 -1.17 0.66 0.00 -1.45 0.00 0.00 42.92 40.93 1xa7 s ASP 21 CO 0.05 -0.32 1.57 0.29 0.13 0.00 0.00 175.17 176.89 1xa7 n LYS 22 N 3.96 3.83 -0.41 4.34 4.76 -1.26 -4.72 118.16 128.66 1xa7 n LYS 22 Ca 0.04 -2.97 0.33 0.00 -2.87 0.00 0.00 58.31 52.84 1xa7 n LYS 22 Cb 0.37 -2.02 0.62 0.00 -1.84 0.00 0.00 35.03 32.16 1xa7 n LYS 22 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1xa7 h SER 23 N 2.88 0.28 0.57 4.39 0.87 -2.00 -1.26 113.55 119.28 1xa7 h SER 23 Ca 0.00 0.11 -0.27 0.00 -1.23 0.00 0.00 61.79 60.40 1xa7 h SER 23 Cb 1.67 0.08 0.01 0.00 -0.44 0.00 0.00 62.40 63.71 1xa7 h SER 23 CO 0.34 -0.09 -1.19 0.07 -0.53 0.00 0.00 176.83 175.42 1xa7 h LYS 24 N 0.17 0.30 -3.69 2.24 -0.00 -2.04 -2.81 116.57 110.74 1xa7 h LYS 24 Ca 0.74 -0.48 -0.77 0.00 -0.00 0.00 0.00 60.65 60.15 1xa7 h LYS 24 Cb 2.28 0.17 -0.20 0.00 -0.00 0.00 0.00 32.23 34.48 1xa7 h LYS 24 CO -0.35 1.21 1.40 -0.89 -0.00 0.00 0.00 179.45 180.82 1xa7 n ILE 25 N -3.58 4.57 -2.62 0.07 5.41 -0.48 -5.24 119.36 117.49 1xa7 n ILE 25 Ca -0.08 -4.94 0.00 0.00 1.00 0.00 0.00 62.75 58.73 1xa7 n ILE 25 Cb 0.99 -2.35 0.00 0.00 -0.71 0.00 0.00 39.64 37.57 1xa7 n ILE 25 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1xa7 n PHE 26 N 3.60 -0.25 -2.82 1.39 3.01 -1.06 -4.95 117.46 116.37 1xa7 n PHE 26 Ca 0.34 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.80 1xa7 n PHE 26 Cb 0.37 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.84 1xa7 n PHE 26 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xa7 n GLY 31 N 0.00 0.40 3.48 1.37 0.00 -1.26 -5.04 105.19 104.14 1xa7 n GLY 31 Ca 0.00 -0.96 -0.11 0.00 0.00 0.00 0.00 46.02 44.95 1xa7 n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xa7 s SER 32 N -4.00 -0.49 -0.18 1.61 0.15 -0.26 -4.83 113.70 105.70 1xa7 s SER 32 Ca 0.00 0.16 -0.12 0.00 0.70 0.00 0.00 55.95 56.69 1xa7 s SER 32 Cb 0.00 0.48 0.06 0.00 -1.71 0.00 0.00 66.02 64.84 1xa7 s SER 32 CO 0.00 -0.71 0.46 0.12 1.20 0.00 0.00 173.24 174.31 1xa7 s PHE 33 N -2.79 -0.62 0.12 3.44 5.36 -0.98 -1.33 117.98 121.18 1xa7 s PHE 33 Ca 0.00 1.36 -0.03 0.00 -0.96 0.00 0.00 56.93 57.29 1xa7 s PHE 33 Cb -0.01 0.27 -0.03 0.00 -0.34 0.00 0.00 43.02 42.91 1xa7 s PHE 33 CO -0.06 -0.33 0.11 0.08 -1.46 0.00 0.00 175.22 173.56 1xa7 s VAL 34 N 1.01 0.11 -0.30 3.12 1.01 -0.68 -1.22 120.40 123.46 1xa7 s VAL 34 Ca -0.06 -1.72 -0.17 0.00 0.00 0.00 0.00 61.98 60.03 1xa7 s VAL 34 Cb -0.06 -1.87 0.18 0.00 0.00 0.00 0.00 36.38 34.63 1xa7 s VAL 34 CO -0.09 -0.51 1.15 -0.47 0.00 0.00 0.00 175.10 175.18 1xa7 s TYR 36 N -4.00 -0.34 0.00 5.22 5.04 0.24 -2.08 117.35 121.43 1xa7 s TYR 36 Ca 0.19 0.50 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 1xa7 s TYR 36 Cb 0.06 0.17 0.00 0.00 0.35 0.00 0.00 41.96 42.54 1xa7 s TYR 36 CO -0.01 -0.18 0.00 0.45 -1.34 0.00 0.00 175.55 174.47 1xa7 n SER 37 N 4.99 0.00 0.00 4.32 2.88 -0.95 -0.64 113.62 124.22 1xa7 n SER 37 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 1xa7 n SER 37 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1xa7 n SER 37 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1xa7 n LYS 40 N 0.00 0.00 -3.92 -1.46 5.02 -1.26 -2.63 118.16 113.91 1xa7 n LYS 40 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 1xa7 n LYS 40 Cb 0.00 -2.57 0.01 0.00 -0.02 0.00 0.00 35.03 32.45 1xa7 n LYS 40 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xa7 n ASP 41 N 0.05 -4.56 -3.63 4.39 2.03 -1.26 -4.99 116.55 108.58 1xa7 n ASP 41 Ca 0.00 -1.12 -0.16 0.00 0.52 0.00 0.00 54.79 54.04 1xa7 n ASP 41 Cb 0.00 -1.72 -0.07 0.00 -0.72 0.00 0.00 41.12 38.61 1xa7 n ASP 41 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1xa7 s LYS 42 N -6.09 0.86 0.20 -0.67 -2.85 -1.08 -4.49 119.74 105.62 1xa7 s LYS 42 Ca 0.23 0.18 0.02 0.00 -1.00 0.00 0.00 55.97 55.41 1xa7 s LYS 42 Cb -0.13 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 36.01 1xa7 s LYS 42 CO 0.93 -0.24 0.34 0.71 0.10 0.00 0.00 175.35 177.20 1xa7 s TYR 43 N -1.00 3.48 -0.31 1.78 2.02 -0.73 -2.24 117.35 120.35 1xa7 s TYR 43 Ca -0.10 0.14 -0.02 0.00 -0.37 0.00 0.00 57.07 56.72 1xa7 s TYR 43 Cb -0.02 -1.69 0.12 0.00 -0.40 0.00 0.00 41.96 39.96 1xa7 s TYR 43 CO 0.06 0.44 0.18 0.71 -1.57 0.00 0.00 175.55 175.38 1xa7 s TYR 44 N -1.87 0.32 -0.05 2.71 1.51 -1.26 -1.42 117.35 117.29 1xa7 s TYR 44 Ca 0.36 -1.00 0.03 0.00 -1.01 0.00 0.00 57.07 55.44 1xa7 s TYR 44 Cb -0.10 -0.84 -0.03 0.00 -0.11 0.00 0.00 41.96 40.88 1xa7 s TYR 44 CO 0.29 -0.84 -0.11 0.42 -1.11 0.00 0.00 175.55 174.20 1xa7 s ILE 45 N 1.83 3.35 -0.19 2.71 -1.09 -0.76 -4.23 121.20 122.81 1xa7 s ILE 45 Ca 0.12 -0.64 -0.01 0.00 -2.23 0.00 0.00 60.65 57.89 1xa7 s ILE 45 Cb -0.18 -2.35 0.01 0.00 -1.58 0.00 0.00 42.46 38.37 1xa7 s ILE 45 CO -0.25 0.58 -0.14 -0.47 -1.23 0.00 0.00 174.94 173.43 1xa7 s TYR 46 N -0.78 2.85 -0.45 3.97 6.04 -0.36 -0.23 117.35 128.38 1xa7 s TYR 46 Ca 0.12 -1.34 -0.01 0.00 0.04 0.00 0.00 57.07 55.89 1xa7 s TYR 46 Cb -0.11 -1.99 0.00 0.00 -1.04 0.00 0.00 41.96 38.83 1xa7 s TYR 46 CO 0.01 -0.69 0.44 0.09 -1.54 0.00 0.00 175.55 173.86 1xa7 n ASN 47 N 4.65 -5.67 0.08 4.32 4.13 -1.26 -2.31 115.26 119.19 1xa7 n ASN 47 Ca -0.20 -0.01 0.12 0.00 1.68 0.00 0.00 54.58 56.18 1xa7 n ASN 47 Cb 0.50 -3.73 0.20 0.00 -1.54 0.00 0.00 39.78 35.22 1xa7 n ASN 47 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 1xa7 h GLU 48 N 0.38 0.00 -0.05 3.52 -0.00 -1.93 -2.64 114.58 113.86 1xa7 h GLU 48 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.36 59.27 1xa7 h GLU 48 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.72 1xa7 h GLU 48 CO 0.18 0.00 -0.32 -0.22 -0.00 0.00 0.00 179.01 178.66 1xa7 h LYS 49 N 0.00 0.31 0.00 1.06 3.64 -1.99 -3.10 116.57 116.49 1xa7 h LYS 49 Ca 0.00 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1xa7 h LYS 49 Cb 0.78 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1xa7 h LYS 49 CO 0.00 0.91 0.00 -1.91 -2.27 0.00 0.00 179.45 176.18 1xa7 n GLU 50 N -4.44 0.14 0.04 1.90 4.07 -1.23 -1.51 120.64 119.60 1xa7 n GLU 50 Ca -0.09 0.52 -0.04 0.00 -0.06 0.00 0.00 57.16 57.49 1xa7 n GLU 50 Cb 0.51 -1.86 -0.09 0.00 -0.06 0.00 0.00 31.44 29.94 1xa7 n GLU 50 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1xa7 h SER 51 N 0.00 0.00 -0.09 4.31 4.64 -1.44 -3.33 113.55 117.63 1xa7 h SER 51 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xa7 h SER 51 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1xa7 h SER 51 CO 0.00 0.81 0.00 0.54 -0.87 0.00 0.00 176.83 177.31 1xa7 n ARG 52 N -3.13 1.32 -3.14 4.77 1.74 -0.57 -1.94 116.66 115.71 1xa7 n ARG 52 Ca -0.07 -0.49 -0.39 0.00 -0.77 0.00 0.00 57.85 56.13 1xa7 n ARG 52 Cb 0.91 -1.28 -0.06 0.00 -1.02 0.00 0.00 32.46 31.02 1xa7 n ARG 52 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1xa7 s LYS 53 N -1.88 4.37 -0.00 5.56 2.36 -1.22 -0.06 119.74 128.87 1xa7 s LYS 53 Ca 0.25 0.90 -0.18 0.00 -2.55 0.00 0.00 55.97 54.39 1xa7 s LYS 53 Cb 0.12 -3.29 -0.06 0.00 -1.05 0.00 0.00 37.83 33.56 1xa7 s LYS 53 CO 0.19 0.51 0.51 1.03 1.55 0.00 0.00 175.35 179.14 1xa7 s ARG 54 N -0.76 4.17 0.18 4.03 0.52 -1.26 -4.09 118.95 121.74 1xa7 s ARG 54 Ca 0.33 0.59 0.03 0.00 -0.52 0.00 0.00 55.73 56.16 1xa7 s ARG 54 Cb -0.20 -3.29 -0.05 0.00 0.52 0.00 0.00 34.95 31.93 1xa7 s ARG 54 CO 0.21 0.51 -0.04 0.71 0.02 0.00 0.00 175.30 176.71 1xa7 s TYR 55 N -0.58 1.33 0.38 -0.53 2.02 -0.26 -4.76 117.35 114.95 1xa7 s TYR 55 Ca 0.27 -0.90 -0.26 0.00 -0.37 0.00 0.00 57.07 55.82 1xa7 s TYR 55 Cb -0.18 -0.74 -0.11 0.00 -0.40 0.00 0.00 41.96 40.53 1xa7 s TYR 55 CO 0.15 -0.06 1.11 0.45 -1.57 0.00 0.00 175.55 175.64 1xa7 n SER 56 N -0.28 1.79 -0.03 2.29 2.88 -1.26 0.22 113.62 119.23 1xa7 n SER 56 Ca -0.07 1.11 0.14 0.00 -1.33 0.00 0.00 58.87 58.71 1xa7 n SER 56 Cb 0.62 -1.39 0.61 0.00 -0.75 0.00 0.00 64.21 63.30 1xa7 n SER 56 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1xa7 n PRO 57 N 0.31 0.30 0.00 -1.46 -0.04 -1.25 -4.82 135.00 128.04 1xa7 n PRO 57 Ca 0.08 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1xa7 n PRO 57 Cb 0.37 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1xa7 n PRO 57 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1xa7 n ASN 58 N -1.30 0.00 0.00 3.54 0.23 -0.91 -3.93 115.26 112.89 1xa7 n ASN 58 Ca 0.11 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.16 1xa7 n ASN 58 Cb 0.30 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.00 1xa7 n ASN 58 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1xa7 n THR 60 N 0.00 0.00 0.24 5.53 -2.24 -1.25 -4.31 114.28 112.25 1xa7 n THR 60 Ca 0.00 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 61.96 1xa7 n THR 60 Cb 0.00 0.00 0.87 0.00 -2.10 0.00 0.00 70.33 69.10 1xa7 n THR 60 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1xa7 h TYR 61 N 0.00 0.00 -0.54 4.78 3.20 -1.93 -1.68 116.97 120.80 1xa7 h TYR 61 Ca 0.00 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.03 1xa7 h TYR 61 Cb 0.00 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 1xa7 h TYR 61 CO 0.00 0.00 0.47 0.87 -1.64 0.00 0.00 178.16 177.86 1xa7 h LYS 62 N 0.00 0.00 -0.76 1.82 1.57 -1.94 0.14 116.57 117.40 1xa7 h LYS 62 Ca 0.07 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.93 1xa7 h LYS 62 Cb 0.58 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.82 1xa7 h LYS 62 CO -0.00 0.00 0.42 0.82 -0.57 0.00 0.00 179.45 180.12 1xa7 h ILE 63 N 0.00 0.93 0.19 1.86 2.04 -1.70 -0.90 117.51 119.92 1xa7 h ILE 63 Ca 0.26 -0.25 -0.34 0.00 1.00 0.00 0.00 64.86 65.53 1xa7 h ILE 63 Cb 1.20 0.12 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1xa7 h ILE 63 CO -0.00 0.14 -1.62 1.88 0.00 0.00 0.00 178.15 178.54 1xa7 h TYR 64 N 0.74 0.72 -0.85 1.37 0.05 -1.22 -3.25 116.97 114.54 1xa7 h TYR 64 Ca 0.36 -0.53 0.12 0.00 0.05 0.00 0.00 58.73 58.73 1xa7 h TYR 64 Cb 0.29 -0.03 -0.06 0.00 1.01 0.00 0.00 36.73 37.94 1xa7 h TYR 64 CO -0.07 1.57 0.55 -0.07 -1.05 0.00 0.00 178.16 179.09 1xa7 h LEU 65 N 0.11 0.65 -2.14 3.88 -0.00 -1.14 0.10 115.31 116.77 1xa7 h LEU 65 Ca -0.29 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 1xa7 h LEU 65 Cb 2.10 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 42.65 1xa7 h LEU 65 CO 0.20 0.36 0.00 0.00 -0.00 0.00 0.00 178.44 179.00 1xa7 n ALA 66 N -2.44 2.12 0.00 1.53 0.00 -0.35 -1.69 120.51 119.68 1xa7 n ALA 66 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1xa7 n ALA 66 Cb 0.41 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1xa7 n ALA 66 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1xa7 n PHE 68 N 0.83 0.00 -0.01 0.00 3.72 0.02 -1.22 117.46 120.80 1xa7 n PHE 68 Ca 0.00 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.24 1xa7 n PHE 68 Cb 0.27 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.69 1xa7 n PHE 68 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1xa7 h GLY 69 N 0.00 0.24 0.75 1.37 0.00 -1.58 -1.51 103.07 102.35 1xa7 h GLY 69 Ca 0.00 -0.47 0.05 0.00 0.00 0.00 0.00 47.33 46.92 1xa7 h GLY 69 CO 0.00 0.41 0.46 1.41 0.00 0.00 0.00 176.54 178.82 1xa7 h LEU 70 N -0.47 0.72 -1.55 3.11 3.38 -1.34 0.20 115.31 119.35 1xa7 h LEU 70 Ca -0.05 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1xa7 h LEU 70 Cb 1.16 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1xa7 h LEU 70 CO 0.07 0.47 -0.22 -0.78 0.09 0.00 0.00 178.44 178.07 1xa7 h ASP 71 N 0.85 0.01 -0.50 -0.43 3.58 -1.75 -2.42 116.42 115.76 1xa7 h ASP 71 Ca 0.32 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.77 1xa7 h ASP 71 Cb 0.13 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.18 1xa7 h ASP 71 CO -0.16 0.23 0.00 0.54 -2.88 0.00 0.00 179.24 176.97 1xa7 n ARG 72 N -4.28 2.85 -2.02 0.28 1.74 -0.58 -4.97 116.66 109.69 1xa7 n ARG 72 Ca -0.02 -2.33 -0.19 0.00 -0.77 0.00 0.00 57.85 54.53 1xa7 n ARG 72 Cb 0.28 -1.41 -0.04 0.00 -1.02 0.00 0.00 32.46 30.26 1xa7 n ARG 72 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1xa7 n HIS 73 N 0.94 -0.52 0.29 -1.55 8.25 -0.23 -4.85 115.22 117.55 1xa7 n HIS 73 Ca 0.17 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.79 1xa7 n HIS 73 Cb 0.53 -3.56 0.86 0.00 1.12 0.00 0.00 29.99 28.93 1xa7 n HIS 73 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1xa7 h ILE 74 N 0.00 0.41 -3.61 1.59 1.08 -0.96 -3.44 117.51 112.58 1xa7 h ILE 74 Ca -0.44 -0.31 -0.07 0.00 -0.39 0.00 0.00 64.86 63.65 1xa7 h ILE 74 Cb 1.31 1.22 -0.13 0.00 -3.07 0.00 0.00 36.82 36.15 1xa7 h ILE 74 CO 0.56 0.06 -0.20 0.27 -0.69 0.00 0.00 178.15 178.15 1xa7 s ILE 75 N -4.25 0.09 0.00 -0.67 -4.36 -1.21 -4.99 121.20 105.81 1xa7 s ILE 75 Ca -0.03 -0.95 0.00 0.00 -0.26 0.00 0.00 60.65 59.41 1xa7 s ILE 75 Cb 0.13 -1.40 0.00 0.00 1.25 0.00 0.00 42.46 42.44 1xa7 s ILE 75 CO 0.54 -0.39 0.00 -0.46 0.24 0.00 0.00 174.94 174.87 1xa7 n ASN 76 N -0.19 0.00 -0.09 4.36 2.04 0.33 -4.28 115.26 117.44 1xa7 n ASN 76 Ca -0.13 -0.76 -0.10 0.00 -0.44 0.00 0.00 54.58 53.15 1xa7 n ASN 76 Cb 0.63 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.85 1xa7 n ASN 76 CO 0.00 0.00 0.00 0.44 -0.44 0.00 0.00 177.26 177.26 1xa7 h ASP 77 N 0.00 0.39 0.15 0.53 3.32 -2.00 -3.11 116.42 115.71 1xa7 h ASP 77 Ca 0.00 -0.18 -0.18 0.00 0.02 0.00 0.00 57.03 56.69 1xa7 h ASP 77 Cb 0.00 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 1xa7 h ASP 77 CO 0.00 0.46 -0.70 -0.33 -1.72 0.00 0.00 179.24 176.95 1xa7 h GLU 78 N 0.30 0.49 -3.23 3.56 5.08 -2.06 -3.43 114.58 115.29 1xa7 h GLU 78 Ca 0.09 -0.38 -0.28 0.00 -1.00 0.00 0.00 59.36 57.79 1xa7 h GLU 78 Cb 0.20 0.07 -0.34 0.00 0.50 0.00 0.00 28.75 29.18 1xa7 h GLU 78 CO -0.01 1.01 -0.64 1.21 -1.00 0.00 0.00 179.01 179.58 1xa7 s ASN 79 N -6.98 0.37 0.00 1.42 3.84 -1.18 -4.97 114.94 107.45 1xa7 s ASN 79 Ca -0.07 0.26 0.19 0.00 0.21 0.00 0.00 52.86 53.45 1xa7 s ASN 79 Cb 0.10 0.15 0.31 0.00 -0.55 0.00 0.00 41.25 41.27 1xa7 s ASN 79 CO 0.85 -0.19 1.11 -1.54 -2.79 0.00 0.00 177.10 174.54 1xa7 n SER 80 N 4.75 0.57 -4.31 -4.21 3.41 -1.24 -0.51 113.62 112.08 1xa7 n SER 80 Ca -0.16 -1.98 -0.24 0.00 -0.26 0.00 0.00 58.87 56.23 1xa7 n SER 80 Cb 0.51 -0.19 0.14 0.00 -0.26 0.00 0.00 64.21 64.40 1xa7 n SER 80 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xa7 n ARG 81 N 0.36 -0.39 -4.51 4.33 1.74 -1.26 -3.05 116.66 113.89 1xa7 n ARG 81 Ca 0.00 -2.47 -0.24 0.00 -0.77 0.00 0.00 57.85 54.36 1xa7 n ARG 81 Cb 1.02 -0.82 -0.11 0.00 -1.02 0.00 0.00 32.46 31.54 1xa7 n ARG 81 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1xa7 s SER 83 N -5.14 3.30 0.19 0.55 1.04 -1.26 -5.01 113.70 107.37 1xa7 s SER 83 Ca 0.67 -1.24 -0.09 0.00 0.48 0.00 0.00 55.95 55.77 1xa7 s SER 83 Cb -0.03 -0.27 -0.07 0.00 0.10 0.00 0.00 66.02 65.75 1xa7 s SER 83 CO 0.45 -0.32 0.49 0.86 0.98 0.00 0.00 173.24 175.70 1xa7 s TRP 84 N -2.82 3.47 -2.74 5.02 -0.00 -1.26 -4.85 118.94 115.76 1xa7 s TRP 84 Ca 0.32 0.81 0.24 0.00 -0.00 0.00 0.00 56.10 57.47 1xa7 s TRP 84 Cb 0.05 -2.20 0.42 0.00 -0.00 0.00 0.00 33.47 31.73 1xa7 s TRP 84 CO 0.15 0.35 1.39 0.27 -0.00 0.00 0.00 176.95 179.11 1xa7 n ASN 85 N 0.12 2.82 0.00 5.86 0.23 -1.26 -4.96 115.26 118.07 1xa7 n ASN 85 Ca -0.02 -1.91 0.00 0.00 -0.53 0.00 0.00 54.58 52.13 1xa7 n ASN 85 Cb 0.52 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.15 1xa7 n ASN 85 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1xa7 