#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xa7 n THR 5 N 0.00 0.08 -2.18 9.51 -2.24 -1.26 -4.88 114.28 113.31 1xa7 n THR 5 Ca 0.00 -0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 1xa7 n THR 5 Cb 0.00 0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.22 1xa7 n THR 5 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1xa7 s ASP 6 N -3.27 6.86 0.08 3.42 1.01 -1.26 -5.00 116.67 118.51 1xa7 s ASP 6 Ca 0.11 2.53 -0.17 0.00 0.71 0.00 0.00 52.55 55.72 1xa7 s ASP 6 Cb 0.17 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.51 1xa7 s ASP 6 CO 0.67 -0.52 0.40 -0.31 0.21 0.00 0.00 175.17 175.63 1xa7 s TYR 7 N -0.47 -0.23 0.41 4.23 2.02 -1.26 -5.16 117.35 116.89 1xa7 s TYR 7 Ca 0.53 0.07 -0.08 0.00 -0.37 0.00 0.00 57.07 57.22 1xa7 s TYR 7 Cb -0.38 0.23 -0.05 0.00 -0.40 0.00 0.00 41.96 41.35 1xa7 s TYR 7 CO 0.44 -0.62 0.74 -0.80 -1.57 0.00 0.00 175.55 173.74 1xa7 s ASN 8 N -2.35 6.44 -0.12 2.29 0.01 -1.26 -4.66 114.94 115.29 1xa7 s ASN 8 Ca -0.02 1.02 -0.29 0.00 -0.71 0.00 0.00 52.86 52.86 1xa7 s ASN 8 Cb 0.00 -2.28 -0.06 0.00 0.41 0.00 0.00 41.25 39.33 1xa7 s ASN 8 CO -0.06 -0.42 1.90 -0.47 -1.51 0.00 0.00 177.10 176.53 1xa7 s TYR 9 N -2.43 1.57 -0.12 2.20 5.04 -0.22 -4.89 117.35 118.50 1xa7 s TYR 9 Ca 0.49 0.16 -0.14 0.00 -2.44 0.00 0.00 57.07 55.15 1xa7 s TYR 9 Cb -0.10 -4.05 -0.12 0.00 0.35 0.00 0.00 41.96 38.03 1xa7 s TYR 9 CO 0.35 -4.23 0.38 1.57 -1.34 0.00 0.00 175.55 172.28 1xa7 h LYS 10 N 11.69 -0.01 -5.86 4.97 -0.00 -1.93 -3.47 116.57 121.96 1xa7 h LYS 10 Ca -0.42 0.00 -0.64 0.00 -0.00 0.00 0.00 60.65 59.60 1xa7 h LYS 10 Cb 1.21 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.42 1xa7 h LYS 10 CO 0.97 0.46 1.47 1.63 -0.00 0.00 0.00 179.45 183.98 1xa7 n LYS 11 N -4.71 0.94 -1.17 0.07 5.02 -1.26 -4.93 118.16 112.11 1xa7 n LYS 11 Ca -0.05 0.22 -0.33 0.00 -2.02 0.00 0.00 58.31 56.13 1xa7 n LYS 11 Cb 0.23 -2.44 0.12 0.00 -0.02 0.00 0.00 35.03 32.91 1xa7 n LYS 11 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1xa7 s PRO 12 N 6.67 1.74 0.00 1.97 0.04 -1.26 -5.15 135.00 139.01 1xa7 s PRO 12 Ca 1.11 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.87 1xa7 s PRO 12 Cb -0.85 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1xa7 s PRO 12 CO 0.47 -2.13 0.00 -0.11 0.04 0.00 0.00 177.00 175.27 1xa7 n LEU 13 N -3.22 0.00 -4.55 -3.56 -0.00 -1.26 -5.30 117.00 99.11 1xa7 n LEU 13 Ca 0.13 0.00 -0.51 0.00 -0.00 0.00 0.00 56.01 55.63 1xa7 n LEU 13 Cb 0.51 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.88 1xa7 n LEU 13 CO 0.48 0.00 0.64 1.67 -0.00 0.00 0.00 177.39 180.18 1xa7 n GLN 18 N 0.00 0.82 -4.48 1.96 7.27 -1.18 -5.24 117.38 116.53 1xa7 n GLN 18 Ca 0.00 0.29 -0.23 0.00 0.07 0.00 0.00 57.00 57.13 1xa7 