n HIS 86 N 1.15 0.00 -2.54 -2.53 8.25 -1.26 -5.00 115.22 113.28 1xa7 n HIS 86 Ca 0.16 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.19 1xa7 n HIS 86 Cb 0.55 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.61 1xa7 n HIS 86 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1xa7 s LYS 87 N -0.02 3.86 -0.58 -0.41 0.00 -1.26 -4.87 119.74 116.46 1xa7 s LYS 87 Ca 0.00 0.93 -0.26 0.00 0.00 0.00 0.00 55.97 56.64 1xa7 s LYS 87 Cb 0.00 -3.86 -0.10 0.00 0.00 0.00 0.00 37.83 33.87 1xa7 s LYS 87 CO 0.00 -1.19 2.44 1.58 0.00 0.00 0.00 175.35 178.18 1xa7 n HIS 88 N 7.60 1.30 -2.47 1.78 -0.00 -1.26 -4.87 115.22 117.29 1xa7 n HIS 88 Ca 0.13 0.12 -0.32 0.00 -0.00 0.00 0.00 57.72 57.66 1xa7 n HIS 88 Cb 0.48 -2.59 -0.03 0.00 -0.00 0.00 0.00 29.99 27.85 1xa7 n HIS 88 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.34 177.05 1xa7 s TYR 89 N 12.16 3.46 -0.55 1.57 1.51 -1.26 -4.94 117.35 129.30 1xa7 s TYR 89 Ca 1.01 1.40 0.05 0.00 -1.01 0.00 0.00 57.07 58.52 1xa7 s TYR 89 Cb -0.27 -2.73 0.37 0.00 -0.11 0.00 0.00 41.96 39.21 1xa7 s TYR 89 CO 0.26 -0.32 1.16 -0.35 -1.11 0.00 0.00 175.55 175.19 1xa7 n PRO 90 N -1.53 2.55 -4.43 -1.71 -0.05 -1.26 -4.55 135.00 124.02 1xa7 n PRO 90 Ca 0.06 -1.46 -0.29 0.00 -0.05 0.00 0.00 63.50 61.77 1xa7 n PRO 90 Cb 0.54 -1.79 -0.17 0.00 -0.05 0.00 0.00 33.50 32.03 1xa7 n PRO 90 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 175.50 175.39 1xa7 s PHE 91 N -1.76 1.98 0.22 0.54 0.08 -1.26 -5.04 117.98 112.74 1xa7 s PHE 91 Ca 0.26 -0.94 -0.04 0.00 0.12 0.00 0.00 56.93 56.33 1xa7 s PHE 91 Cb 0.20 -1.43 0.22 0.00 -0.57 0.00 0.00 43.02 41.44 1xa7 s PHE 91 CO 0.07 -0.49 1.65 -0.44 -0.10 0.00 0.00 175.22 175.91 1xa7 h ASP 92 N 7.46 0.77 0.17 1.36 3.45 -2.00 -2.20 116.42 125.42 1xa7 h ASP 92 Ca -0.31 -0.26 0.00 0.00 0.43 0.00 0.00 57.03 56.88 1xa7 h ASP 92 Cb 1.17 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 39.73 1xa7 h ASP 92 CO 0.49 0.95 0.00 0.00 -1.57 0.00 0.00 179.24 179.11 1xa7 n ALA 93 N -2.50 1.22 0.34 3.45 0.00 -1.26 -1.88 120.51 119.88 1xa7 n ALA 93 Ca 0.00 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.58 1xa7 n ALA 93 Cb 0.41 -1.12 0.08 0.00 0.00 0.00 0.00 19.45 18.83 1xa7 n ALA 93 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1xa7 h TRP 94 N 0.00 0.00 -1.06 0.00 4.06 -1.74 -3.42 115.95 113.80 1xa7 h TRP 94 Ca 0.00 0.00 -0.59 0.00 2.06 0.00 0.00 58.89 60.36 1xa7 h TRP 94 Cb 0.09 0.00 -0.15 0.00 -1.00 0.00 0.00 29.16 28.10 1xa7 h TRP 94 CO 0.00 0.00 1.27 0.09 -3.56 0.00 0.00 178.44 176.24 1xa7 n ASN 95 N -2.40 7.14 -3.56 -3.49 3.02 -0.79 -4.81 115.26 110.36 1xa7 n ASN 95 Ca 0.02 -3.15 -0.07 0.00 -0.03 0.00 0.00 54.58 51.35 1xa7 n ASN 95 Cb 0.49 -1.30 -0.03 0.00 -0.61 0.00 0.00 39.78 38.34 1xa7 n ASN 95 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1xa7 s LYS 96 N -1.34 0.52 0.66 3.52 -2.85 -1.26 -5.02 119.74 113.97 1xa7 s LYS 96 Ca 0.57 -0.11 -0.17 0.00 -1.00 0.00 0.00 55.97 55.27 1xa7 s LYS 96 Cb 0.29 0.24 -0.06 0.00 -2.06 0.00 0.00 37.83 36.25 1xa7 s LYS 96 CO -0.16 -0.21 0.56 -1.91 0.10 0.00 0.00 175.35 173.73 1xa7 n GLU 97 N 0.09 0.42 -4.14 1.78 2.13 -1.26 -4.36 120.64 115.30 1xa7 n GLU 97 Ca -0.05 0.18 -0.12 0.00 0.66 0.00 0.00 57.16 57.83 1xa7 n GLU 97 Cb 0.59 -1.81 -0.11 0.00 0.27 0.00 0.00 31.44 30.39 1xa7 n GLU 97 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1xa7 s GLN 98 N -2.53 0.74 0.53 5.31 -1.52 -1.26 -4.92 119.66 116.00 1xa7 s GLN 98 Ca 0.67 -1.11 0.01 0.00 -1.95 0.00 0.00 55.36 52.98 1xa7 s GLN 98 Cb -0.39 -0.30 -0.00 0.00 -0.22 0.00 0.00 33.01 32.11 1xa7 s GLN 98 CO 0.56 0.02 0.04 0.16 -0.25 0.00 0.00 175.29 175.83 1xa7 s ASP 99 N -2.45 4.21 0.19 5.90 -4.77 -1.26 -4.23 116.67 114.26 1xa7 s ASP 99 Ca 0.03 -1.65 -0.12 0.00 -3.30 0.00 0.00 52.55 47.52 1xa7 s ASP 99 Cb -0.01 0.61 0.13 0.00 -1.09 0.00 0.00 42.92 42.56 1xa7 s ASP 99 CO -0.02 -0.92 1.84 0.25 0.70 0.00 0.00 175.17 177.01 1xa7 h LEU 100 N 1.24 0.63 -0.42 2.11 5.85 -1.95 -0.50 115.31 122.28 1xa7 h LEU 100 Ca -0.43 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.29 1xa7 h LEU 100 Cb 1.32 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1xa7 h LEU 100 CO 0.72 0.44 0.27 0.78 -0.34 0.00 0.00 178.44 180.31 1xa7 h ASN 101 N 0.75 0.46 -0.01 1.25 2.35 -1.92 -3.22 115.58 115.25 1xa7 h ASN 101 Ca 0.24 -0.01 -0.22 0.00 -0.55 0.00 0.00 56.30 55.76 1xa7 h ASN 101 Cb -0.01 -0.11 0.01 0.00 0.05 0.00 0.00 38.32 38.26 1xa7 h ASN 101 CO -0.09 0.33 -0.80 0.71 -1.65 0.00 0.00 177.43 175.94 1xa7 h THR 102 N 0.55 1.31 0.00 2.81 1.35 -1.91 -2.16 112.91 114.86 1xa7 h THR 102 Ca 0.16 -2.06 0.00 0.00 -0.55 0.00 0.00 66.41 63.95 1xa7 h THR 102 Cb -0.05 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 1xa7 h THR 102 CO -0.04 0.64 0.00 0.00 -0.25 0.00 0.00 175.52 175.87 1xa7 n ALA 103 N -2.58 1.09 0.00 6.62 0.00 -0.21 -1.89 120.51 123.54 1xa7 n ALA 103 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1xa7 n ALA 103 Cb 0.75 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.31 1xa7 n ALA 103 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1xa7 n GLN 105 N 0.05 0.00 -0.17 0.00 7.27 -0.81 -0.74 117.38 122.97 1xa7 n GLN 105 Ca 0.00 0.00 0.08 0.00 0.07 0.00 0.00 57.00 57.15 1xa7 n GLN 105 Cb 0.00 0.00 0.17 0.00 2.41 0.00 0.00 30.24 32.82 1xa7 n GLN 105 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1xa7 n ASN 106 N 0.00 2.98 -3.56 1.69 3.02 -0.79 -5.01 115.26 113.59 1xa7 n ASN 106 Ca 0.00 -1.89 -0.21 0.00 -0.03 0.00 0.00 54.58 52.45 1xa7 n ASN 106 Cb 0.00 -0.22 0.02 0.00 -0.61 0.00 0.00 39.78 38.96 1xa7 n ASN 106 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1xa7 n SER 107 N 0.90 -5.83 -4.40 6.41 2.88 -0.76 -4.89 113.62 107.93 1xa7 n SER 107 Ca 0.14 -0.76 -0.44 0.00 -1.33 0.00 0.00 58.87 56.48 1xa7 n SER 107 Cb 0.46 -3.32 -0.05 0.00 -0.75 0.00 0.00 64.21 60.55 1xa7 n SER 107 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1xa7 s VAL 108 N -3.19 4.82 0.14 2.46 1.01 0.08 -4.93 120.40 120.80 1xa7 s VAL 108 Ca 0.20 -0.79 -0.20 0.00 0.00 0.00 0.00 61.98 61.18 1xa7 s VAL 108 Cb -0.07 -4.43 0.01 0.00 0.00 0.00 0.00 36.38 31.89 1xa7 s VAL 108 CO 0.85 -1.03 1.67 0.78 0.00 0.00 0.00 175.10 177.37 1xa7 h ASN 109 N 9.13 -0.40 -0.68 3.32 2.35 -1.90 -2.40 115.58 125.00 1xa7 h ASN 109 Ca -0.29 0.09 0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1xa7 h ASN 109 Cb 1.09 0.22 -0.04 0.00 0.05 0.00 0.00 38.32 39.64 1xa7 h ASN 109 CO 1.06 -0.16 0.45 4.11 -1.65 0.00 0.00 177.43 181.24 1xa7 h TRP 110 N -0.10 0.81 -0.55 1.19 5.08 -1.99 -1.58 115.95 118.81 1xa7 h TRP 110 Ca 0.12 0.02 -0.02 0.00 1.08 0.00 0.00 58.89 60.09 1xa7 h TRP 110 Cb 0.28 -0.27 -0.02 0.00 -3.00 0.00 0.00 29.16 26.15 1xa7 h TRP 110 CO -0.28 0.49 0.26 -0.92 -1.28 0.00 0.00 178.44 176.70 1xa7 h TYR 111 N 0.85 0.79 0.00 0.12 5.03 -1.84 -0.84 116.97 121.08 1xa7 h TYR 111 Ca 0.26 -0.04 -0.15 0.00 2.58 0.00 0.00 58.73 61.39 1xa7 h TYR 111 Cb -0.00 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 38.01 1xa7 h TYR 111 CO -0.00 0.61 -0.69 0.74 -1.32 0.00 0.00 178.16 177.50 1xa7 h PHE 112 N 0.73 0.00 -0.88 -3.82 0.04 -1.37 -3.05 116.94 108.59 1xa7 h PHE 112 Ca 0.19 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.95 1xa7 h PHE 112 Cb 0.12 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.23 1xa7 h PHE 112 CO -0.00 0.69 0.54 0.93 -0.60 0.00 0.00 178.31 179.87 1xa7 h GLU 113 N 0.00 1.19 -0.34 1.51 5.08 -1.00 -0.70 114.58 120.32 1xa7 h GLU 113 Ca -0.01 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1xa7 h GLU 113 Cb 1.50 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 1xa7 h GLU 113 CO 0.09 0.83 -0.05 0.00 -1.00 0.00 0.00 179.01 178.88 1xa7 h ARG 114 N 1.22 0.56 -0.05 2.33 3.08 -1.10 -2.15 114.38 118.27 1xa7 h ARG 114 Ca 0.32 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 1xa7 h ARG 114 Cb -0.06 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 1xa7 h ARG 114 CO -0.06 0.62 0.00 0.82 -1.07 0.00 0.00 179.97 180.28 1xa7 h ILE 115 N 0.53 1.25 0.00 2.04 2.04 -1.36 -3.30 117.51 118.71 1xa7 h ILE 115 Ca 0.11 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.15 1xa7 h ILE 115 Cb 0.42 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1xa7 h ILE 115 CO 0.02 0.21 -0.27 -1.28 0.00 0.00 0.00 178.15 176.83 1xa7 h SER 116 N -0.20 0.00 0.22 1.72 0.87 -0.71 -2.37 113.55 113.08 1xa7 h SER 116 Ca 0.01 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 1xa7 h SER 116 Cb 0.33 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1xa7 h SER 116 CO 0.00 0.27 -0.17 0.44 -0.53 0.00 0.00 176.83 176.84 1xa7 h ASP 117 N 0.00 0.00 0.71 6.23 3.32 -1.47 -2.13 116.42 123.08 1xa7 h ASP 117 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xa7 h ASP 117 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1xa7 h ASP 117 CO 0.04 0.17 -0.07 0.00 -1.72 0.00 0.00 179.24 177.66 1xa7 n GLN 118 N -4.16 0.24 -3.22 3.56 6.02 -0.89 -4.82 117.38 114.11 1xa7 n GLN 118 Ca -0.02 -0.04 -0.39 0.00 -0.01 0.00 0.00 57.00 56.54 1xa7 n GLN 118 Cb 0.24 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 1xa7 n GLN 118 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1xa7 s ILE 119 N -2.78 4.81 0.05 5.09 1.01 -0.80 -5.09 121.20 123.49 1xa7 s ILE 119 Ca 0.21 1.26 -0.14 0.00 0.00 0.00 0.00 60.65 61.98 1xa7 s ILE 119 Cb 0.19 -3.93 -0.06 0.00 0.01 0.00 0.00 42.46 38.68 1xa7 s ILE 119 CO 0.52 0.48 0.44 -2.16 0.00 0.00 0.00 174.94 174.21 1xa7 s PRO 120 N -0.60 3.90 0.41 2.79 0.04 -1.26 -5.01 135.00 135.28 1xa7 s PRO 120 Ca 0.30 0.38 0.26 0.00 0.04 0.00 0.00 61.00 61.99 1xa7 s PRO 120 Cb -0.19 -3.12 1.33 0.00 0.04 0.00 0.00 34.50 32.57 1xa7 s PRO 120 CO 0.18 0.62 1.64 -0.22 0.04 0.00 0.00 177.00 179.27 1xa7 h LYS 121 N 4.25 0.14 0.10 4.56 3.64 -1.98 -2.19 116.57 125.09 1xa7 h LYS 121 Ca -0.50 -0.01 -0.28 0.00 -1.27 0.00 0.00 60.65 58.59 1xa7 h LYS 121 Cb 1.21 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1xa7 h LYS 121 CO 0.64 0.10 -1.34 -2.95 -2.27 0.00 0.00 179.45 173.62 1xa7 h ASN 122 N 0.15 0.34 -0.58 4.20 -1.07 -1.98 0.22 115.58 116.86 1xa7 h ASN 122 Ca 0.78 -0.41 -0.02 0.00 0.07 0.00 0.00 56.30 56.72 1xa7 h ASN 122 Cb 2.29 -0.11 -0.03 0.00 -2.07 0.00 0.00 38.32 38.41 1xa7 h ASN 122 CO -0.46 1.33 0.28 0.22 0.07 0.00 0.00 177.43 178.87 1xa7 h TYR 123 N 0.06 0.83 -0.21 4.14 5.03 -1.84 0.79 116.97 125.76 1xa7 h TYR 123 Ca -0.16 -0.04 -0.06 0.00 2.58 0.00 0.00 58.73 61.05 1xa7 h TYR 123 Cb 1.96 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 39.98 1xa7 h TYR 123 CO 0.05 0.64 -0.09 1.15 -1.32 0.00 0.00 178.16 178.59 1xa7 h THR 124 N 0.79 1.30 -0.42 1.81 2.02 -1.06 -1.36 112.91 115.98 1xa7 h THR 124 Ca 0.20 -1.13 -0.05 0.00 0.77 0.00 0.00 66.41 66.20 1xa7 h THR 124 Cb 0.12 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1xa7 h THR 124 CO -0.03 0.34 0.07 0.00 0.37 0.00 0.00 175.52 176.28 1xa7 h ALA 125 N 0.72 0.56 -0.48 6.16 0.00 -0.61 -1.58 119.26 124.02 1xa7 h ALA 125 Ca 0.05 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.83 1xa7 h ALA 125 Cb 0.57 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.11 1xa7 h ALA 125 CO 0.03 0.28 -0.03 1.15 0.00 0.00 0.00 179.25 180.68 1xa7 h THR 126 N 0.56 0.60 -0.43 0.00 2.02 -0.69 -1.65 112.91 113.31 1xa7 h THR 126 Ca 0.13 -0.03 -0.12 0.00 0.77 0.00 0.00 66.41 67.16 1xa7 h THR 126 Cb 0.38 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1xa7 h THR 126 CO 0.01 0.02 -0.22 1.56 0.37 0.00 0.00 175.52 177.26 1xa7 h GLN 127 N 0.08 0.87 0.00 6.66 1.08 -0.98 -2.04 115.11 120.79 1xa7 h GLN 127 Ca 0.24 -0.36 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 1xa7 h GLN 127 Cb 0.36 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1xa7 h GLN 127 CO -0.42 1.00 0.00 -0.07 -0.95 0.00 0.00 178.83 178.38 1xa7 h LEU 128 N 0.75 0.00 0.10 1.46 4.07 -0.57 0.38 115.31 121.50 1xa7 h LEU 128 Ca 0.10 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.80 1xa7 h LEU 128 Cb 0.76 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.49 1xa7 h LEU 128 CO 0.06 0.00 -1.35 0.50 -1.08 0.00 0.00 178.44 176.57 1xa7 h LYS 129 N 0.00 0.21 -0.89 1.13 3.64 -0.89 -1.88 116.57 117.89 1xa7 h LYS 129 Ca 0.00 -0.36 0.14 0.00 -1.27 0.00 0.00 60.65 59.16 1xa7 h LYS 129 Cb 0.39 0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 1xa7 h LYS 129 CO 0.00 1.17 0.57 1.96 -2.27 0.00 0.00 179.45 180.89 1xa7 h GLN 130 N -0.39 0.68 0.00 1.90 4.20 -1.08 -3.07 115.11 117.35 1xa7 h GLN 130 Ca -0.30 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.37 1xa7 h GLN 130 Cb 1.69 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 29.32 1xa7 h GLN 130 CO 0.03 0.45 -1.09 1.28 -0.67 0.00 0.00 178.83 178.84 1xa7 n LEU 131 N -4.56 0.62 -2.70 1.46 4.77 0.13 -4.98 117.00 111.74 1xa7 n LEU 131 Ca 0.17 0.12 -0.16 0.00 -0.03 0.00 0.00 56.01 56.12 1xa7 n LEU 131 Cb 0.46 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.53 1xa7 n LEU 131 CO 0.29 -0.05 0.15 0.59 -1.33 0.00 0.00 177.39 177.05 1xa7 n ASN 132 N -2.24 -4.32 -4.54 -1.43 3.02 -1.10 -4.76 115.26 99.89 1xa7 n ASN 132 Ca 0.01 -0.40 -0.43 0.00 -0.03 0.00 0.00 54.58 53.74 1xa7 n ASN 132 Cb 0.49 -3.72 -0.02 0.00 -0.61 0.00 0.00 39.78 35.92 1xa7 n ASN 132 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1xa7 s TYR 133 N -3.23 2.84 0.00 3.10 5.04 -0.72 -4.94 117.35 119.43 1xa7 s TYR 133 Ca 0.31 -1.36 0.00 0.00 -2.44 0.00 0.00 57.07 53.58 1xa7 s TYR 133 Cb -0.14 -4.60 0.00 0.00 0.35 0.00 0.00 41.96 37.57 1xa7 s TYR 133 CO 0.52 -1.75 0.00 0.41 -1.34 0.00 0.00 175.55 173.38 1xa7 n GLY 134 N 5.81 1.88 0.13 8.97 0.00 -1.26 -2.03 105.19 118.68 1xa7 n GLY 134 Ca 0.37 -0.28 0.03 0.00 0.00 0.00 0.00 46.02 46.14 1xa7 n GLY 134 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xa7 n ASN 135 N -0.73 -0.11 -1.68 1.61 5.03 -0.26 -4.87 115.26 114.25 1xa7 n ASN 135 Ca 0.00 0.61 -0.19 0.00 0.87 0.00 0.00 54.58 55.87 1xa7 n ASN 135 Cb 0.00 -0.20 -0.07 0.00 -1.02 0.00 0.00 39.78 38.49 1xa7 n ASN 135 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1xa7 n LYS 136 N -4.52 -1.48 -3.17 3.52 5.02 -0.86 -4.92 118.16 111.76 1xa7 n LYS 136 Ca 0.06 1.11 -0.45 0.00 -2.02 0.00 0.00 58.31 57.02 1xa7 n LYS 136 Cb 0.20 -5.51 -0.05 0.00 -0.02 0.00 0.00 35.03 29.65 1xa7 n LYS 136 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1xa7 s ASN 137 N -2.55 6.19 0.00 4.39 3.04 -1.26 -4.89 114.94 119.86 1xa7 s ASN 137 Ca 0.00 -1.33 0.30 0.00 0.04 0.00 0.00 52.86 51.87 1xa7 s ASN 137 Cb 0.00 -2.28 1.53 0.00 -1.54 0.00 0.00 41.25 38.96 1xa7 s ASN 137 CO 0.00 -0.98 2.01 0.18 -3.04 0.00 0.00 177.10 175.27 1xa7 n LEU 138 N 6.06 0.65 0.00 3.21 4.77 -1.26 -2.25 117.00 128.17 1xa7 n LEU 138 Ca -0.10 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1xa7 n LEU 138 Cb 0.43 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1xa7 n LEU 138 CO 0.56 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 1xa7 n GLY 139 N 1.08 2.37 0.16 -0.72 0.00 -1.26 -0.15 105.19 106.67 1xa7 n GLY 139 Ca 0.22 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 46.13 1xa7 n GLY 139 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xa7 h SER 140 N 3.30 0.00 -2.80 1.61 4.64 -2.00 -3.47 113.55 114.83 1xa7 h SER 140 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 1xa7 h SER 140 Cb 0.00 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.14 1xa7 h SER 140 CO 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 176.83 175.74 1xa7 n TYR 141 N -2.56 -0.78 0.00 4.77 9.36 0.79 -5.03 117.16 123.71 1xa7 n TYR 141 Ca 0.04 0.30 0.00 0.00 3.32 0.00 0.00 57.90 61.56 1xa7 n TYR 141 Cb 0.41 -2.59 0.00 0.00 -0.63 0.00 0.00 39.34 36.52 1xa7 n TYR 141 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1xa7 n LYS 142 N -1.92 0.00 -2.32 2.98 4.01 -1.26 -4.85 118.16 114.80 1xa7 n LYS 142 Ca -0.04 0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.35 1xa7 n LYS 142 Cb 0.54 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.06 1xa7 n LYS 142 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1xa7 n SER 143 N 0.00 7.29 0.26 4.39 7.64 -1.26 -4.82 113.62 127.12 1xa7 n SER 143 Ca 0.00 -3.32 0.10 0.00 1.01 0.00 0.00 58.87 56.66 1xa7 n SER 143 Cb 0.00 -1.32 0.69 0.00 -1.01 0.00 0.00 64.21 62.57 1xa7 n SER 143 CO 0.00 0.00 0.00 0.10 -3.01 0.00 0.00 175.04 172.13 1xa7 h TYR 144 N 4.73 0.00 -0.03 1.43 -0.00 -1.89 -3.44 116.97 117.78 1xa7 h TYR 144 Ca 0.57 0.00 -0.70 0.00 0.00 0.00 0.00 58.73 58.60 1xa7 h TYR 144 Cb 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.09 1xa7 h TYR 144 CO 1.43 0.06 3.34 -2.67 -0.00 0.00 0.00 178.16 180.32 1xa7 n TRP 145 N -4.19 3.18 -0.00 0.10 2.14 -1.26 -3.33 117.44 114.07 1xa7 n TRP 145 Ca -0.03 -3.01 0.00 0.00 2.07 0.00 0.00 57.50 56.53 1xa7 n TRP 145 Cb 0.14 -2.52 0.00 0.00 -0.81 0.00 0.00 31.31 28.12 1xa7 n TRP 145 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1xa7 n GLU 147 N 5.25 0.00 0.00 -2.67 -0.58 -1.26 -2.15 120.64 119.23 1xa7 n GLU 147 Ca 0.60 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.34 1xa7 n GLU 147 Cb 0.34 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.74 1xa7 n GLU 147 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1xa7 n ASP 148 N 2.96 0.00 0.06 1.62 2.03 -1.25 -5.07 116.55 116.90 1xa7 n ASP 148 Ca 0.00 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.09 1xa7 n ASP 148 Cb 0.00 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.25 1xa7 n ASP 148 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1xa7 h SER 149 N 0.00 0.56 -3.07 1.67 4.64 -1.81 -3.46 113.55 112.08 1xa7 h SER 149 Ca 0.00 -0.93 -0.54 0.00 -0.47 0.00 0.00 61.79 59.85 1xa7 h SER 149 Cb 0.00 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 1xa7 h SER 149 CO 0.00 1.80 0.68 -0.22 -0.87 0.00 0.00 176.83 178.22 1xa7 s LEU 150 N -7.22 4.34 0.02 5.97 2.96 -0.96 -4.68 118.68 119.12 1xa7 s LEU 150 Ca -0.17 2.05 0.01 0.00 -0.22 0.00 0.00 54.13 55.79 1xa7 s LEU 150 Cb 0.06 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1xa7 s LEU 150 CO 0.83 -0.58 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.69 1xa7 s LYS 151 N 1.64 0.37 -0.01 1.98 1.02 -1.26 -4.09 119.74 119.40 1xa7 s LYS 151 Ca 0.60 -0.56 -0.14 0.00 0.02 0.00 0.00 55.97 55.89 1xa7 s LYS 151 Cb -0.30 -0.11 0.02 0.00 -0.52 0.00 0.00 37.83 36.92 1xa7 s LYS 151 CO 0.27 0.01 0.29 -1.50 -0.92 0.00 0.00 175.35 173.50 1xa7 s ILE 152 N -1.13 0.06 0.31 2.17 2.07 0.13 -1.11 121.20 123.70 1xa7 s ILE 152 Ca -0.10 -0.51 -0.04 0.00 -1.41 0.00 0.00 60.65 58.58 1xa7 s ILE 152 Cb -0.08 -0.62 -0.05 0.00 0.13 0.00 0.00 42.46 41.84 1xa7 s ILE 152 CO -0.00 -0.28 0.57 -0.94 -1.91 0.00 0.00 174.94 172.38 1xa7 s SER 153 N -1.39 6.42 0.26 4.50 1.04 -1.26 -1.10 113.70 122.17 1xa7 s SER 153 Ca -0.13 0.70 -0.01 0.00 0.48 0.00 0.00 55.95 56.99 1xa7 s SER 153 Cb -0.05 -2.14 0.53 0.00 0.10 0.00 0.00 66.02 64.46 1xa7 s SER 153 CO 0.03 -0.23 1.75 -1.13 0.98 0.00 0.00 173.24 174.64 1xa7 h ASN 154 N 1.47 0.45 -0.52 7.02 -1.24 -1.54 0.40 115.58 121.62 1xa7 h ASN 154 Ca -0.48 0.10 -0.04 0.00 0.71 0.00 0.00 56.30 56.59 1xa7 h ASN 154 Cb 1.19 0.04 -0.02 0.00 0.73 0.00 0.00 38.32 40.26 1xa7 h ASN 154 CO 0.65 0.17 0.18 0.25 -1.29 0.00 0.00 177.43 177.40 1xa7 h LEU 155 N 0.56 0.75 -0.98 0.34 5.85 -1.79 -2.76 115.31 117.28 1xa7 h LEU 155 Ca 0.46 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.92 1xa7 h LEU 155 Cb 0.68 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1xa7 h LEU 155 CO -0.38 0.74 0.07 -0.33 -0.34 0.00 0.00 178.44 178.20 1xa7 h GLU 156 N 0.71 0.81 -0.61 1.25 5.08 -1.53 -2.37 114.58 117.92 1xa7 h GLU 156 Ca 0.17 -0.19 0.12 0.00 -1.00 0.00 0.00 59.36 58.47 1xa7 h GLU 156 Cb 0.25 -0.11 -0.10 0.00 0.50 0.00 0.00 28.75 29.29 1xa7 h GLU 156 CO -0.01 0.77 0.06 1.96 -1.00 0.00 0.00 179.01 180.79 1xa7 h GLN 157 N 0.77 0.17 -0.15 2.33 1.08 -0.67 0.28 115.11 118.93 1xa7 h GLN 157 Ca 0.16 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.31 1xa7 h GLN 157 Cb 0.36 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1xa7 h GLN 157 CO 0.01 0.11 -0.05 0.28 -0.95 0.00 0.00 178.83 178.23 1xa7 h VAL 158 N 0.18 1.30 0.28 -0.54 2.07 -1.42 -0.60 116.25 117.52 1xa7 h VAL 158 Ca 0.32 -1.04 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1xa7 h VAL 158 Cb 0.51 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1xa7 h VAL 158 CO -0.47 0.31 -0.14 0.40 0.02 0.00 0.00 177.57 177.69 1xa7 h ILE 159 N -0.02 0.74 -0.56 4.57 1.08 -0.83 0.67 117.51 123.17 1xa7 h ILE 159 Ca 0.04 -0.59 -0.04 0.00 -0.39 0.00 0.00 64.86 63.88 1xa7 h ILE 159 Cb 0.50 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 35.27 1xa7 h ILE 159 CO 0.02 0.12 0.19 0.58 -0.69 0.00 0.00 178.15 178.37 1xa7 h VAL 160 N -0.70 1.21 -0.08 1.67 2.07 -0.56 -2.16 116.25 117.70 1xa7 h VAL 160 Ca -0.04 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 1xa7 h VAL 160 Cb 0.48 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1xa7 h VAL 160 CO 0.06 0.27 -0.03 0.15 0.02 0.00 0.00 177.57 178.05 1xa7 h PHE 161 N 0.81 0.17 -0.55 1.57 -0.00 -0.79 -3.18 116.94 114.97 1xa7 h PHE 161 Ca 0.19 -0.04 -0.03 0.00 -0.00 0.00 0.00 57.97 58.09 1xa7 h PHE 161 Cb 0.21 -0.04 -0.03 0.00 -0.00 0.00 0.00 35.95 36.09 1xa7 h PHE 161 CO 0.01 0.51 0.24 -0.22 -0.00 0.00 0.00 178.31 178.85 1xa7 h LYS 162 N -0.21 0.79 -4.77 1.11 3.64 -0.79 -3.42 116.57 112.92 1xa7 h LYS 162 Ca 0.02 -0.11 -0.56 0.00 -1.27 0.00 0.00 60.65 58.73 1xa7 h LYS 162 Cb 0.46 -0.15 0.04 0.00 -0.41 0.00 0.00 32.23 32.17 1xa7 h LYS 162 CO 0.01 0.63 1.86 0.09 -2.27 0.00 0.00 179.45 179.77 1xa7 n ASN 163 N -4.35 2.43 0.00 4.20 3.02 -0.82 -4.17 115.26 115.57 1xa7 n ASN 163 Ca 0.05 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 51.94 1xa7 n ASN 163 Cb 0.15 -1.19 0.00 0.00 -0.61 0.00 0.00 39.78 38.12 1xa7 n ASN 163 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xa7 n GLU 166 N 7.43 0.00 -2.05 3.52 -0.58 -1.26 -4.73 120.64 122.97 1xa7 n GLU 166 Ca 0.48 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.87 1xa7 n GLU 166 Cb 0.42 0.00 0.03 0.00 -0.57 0.00 0.00 31.44 31.32 1xa7 n GLU 166 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1xa7 s GLN 167 N 0.00 3.04 -0.80 3.49 -0.21 -1.26 -4.91 119.66 119.01 1xa7 s GLN 167 Ca 0.00 1.75 -0.18 0.00 0.02 0.00 0.00 55.36 56.94 1xa7 s GLN 167 Cb 0.00 -1.95 0.13 0.00 1.00 0.00 0.00 33.01 32.20 1xa7 s GLN 167 CO 0.00 -1.13 0.94 -0.80 -2.12 0.00 0.00 175.29 172.17 1xa7 s ASN 168 N -1.70 6.49 0.00 5.90 0.01 -1.26 -4.95 114.94 119.43 1xa7 s ASN 168 Ca 0.76 -1.90 0.00 0.00 -0.71 0.00 0.00 52.86 51.00 1xa7 s ASN 168 Cb -0.28 -2.34 0.00 0.00 0.41 0.00 0.00 41.25 39.04 1xa7 s ASN 168 CO 0.32 -1.02 0.00 -0.46 -1.51 0.00 0.00 177.10 174.43 1xa7 n ASN 169 N 6.12 0.33 -1.45 -1.22 6.94 -1.26 -5.06 115.26 119.66 1xa7 n ASN 169 Ca 0.11 0.00 0.06 0.00 -0.02 0.00 0.00 54.58 54.73 1xa7 n ASN 169 Cb 0.47 0.00 0.30 0.00 -2.36 0.00 0.00 39.78 38.19 1xa7 n ASN 169 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xa7 n HIS 170 N 0.00 1.41 -4.15 -2.53 1.44 -1.26 -4.86 115.22 105.27 1xa7 n HIS 170 Ca 0.00 -0.52 -0.33 0.00 -2.01 0.00 0.00 57.72 54.86 1xa7 n HIS 170 Cb 0.00 -0.32 -0.07 0.00 0.12 0.00 0.00 29.99 29.71 1xa7 n HIS 170 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1xa7 s PHE 171 N -2.10 3.24 0.73 -1.40 0.08 -1.26 -5.11 117.98 112.16 1xa7 s PHE 171 Ca 0.41 0.18 -0.11 0.00 0.12 0.00 0.00 56.93 57.53 1xa7 s PHE 171 Cb 0.29 -1.73 0.03 0.00 -0.57 0.00 0.00 43.02 41.05 1xa7 s PHE 171 CO 0.15 0.53 1.08 -1.54 -0.10 0.00 0.00 175.22 175.34 1xa7 s SER 172 N -1.66 5.11 0.31 1.36 1.04 -1.26 -4.96 113.70 113.64 1xa7 s SER 172 Ca 0.22 1.37 0.15 0.00 0.48 0.00 0.00 55.95 58.17 1xa7 s SER 172 Cb -0.12 -2.20 0.44 0.00 0.10 0.00 0.00 66.02 64.24 1xa7 s SER 172 CO 0.13 -1.58 1.63 0.11 0.98 0.00 0.00 173.24 174.50 1xa7 h LYS 173 N -0.82 0.00 0.52 4.02 6.56 -1.99 -2.70 116.57 122.16 1xa7 h LYS 173 Ca -0.45 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.11 1xa7 h LYS 173 Cb 1.24 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.91 1xa7 h LYS 173 CO 0.60 0.52 -0.25 0.87 -2.06 0.00 0.00 179.45 179.13 1xa7 h LYS 174 N 0.00 -0.67 -0.35 3.15 6.56 -1.99 -2.30 116.57 120.97 1xa7 h LYS 174 Ca -0.01 0.05 0.07 0.00 -1.06 0.00 0.00 60.65 59.70 1xa7 h LYS 174 Cb 1.08 0.15 -0.06 0.00 -0.57 0.00 0.00 32.23 32.84 1xa7 h LYS 174 CO 0.07 -0.36 -0.02 0.00 -2.06 0.00 0.00 179.45 177.08 1xa7 h ALA 175 N -0.62 0.30 -0.67 3.86 0.00 -1.96 0.69 119.26 120.85 1xa7 h ALA 175 Ca -0.07 0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1xa7 h ALA 175 Cb 0.61 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1xa7 h ALA 175 CO 0.12 -0.41 0.44 0.87 0.00 0.00 0.00 179.25 180.27 1xa7 h LYS 176 N 0.08 0.84 0.03 0.00 1.57 -1.54 0.71 116.57 118.26 1xa7 h LYS 176 Ca 0.17 -0.05 -0.22 0.00 -1.87 0.00 0.00 60.65 58.68 1xa7 h LYS 176 Cb 0.24 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1xa7 h LYS 176 CO -0.30 0.56 -1.04 -0.91 -0.57 0.00 0.00 179.45 177.19 1xa7 h ASN 177 N 0.87 0.11 -0.16 0.86 -0.26 -0.74 0.25 115.58 116.51 1xa7 h ASN 177 Ca 0.26 -0.11 -0.03 0.00 -0.56 0.00 0.00 56.30 55.85 1xa7 h ASN 177 Cb -0.03 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.19 1xa7 h ASN 177 CO -0.06 1.07 -0.03 -0.61 -1.06 0.00 0.00 177.43 176.74 1xa7 h GLN 178 N 0.02 0.30 0.16 0.81 4.15 0.12 -1.26 115.11 119.40 1xa7 h GLN 178 Ca -0.04 -0.11 0.01 0.00 0.77 0.00 0.00 58.65 59.28 1xa7 h GLN 178 Cb 1.78 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 29.43 1xa7 h GLN 178 CO 0.15 0.56 -0.22 1.25 -1.93 0.00 0.00 178.83 178.64 1xa7 h LEU 179 N 0.01 -0.61 -0.67 -2.39 5.85 0.47 -2.53 115.31 115.44 1xa7 h LEU 179 Ca 0.04 0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.94 1xa7 h LEU 179 Cb 0.45 0.22 -0.12 0.00 0.37 0.00 0.00 40.66 41.58 1xa7 h LEU 179 CO 0.01 -0.32 -0.38 0.28 -0.34 0.00 0.00 178.44 177.70 1xa7 h SER 180 N -0.44 -1.34 -0.42 1.25 0.02 -0.42 -0.61 113.55 111.58 1xa7 h SER 180 Ca 0.02 0.25 0.09 0.00 -0.84 0.00 0.00 61.79 61.31 1xa7 h SER 180 Cb 0.44 0.65 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 1xa7 h SER 180 CO -0.10 -0.31 0.29 0.28 -1.14 0.00 0.00 176.83 175.86 1xa7 h SER 181 N -0.15 0.15 1.06 3.07 0.02 -1.12 0.12 113.55 116.70 1xa7 h SER 181 Ca 0.23 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1xa7 h SER 181 Cb 0.56 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 1xa7 h SER 181 CO -0.74 0.10 -0.25 0.77 -1.14 0.00 0.00 176.83 175.57 1xa7 h SER 182 N 0.17 0.00 0.48 3.07 4.64 -0.69 -3.19 113.55 118.04 1xa7 h SER 182 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1xa7 h SER 182 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1xa7 h SER 182 CO -0.03 0.25 -0.35 0.18 -0.87 0.00 0.00 176.83 176.01 1xa7 n LEU 183 N -3.34 0.56 -4.71 5.97 4.77 -0.02 -4.48 117.00 115.75 1xa7 n LEU 183 Ca 0.01 -0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1xa7 n LEU 183 Cb 0.47 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1xa7 n LEU 183 CO 0.34 0.12 1.27 -0.22 -1.33 0.00 0.00 177.39 177.57 1xa7 s LEU 184 N -2.83 4.37 -0.02 2.23 2.96 -0.92 -1.39 118.68 123.08 1xa7 s LEU 184 Ca 0.16 2.57 -0.01 0.00 -0.22 0.00 0.00 54.13 56.63 1xa7 s LEU 184 Cb 0.18 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.28 1xa7 s LEU 184 CO 0.62 -0.85 -0.03 -0.38 -1.32 0.00 0.00 176.35 174.39 1xa7 n ILE 185 N 4.27 0.12 -4.17 6.68 5.41 -0.21 -4.92 119.36 126.55 1xa7 n ILE 185 Ca 0.15 -0.03 -0.16 0.00 1.00 0.00 0.00 62.75 63.71 1xa7 n ILE 185 Cb 0.39 -1.35 -0.14 0.00 -0.71 0.00 0.00 39.64 37.83 1xa7 n ILE 185 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1xa7 s LYS 186 N -2.04 0.48 -0.10 0.38 1.02 -0.83 -4.99 119.74 113.67 1xa7 s LYS 186 Ca -0.03 -0.31 -0.10 0.00 0.02 0.00 0.00 55.97 55.54 1xa7 s LYS 186 Cb 0.01 -0.43 0.03 0.00 -0.52 0.00 0.00 37.83 36.92 1xa7 s LYS 186 CO 0.04 0.11 0.29 0.21 -0.92 0.00 0.00 175.35 175.08 1xa7 s LYS 187 N -0.41 0.38 0.00 1.68 2.20 -1.26 0.46 119.74 122.79 1xa7 s LYS 187 Ca -0.00 0.31 0.00 0.00 -0.36 0.00 0.00 55.97 55.92 1xa7 s LYS 187 Cb -0.04 0.18 0.00 0.00 -1.51 0.00 0.00 37.83 36.46 1xa7 s LYS 187 CO -0.00 -0.06 0.00 0.27 -0.36 0.00 0.00 175.35 175.20 1xa7 n ASN 188 N 2.70 0.00 -0.21 1.43 0.23 0.67 -4.99 115.26 115.10 1xa7 n ASN 188 Ca -0.14 -0.70 -0.08 0.00 -0.53 0.00 0.00 54.58 53.13 1xa7 n ASN 188 Cb 0.58 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 38.32 1xa7 n ASN 188 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1xa7 h GLU 189 N 0.00 1.06 -0.55 -3.83 9.09 -2.02 -2.97 114.58 115.35 1xa7 h GLU 189 Ca 0.00 -0.32 -0.05 0.00 0.05 0.00 0.00 59.36 59.04 1xa7 h GLU 189 Cb 0.00 -0.10 -0.02 0.00 -1.65 0.00 0.00 28.75 26.97 1xa7 h GLU 189 CO 0.00 1.02 0.14 0.87 0.05 0.00 0.00 179.01 181.09 1xa7 h LYS 190 N 0.97 0.88 -2.75 1.06 1.57 -1.96 -3.47 116.57 112.87 1xa7 h LYS 190 Ca 0.18 -0.21 0.06 0.00 -1.87 0.00 0.00 60.65 58.82 1xa7 h LYS 190 Cb 0.53 -0.12 -0.10 0.00 0.08 0.00 0.00 32.23 32.62 1xa7 h LYS 190 CO 0.03 0.82 0.32 1.52 -0.57 0.00 0.00 179.45 181.56 1xa7 s TYR 191 N -5.33 -0.33 -0.19 -1.35 1.13 -1.12 -4.03 117.35 106.13 1xa7 s TYR 191 Ca -0.13 0.05 0.01 0.00 -1.41 0.00 0.00 57.07 55.59 1xa7 s TYR 191 Cb 0.12 0.61 0.04 0.00 -1.10 0.00 0.00 41.96 41.63 1xa7 s TYR 191 CO 0.81 -0.90 -0.12 -1.21 -2.51 0.00 0.00 175.55 171.61 1xa7 s GLU 192 N -3.60 2.24 -0.20 -3.49 2.02 0.44 -0.24 118.70 115.87 1xa7 s GLU 192 Ca 0.07 -0.83 -0.08 0.00 0.02 0.00 0.00 54.97 54.14 1xa7 s GLU 192 Cb -0.02 -2.42 -0.04 0.00 0.10 0.00 0.00 34.13 31.74 1xa7 s GLU 192 CO -0.04 -0.37 0.09 -1.17 0.02 0.00 0.00 175.26 173.79 1xa7 s LEU 193 N 1.37 3.85 0.01 1.80 2.96 0.17 -1.34 118.68 127.51 1xa7 s LEU 193 Ca 0.00 0.06 0.06 0.00 -0.22 0.00 0.00 54.13 54.03 1xa7 s LEU 193 Cb -0.15 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 1xa7 s LEU 193 CO -0.09 0.13 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.58 1xa7 s TYR 194 N 0.67 2.57 0.02 5.38 2.02 -0.01 -1.04 117.35 126.96 1xa7 s TYR 194 Ca 0.05 -0.25 -0.22 0.00 -0.37 0.00 0.00 57.07 56.27 1xa7 s TYR 194 Cb -0.13 -1.51 0.07 0.00 -0.40 0.00 0.00 41.96 40.00 1xa7 s TYR 194 CO 0.01 0.20 1.01 0.41 -1.57 0.00 0.00 175.55 175.62 1xa7 n GLY 195 N 1.83 0.38 3.07 0.71 0.00 -0.48 -1.52 105.19 109.18 1xa7 n GLY 195 Ca -0.16 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 1xa7 n GLY 195 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xa7 s LYS 196 N -2.02 0.22 0.42 1.61 2.47 0.40 -4.77 119.74 118.06 1xa7 s LYS 196 Ca 0.23 0.45 -0.01 0.00 -1.56 0.00 0.00 55.97 55.09 1xa7 s LYS 196 Cb -0.01 -0.05 -0.03 0.00 -1.46 0.00 0.00 37.83 36.29 1xa7 s LYS 196 CO 0.01 -0.12 0.65 0.95 0.16 0.00 0.00 175.35 177.00 1xa7 s THR 197 N 0.89 4.75 -0.13 3.43 -4.23 -1.26 -1.36 115.64 117.73 1xa7 s THR 197 Ca -0.06 -0.28 -0.05 0.00 -1.18 0.00 0.00 61.69 60.12 1xa7 s THR 197 Cb -0.08 -3.76 0.06 0.00 1.34 0.00 0.00 72.50 70.06 1xa7 s THR 197 CO -0.06 -0.58 0.28 -0.83 -0.54 0.00 0.00 174.62 172.89 1xa7 s GLY 198 N -4.11 -0.15 -0.10 3.99 0.00 -0.63 -3.95 107.32 102.38 1xa7 s GLY 198 Ca 0.44 1.01 0.04 0.00 0.00 0.00 0.00 44.72 46.21 1xa7 s GLY 198 CO 0.39 1.91 -0.22 -1.59 0.00 0.00 0.00 173.10 173.58 1xa7 s THR 199 N 2.26 1.95 0.06 0.90 2.01 -1.26 -0.03 115.64 121.53 1xa7 s THR 199 Ca -0.01 -0.95 0.02 0.00 0.31 0.00 0.00 61.69 61.06 1xa7 s THR 199 Cb -0.12 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.65 1xa7 s THR 199 CO -0.09 0.54 0.08 -0.83 -0.69 0.00 0.00 174.62 173.63 1xa7 s GLY 200 N 0.42 2.02 -0.08 4.40 0.00 0.10 -4.97 107.32 109.21 1xa7 s GLY 200 Ca -0.17 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.58 1xa7 s GLY 200 CO 0.07 -0.93 -0.09 -0.26 0.00 0.00 0.00 173.10 171.90 1xa7 s ILE 201 N -1.34 0.97 -0.04 0.90 -0.00 -1.26 -2.62 121.20 117.82 1xa7 s ILE 201 Ca 0.28 -0.33 0.06 0.00 -0.00 0.00 0.00 60.65 60.66 1xa7 s ILE 201 Cb -0.12 -0.95 -0.01 0.00 -0.00 0.00 0.00 42.46 41.38 1xa7 s ILE 201 CO 0.20 0.34 -0.21 -0.69 -0.00 0.00 0.00 174.94 174.57 1xa7 s VAL 202 N 1.16 1.73 -0.95 8.37 1.01 -0.56 -4.74 120.40 126.41 1xa7 s VAL 202 Ca -0.06 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 60.93 1xa7 s VAL 202 Cb -0.14 -1.46 0.08 0.00 0.00 0.00 0.00 36.38 34.86 1xa7 s VAL 202 CO -0.02 0.49 0.30 0.59 0.00 0.00 0.00 175.10 176.46 1xa7 n ASN 203 N 2.88 -2.26 0.00 3.32 3.02 -1.26 -1.85 115.26 119.11 1xa7 n ASN 203 Ca -0.17 -0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 1xa7 n ASN 203 Cb 0.52 -1.96 0.00 0.00 -0.61 0.00 0.00 39.78 37.73 1xa7 n ASN 203 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xa7 n GLY 204 N -0.87 3.00 3.84 7.41 0.00 -1.26 -5.01 105.19 112.30 1xa7 n GLY 204 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1xa7 n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xa7 s LYS 205 N -0.23 4.05 0.39 1.61 1.02 -0.77 -5.05 119.74 120.76 1xa7 s LYS 205 Ca 0.00 0.79 -0.24 0.00 0.02 0.00 0.00 55.97 56.54 1xa7 s LYS 205 Cb 0.00 -2.35 -0.10 0.00 -0.52 0.00 0.00 37.83 34.86 1xa7 s LYS 205 CO 0.00 0.08 0.99 0.71 -0.92 0.00 0.00 175.35 176.21 1xa7 s TYR 206 N -2.08 3.38 0.00 3.18 4.12 -1.26 -1.50 117.35 123.19 1xa7 s TYR 206 Ca 0.56 1.67 0.00 0.00 0.02 0.00 0.00 57.07 59.32 1xa7 s TYR 206 Cb -0.10 -2.99 0.00 0.00 -1.52 0.00 0.00 41.96 37.35 1xa7 s TYR 206 CO 0.17 -0.26 0.11 0.27 0.02 0.00 0.00 175.55 175.86 1xa7 n ASN 207 N -0.10 0.00 -3.12 2.29 6.94 -1.08 -4.73 115.26 115.47 1xa7 n ASN 207 Ca 0.05 -1.00 -0.06 0.00 -0.02 0.00 0.00 54.58 53.55 1xa7 n ASN 207 Cb 0.51 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.91 1xa7 n ASN 207 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1xa7 s ASN 208 N 0.00 -0.79 -0.11 0.53 2.47 -1.25 -4.51 114.94 111.29 1xa7 s ASN 208 Ca 0.00 -1.38 -0.01 0.00 0.42 0.00 0.00 52.86 51.89 1xa7 s ASN 208 Cb 0.00 1.51 -0.03 0.00 -1.45 0.00 0.00 41.25 41.29 1xa7 s ASN 208 CO 0.00 -0.15 -0.07 -0.83 -3.72 0.00 0.00 177.10 172.33 1xa7 s GLY 209 N 1.35 1.66 0.04 1.21 0.00 -0.86 0.02 107.32 110.74 1xa7 s GLY 209 Ca 0.22 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 44.08 1xa7 s GLY 209 CO -0.06 -0.39 -0.06 -0.98 0.00 0.00 0.00 173.10 171.61 1xa7 s TRP 210 N -0.21 0.55 -0.18 1.90 0.52 0.96 -0.55 118.94 121.93 1xa7 s TRP 210 Ca 0.03 -0.55 -0.04 0.00 0.02 0.00 0.00 56.10 55.55 1xa7 s TRP 210 Cb -0.13 -0.34 0.09 0.00 -1.15 0.00 0.00 33.47 31.94 1xa7 s TRP 210 CO 0.03 -0.13 0.27 0.12 0.02 0.00 0.00 176.95 177.25 1xa7 s PHE 211 N -1.63 -0.44 -0.03 -1.98 5.36 -0.89 -1.61 117.98 116.76 1xa7 s PHE 211 Ca -0.10 0.66 0.06 0.00 -0.96 0.00 0.00 56.93 56.59 1xa7 s PHE 211 Cb -0.08 -0.15 -0.01 0.00 -0.34 0.00 0.00 43.02 42.43 1xa7 s PHE 211 CO -0.01 -0.52 -0.22 0.14 -1.46 0.00 0.00 175.22 173.15 1xa7 s VAL 212 N 2.41 1.79 0.00 3.12 -7.23 -0.47 -1.18 120.40 118.84 1xa7 s VAL 212 Ca 0.06 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.28 1xa7 s VAL 212 Cb -0.14 -1.50 0.00 0.00 0.56 0.00 0.00 36.38 35.30 1xa7 s VAL 212 CO -0.11 0.50 0.00 0.61 -0.31 0.00 0.00 175.10 175.79 1xa7 n GLY 213 N 2.72 0.79 3.15 2.32 0.00 -0.50 -0.46 105.19 113.22 1xa7 n GLY 213 Ca -0.16 -0.70 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 1xa7 n GLY 213 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xa7 s TYR 214 N -2.39 0.35 -0.16 1.61 1.13 -0.57 -0.30 117.35 117.02 1xa7 s TYR 214 Ca 0.00 -0.84 -0.04 0.00 -1.41 0.00 0.00 57.07 54.78 1xa7 s TYR 214 Cb 0.00 -0.23 0.06 0.00 -1.10 0.00 0.00 41.96 40.68 1xa7 s TYR 214 CO 0.00 -0.46 0.07 0.54 -2.51 0.00 0.00 175.55 173.19 1xa7 s VAL 215 N -3.89 0.08 -0.04 -3.49 0.11 -0.73 -0.83 120.40 111.60 1xa7 s VAL 215 Ca 0.06 -0.18 -0.26 0.00 -2.93 0.00 0.00 61.98 58.67 1xa7 s VAL 215 Cb 0.06 -0.64 -0.03 0.00 -1.53 0.00 0.00 36.38 34.25 1xa7 s VAL 215 CO -0.10 -0.19 0.83 -0.63 -3.33 0.00 0.00 175.10 171.67 1xa7 s ILE 216 N 2.07 4.97 0.49 7.04 1.01 -0.45 -2.05 121.20 134.28 1xa7 s ILE 216 Ca 0.02 1.72 0.02 0.00 0.00 0.00 0.00 60.65 62.41 1xa7 s ILE 216 Cb -0.16 -4.17 0.02 0.00 0.01 0.00 0.00 42.46 38.17 1xa7 s ILE 216 CO -0.08 0.21 0.17 0.35 0.00 0.00 0.00 174.94 175.59 1xa7 n THR 217 N 3.85 0.00 0.20 2.92 -2.24 -0.63 -0.42 114.28 117.96 1xa7 n THR 217 Ca 0.02 -2.13 0.06 0.00 -2.27 0.00 0.00 64.05 59.73 1xa7 n THR 217 Cb 0.51 0.21 0.43 0.00 -2.10 0.00 0.00 70.33 69.38 1xa7 n THR 217 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1xa7 h ASN 218 N 0.89 0.00 0.35 3.42 4.21 -1.91 -3.32 115.58 119.22 1xa7 h ASN 218 Ca -0.36 0.00 -0.32 0.00 1.21 0.00 0.00 56.30 56.83 1xa7 h ASN 218 Cb 1.18 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 38.33 1xa7 h ASN 218 CO 0.58 0.32 -1.88 1.41 -1.29 0.00 0.00 177.43 176.57 1xa7 n HIS 219 N -3.77 0.81 -3.76 1.19 8.25 -1.26 -5.07 115.22 111.60 1xa7 n HIS 219 Ca -0.01 0.28 -0.08 0.00 -0.26 0.00 0.00 57.72 57.64 1xa7 n HIS 219 Cb 0.41 -1.14 -0.01 0.00 1.12 0.00 0.00 29.99 30.37 1xa7 n HIS 219 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1xa7 n ASP 220 N -3.03 -1.03 -3.59 0.41 4.64 -1.25 -5.08 116.55 107.62 1xa7 n ASP 220 Ca -0.22 -2.14 -0.29 0.00 -1.38 0.00 0.00 54.79 50.76 1xa7 n ASP 220 Cb 1.07 1.84 -0.13 0.00 -1.04 0.00 0.00 41.12 42.87 1xa7 n ASP 220 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 1xa7 s LYS 221 N -2.37 0.80 -0.58 -0.67 2.20 -1.26 -1.61 119.74 116.25 1xa7 s LYS 221 Ca 0.16 -1.48 -0.18 0.00 -0.36 0.00 0.00 55.97 54.11 1xa7 s LYS 221 Cb -0.01 -1.74 0.10 0.00 -1.51 0.00 0.00 37.83 34.67 1xa7 s LYS 221 CO 0.11 -1.15 0.67 0.71 -0.36 0.00 0.00 175.35 175.33 1xa7 s TYR 222 N 0.96 3.04 0.62 4.03 2.02 -0.87 -4.58 117.35 122.57 1xa7 s TYR 222 Ca 0.16 -0.98 -0.16 0.00 -0.37 0.00 0.00 57.07 55.73 1xa7 s TYR 222 Cb -0.22 -3.94 -0.02 0.00 -0.40 0.00 0.00 41.96 37.38 1xa7 s TYR 222 CO -0.05 -1.23 1.09 0.71 -1.57 0.00 0.00 175.55 174.50 1xa7 s TYR 223 N 2.52 2.77 0.10 2.71 1.51 0.19 -1.78 117.35 125.36 1xa7 s TYR 223 Ca 0.10 1.54 -0.27 0.00 -1.01 0.00 0.00 57.07 57.44 1xa7 s TYR 223 Cb -0.25 -3.12 0.08 0.00 -0.11 0.00 0.00 41.96 38.56 1xa7 s TYR 223 CO 0.06 -1.45 1.01 -0.59 -1.11 0.00 0.00 175.55 173.47 1xa7 s PHE 224 N -2.30 -0.14 -0.30 2.71 -0.12 0.59 0.79 117.98 119.21 1xa7 s PHE 224 Ca 0.67 -0.10 -0.16 0.00 -0.05 0.00 0.00 56.93 57.28 1xa7 s PHE 224 Cb -0.19 0.61 0.18 0.00 -0.63 0.00 0.00 43.02 42.98 1xa7 s PHE 224 CO 0.37 -0.69 1.11 0.00 -0.05 0.00 0.00 175.22 175.96 1xa7 s ALA 225 N -3.11 -2.69 -0.04 1.99 0.00 -0.89 -1.40 121.76 115.62 1xa7 s ALA 225 Ca 0.11 2.03 0.04 0.00 0.00 0.00 0.00 51.96 54.14 1xa7 s ALA 225 Cb -0.00 -1.99 -0.03 0.00 0.00 0.00 0.00 23.12 21.10 1xa7 s ALA 225 CO -0.00 -0.64 -0.14 0.99 0.00 0.00 0.00 175.76 175.97 1xa7 s THR 226 N 1.73 3.07 0.03 0.00 2.01 -0.32 -1.68 115.64 120.48 1xa7 s THR 226 Ca -0.05 -0.75 0.07 0.00 0.31 0.00 0.00 61.69 61.27 1xa7 s THR 226 Cb -0.03 -2.21 -0.02 0.00 0.01 0.00 0.00 72.50 70.24 1xa7 s THR 226 CO -0.15 0.57 -0.21 -2.28 -0.69 0.00 0.00 174.62 171.86 1xa7 s HIS 227 N -0.75 1.88 -0.15 4.92 2.46 -0.44 -2.09 115.29 121.11 1xa7 s HIS 227 Ca 0.12 -0.37 0.00 0.00 0.47 0.00 0.00 55.06 55.28 1xa7 s HIS 227 Cb -0.11 -1.15 0.03 0.00 -0.13 0.00 0.00 32.58 31.23 1xa7 s HIS 227 CO 0.01 0.06 -0.10 -0.51 -2.47 0.00 0.00 174.74 171.73 1xa7 s LEU 228 N -0.99 1.68 -0.09 8.88 1.43 0.29 -1.11 118.68 128.78 1xa7 s LEU 228 Ca 0.08 -0.56 0.15 0.00 -1.03 0.00 0.00 54.13 52.77 1xa7 s LEU 228 Cb -0.09 -1.07 -0.22 0.00 0.03 0.00 0.00 46.19 44.85 1xa7 s LEU 228 CO 0.01 -0.11 0.20 -1.54 0.23 0.00 0.00 176.35 175.14 1xa7 n SER 229 N 4.81 1.30 -3.92 2.29 3.41 -1.26 -2.02 113.62 118.23 1xa7 n SER 229 Ca -0.15 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.38 1xa7 n SER 229 Cb 0.49 1.29 -0.08 0.00 -0.26 0.00 0.00 64.21 65.65 1xa7 n SER 229 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1xa7 s ASP 230 N -4.36 0.21 0.00 4.04 -0.00 -1.26 -4.81 116.67 110.48 1xa7 s ASP 230 Ca -0.07 -0.68 0.00 0.00 -0.00 0.00 0.00 52.55 51.80 1xa7 s ASP 230 Cb 0.07 0.28 0.00 0.00 -0.00 0.00 0.00 42.92 43.28 1xa7 s ASP 230 CO 0.64 -0.64 0.00 0.61 -0.00 0.00 0.00 175.17 175.78 1xa7 n GLY 231 N 0.20 0.95 2.35 0.21 0.00 -1.26 -4.52 105.19 103.11 1xa7 n GLY 231 Ca -0.16 -0.90 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 1xa7 n GLY 231 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xa7 n LYS 232 N 0.00 1.65 -1.96 1.61 5.02 -1.26 -5.09 118.16 118.14 1xa7 n LYS 232 Ca 0.00 -3.93 -0.43 0.00 -2.02 0.00 0.00 58.31 51.93 1xa7 n LYS 232 Cb 0.00 -1.75 -0.03 0.00 -0.02 0.00 0.00 35.03 33.23 1xa7 n LYS 232 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1xa7 s PRO 233 N -2.01 3.58 0.07 1.97 0.04 -1.26 -4.76 135.00 132.62 1xa7 s PRO 233 Ca 0.39 1.73 -0.11 0.00 0.04 0.00 0.00 61.00 63.05 1xa7 s PRO 233 Cb 0.19 -4.15 0.01 0.00 0.04 0.00 0.00 34.50 30.59 1xa7 s PRO 233 CO -0.07 -1.57 0.24 0.45 0.04 0.00 0.00 177.00 176.09 1xa7 s SER 234 N 5.46 -0.00 -0.03 6.66 0.15 -1.26 -4.30 113.70 120.39 1xa7 s SER 234 Ca 0.80 -0.42 -0.24 0.00 0.70 0.00 0.00 55.95 56.79 1xa7 s SER 234 Cb -0.27 0.34 -0.20 0.00 -1.71 0.00 0.00 66.02 64.18 1xa7 s SER 234 CO 0.33 -0.66 1.17 1.23 1.20 0.00 0.00 173.24 176.50 1xa7 h GLY 235 N 3.04 0.15 -0.02 9.45 0.00 -1.79 -2.08 103.07 111.82 1xa7 h GLY 235 Ca -0.33 -0.19 0.08 0.00 0.00 0.00 0.00 47.33 46.89 1xa7 h GLY 235 CO 0.50 0.17 -0.25 0.50 0.00 0.00 0.00 176.54 177.47 1xa7 h LYS 236 N -0.43 -0.18 -0.68 4.80 1.57 -1.90 0.37 116.57 120.11 1xa7 h LYS 236 Ca -0.00 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1xa7 h LYS 236 Cb 0.73 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.06 1xa7 h LYS 236 CO 0.02 -0.12 0.16 -0.91 -0.57 0.00 0.00 179.45 178.03 1xa7 h ASN 237 N -0.19 1.04 -0.65 0.86 2.35 -1.86 0.40 115.58 117.53 1xa7 h ASN 237 Ca 0.18 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1xa7 h ASN 237 Cb 0.47 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1xa7 h ASN 237 CO -0.48 1.00 0.42 0.00 -1.65 0.00 0.00 177.43 176.72 1xa7 h ALA 238 N 1.07 1.52 -0.10 -0.83 0.00 -0.85 -0.67 119.26 119.41 1xa7 h ALA 238 Ca 0.21 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1xa7 h ALA 238 Cb 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1xa7 h ALA 238 CO 0.00 0.44 -0.02 1.49 0.00 0.00 0.00 179.25 181.16 1xa7 h GLU 239 N 0.89 0.18 -0.10 0.00 4.81 0.97 -1.98 114.58 119.34 1xa7 h GLU 239 Ca 0.24 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.44 1xa7 h GLU 239 Cb -0.09 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.23 1xa7 h GLU 239 CO -0.05 0.49 -0.20 -0.07 -0.73 0.00 0.00 179.01 178.45 1xa7 h LEU 240 N -0.14 -0.60 -0.74 1.64 3.38 0.05 -0.93 115.31 117.97 1xa7 h LEU 240 Ca 0.02 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1xa7 h LEU 240 Cb 0.42 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1xa7 h LEU 240 CO 0.01 -0.25 0.42 0.40 0.09 0.00 0.00 178.44 179.11 1xa7 h ILE 241 N -0.26 1.22 0.00 1.22 2.04 -1.22 -0.48 117.51 120.02 1xa7 h ILE 241 Ca 0.09 -0.52 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 1xa7 h ILE 241 Cb 0.39 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1xa7 h ILE 241 CO -0.25 0.24 -0.10 0.28 0.00 0.00 0.00 178.15 178.32 1xa7 h SER 242 N 1.02 0.00 0.00 1.72 0.02 -0.68 -1.81 113.55 113.82 1xa7 h SER 242 Ca 0.26 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 61.02 1xa7 h SER 242 Cb 0.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 1xa7 h SER 242 CO -0.05 0.10 -1.16 -0.62 -1.14 0.00 0.00 176.83 173.96 1xa7 n GLU 243 N -3.89 0.55 -0.33 3.45 1.02 -0.42 -2.06 120.64 118.97 1xa7 n GLU 243 Ca -0.02 0.57 0.15 0.00 -0.02 0.00 0.00 57.16 57.84 1xa7 n GLU 243 Cb 0.19 -1.74 0.31 0.00 -0.02 0.00 0.00 31.44 30.19 1xa7 n GLU 243 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1xa7 h LYS 244 N -1.00 0.04 -0.12 3.49 1.57 -1.15 -1.46 116.57 117.95 1xa7 h LYS 244 Ca -0.30 -0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.28 1xa7 h LYS 244 Cb 1.18 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.49 1xa7 h LYS 244 CO -0.18 0.03 -0.70 0.82 -0.57 0.00 0.00 179.45 178.85 1xa7 h ILE 245 N 0.04 1.32 -0.31 1.86 2.04 -1.41 0.15 117.51 121.20 1xa7 h ILE 245 Ca 0.61 -1.95 -0.07 0.00 1.00 0.00 0.00 64.86 64.45 1xa7 h ILE 245 Cb 1.28 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 39.47 1xa7 h ILE 245 CO -0.85 0.60 -0.10 -0.07 0.00 0.00 0.00 178.15 177.73 1xa7 h LEU 246 N 0.35 0.51 -0.24 1.44 3.38 -1.09 -3.06 115.31 116.59 1xa7 h LEU 246 Ca -0.05 -0.13 -0.17 0.00 0.09 0.00 0.00 57.88 57.62 1xa7 h LEU 246 Cb 1.34 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1xa7 h LEU 246 CO 0.14 0.65 -0.49 0.50 0.09 0.00 0.00 178.44 179.33 1xa7 h LYS 247 N 0.49 0.77 -1.72 1.13 3.11 -1.25 0.96 116.57 120.05 1xa7 h LYS 247 Ca 0.09 -0.50 0.00 0.00 -2.81 0.00 0.00 60.65 57.44 1xa7 h LYS 247 Cb 0.48 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.77 1xa7 h LYS 247 CO 0.03 1.12 0.00 -1.91 -2.81 0.00 0.00 179.45 175.88 1xa7 n GLU 248 N -4.11 0.35 -0.35 1.90 0.00 0.04 -4.57 120.64 113.89 1xa7 n GLU 248 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.11 1xa7 n GLU 248 Cb 0.59 -1.32 0.00 0.00 0.00 0.00 0.00 31.44 30.71 1xa7 n GLU 248 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1xa7 n GLY 250 N 1.04 0.30 0.09 8.31 0.00 -1.07 -5.08 105.19 108.78 1xa7 n GLY 250 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1xa7 n GLY 250 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xa7 n VAL 251 N 0.00 0.58 0.09 1.61 0.31 0.31 -5.17 118.33 116.06 1xa7 n VAL 251 Ca 0.00 -0.08 0.01 0.00 -0.01 0.00 0.00 64.34 64.26 1xa7 n VAL 251 Cb 0.56 -0.74 0.01 0.00 -0.91 0.00 0.00 33.84 32.76 1xa7 n VAL 251 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69