n GLN 18 Cb 0.00 -1.76 -0.11 0.00 2.41 0.00 0.00 30.24 30.78 1xa7 n GLN 18 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1xa7 s ILE 19 N -0.14 1.60 0.11 1.69 -5.25 -1.26 -2.75 121.20 115.19 1xa7 s ILE 19 Ca 0.77 -2.06 0.04 0.00 -0.99 0.00 0.00 60.65 58.41 1xa7 s ILE 19 Cb -0.95 -2.69 -0.04 0.00 2.95 0.00 0.00 42.46 41.72 1xa7 s ILE 19 CO 0.53 -0.13 -0.11 -0.22 -1.79 0.00 0.00 174.94 173.22 1xa7 s LEU 20 N -3.52 2.42 -0.34 0.37 1.98 -0.14 -4.90 118.68 114.55 1xa7 s LEU 20 Ca 0.33 -0.83 0.03 0.00 -2.89 0.00 0.00 54.13 50.76 1xa7 s LEU 20 Cb 0.07 -0.34 0.10 0.00 0.66 0.00 0.00 46.19 46.68 1xa7 s LEU 20 CO 0.15 -0.25 0.07 -0.62 -1.89 0.00 0.00 176.35 173.80 1xa7 s ASP 21 N -2.53 4.52 -0.09 3.68 3.68 -1.26 -4.26 116.67 120.42 1xa7 s ASP 21 Ca 0.07 -2.03 0.12 0.00 2.13 0.00 0.00 52.55 52.85 1xa7 s ASP 21 Cb -0.03 -1.39 0.29 0.00 -1.45 0.00 0.00 42.92 40.34 1xa7 s ASP 21 CO 0.00 -0.39 1.21 0.29 0.13 0.00 0.00 175.17 176.42 1xa7 n LYS 22 N 4.39 2.41 -0.36 4.34 4.76 -1.26 -4.83 118.16 127.61 1xa7 n LYS 22 Ca 0.02 -2.30 0.32 0.00 -2.87 0.00 0.00 58.31 53.48 1xa7 n LYS 22 Cb 0.42 -1.43 0.49 0.00 -1.84 0.00 0.00 35.03 32.66 1xa7 n LYS 22 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1xa7 n SER 23 N -0.62 0.00 -0.08 4.39 7.64 -1.26 -1.55 113.62 122.14 1xa7 n SER 23 Ca 0.13 0.68 -0.11 0.00 1.01 0.00 0.00 58.87 60.58 1xa7 n SER 23 Cb 0.58 -0.29 -0.15 0.00 -1.01 0.00 0.00 64.21 63.33 1xa7 n SER 23 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1xa7 n LYS 24 N -3.15 0.67 -0.25 1.43 0.00 -1.26 -2.78 118.16 112.83 1xa7 n LYS 24 Ca 0.27 0.09 -0.06 0.00 -0.00 0.00 0.00 58.31 58.60 1xa7 n LYS 24 Cb 1.38 -1.59 0.05 0.00 -0.00 0.00 0.00 35.03 34.87 1xa7 n LYS 24 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 1xa7 h ILE 25 N 0.00 1.24 -0.24 0.58 1.08 -1.67 -2.94 117.51 115.56 1xa7 h ILE 25 Ca -0.48 -0.71 -0.09 0.00 -0.39 0.00 0.00 64.86 63.19 1xa7 h ILE 25 Cb 2.16 0.40 -0.01 0.00 -3.07 0.00 0.00 36.82 36.30 1xa7 h ILE 25 CO 0.03 0.29 -0.23 -0.26 -0.69 0.00 0.00 178.15 177.30 1xa7 h PHE 26 N 0.99 0.49 0.00 1.37 0.04 -1.60 -3.47 116.94 114.76 1xa7 h PHE 26 Ca 0.24 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.91 1xa7 h PHE 26 Cb 0.16 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 38.19 1xa7 h PHE 26 CO 0.01 0.64 0.00 0.41 -0.60 0.00 0.00 178.31 178.77 1xa7 n GLY 27 N -0.46 2.75 0.81 -1.45 0.00 -1.11 -1.86 105.19 103.88 1xa7 n GLY 27 Ca -0.00 0.33 0.05 0.00 0.00 0.00 0.00 46.02 46.39 1xa7 n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xa7 n SER 28 N 6.74 2.32 -4.78 1.61 3.41 -1.26 -4.80 113.62 116.86 1xa7 n SER 28 Ca 0.00 -2.14 -0.25 0.00 -0.26 0.00 0.00 58.87 56.21 1xa7 n SER 28 Cb 0.00 -0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 63.54 1xa7 n SER 28 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1xa7 s ASN 29 N -0.79 5.39 0.07 4.04 -0.87 -0.77 -4.20 114.94 117.80 1xa7 s ASN 29 Ca 0.24 -0.21 0.06 0.00 -1.57 0.00 0.00 52.86 51.38 1xa7 s ASN 29 Cb 0.15 -1.36 -0.03 0.00 -0.02 0.00 0.00 41.25 39.99 1xa7 s ASN 29 CO 0.13 0.05 -0.16 -0.55 -2.57 0.00 0.00 177.10 174.00 1xa7 s SER 30 N -3.25 1.86 0.00 -1.22 0.15 0.27 -4.83 113.70 106.68 1xa7 s SER 30 Ca 0.31 -0.60 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1xa7 s SER 30 Cb -0.09 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.14 1xa7 s SER 30 CO 0.23 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.25 1xa7 n GLY 31 N 1.36 0.03 3.30 9.45 0.00 -1.26 -1.68 105.19 116.39 1xa7 n GLY 31 Ca -0.20 -1.24 -0.18 0.00 0.00 0.00 0.00 46.02 44.40 1xa7 n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xa7 s SER 32 N -4.00 1.47 0.00 1.61 1.04 -0.87 -4.81 113.70 108.13 1xa7 s SER 32 Ca 0.00 -1.65 0.01 0.00 0.48 0.00 0.00 55.95 54.78 1xa7 s SER 32 Cb 0.00 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.61 1xa7 s SER 32 CO 0.00 -0.98 -0.02 0.12 0.98 0.00 0.00 173.24 173.33 1xa7 s PHE 33 N -3.58 0.22 0.28 5.02 5.36 -1.00 -2.32 117.98 121.96 1xa7 s PHE 33 Ca 0.38 -0.12 0.03 0.00 -0.96 0.00 0.00 56.93 56.26 1xa7 s PHE 33 Cb 0.04 -0.14 -0.04 0.00 -0.34 0.00 0.00 43.02 42.54 1xa7 s PHE 33 CO 0.22 -0.03 0.19 0.08 -1.46 0.00 0.00 175.22 174.22 1xa7 s VAL 34 N -0.30 0.12 -0.30 3.12 1.01 -0.08 -1.97 120.40 122.01 1xa7 s VAL 34 Ca -0.02 -2.00 -0.16 0.00 0.00 0.00 0.00 61.98 59.80 1xa7 s VAL 34 Cb -0.02 -2.50 0.19 0.00 0.00 0.00 0.00 36.38 34.05 1xa7 s VAL 34 CO -0.00 0.00 1.19 -0.47 0.00 0.00 0.00 175.10 175.82 1xa7 s TYR 36 N -3.73 -0.20 0.29 5.22 5.04 0.95 -0.61 117.35 124.31 1xa7 s TYR 36 Ca 0.38 0.39 0.02 0.00 -2.44 0.00 0.00 57.07 55.42 1xa7 s TYR 36 Cb 0.05 0.12 0.05 0.00 0.35 0.00 0.00 41.96 42.53 1xa7 s TYR 36 CO 0.19 -0.10 0.40 0.45 -1.34 0.00 0.00 175.55 175.15 1xa7 n SER 37 N 3.55 0.73 0.00 4.32 2.88 -0.60 -2.05 113.62 122.45 1xa7 n SER 37 Ca -0.15 -1.57 0.00 0.00 -1.33 0.00 0.00 58.87 55.82 1xa7 n SER 37 Cb 0.56 -0.24 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 1xa7 n SER 37 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1xa7 n LYS 39 N -1.70 0.00 0.00 -1.46 4.81 -1.26 -0.04 118.16 118.51 1xa7 n LYS 39 Ca 0.07 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.62 1xa7 n LYS 39 Cb 0.26 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.33 1xa7 n LYS 39 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1xa7 n LYS 40 N 0.00 0.09 -3.85 1.64 4.76 -1.26 -5.01 118.16 114.54 1xa7 n LYS 40 Ca 0.00 -0.07 -0.27 0.00 -2.87 0.00 0.00 58.31 55.10 1xa7 n LYS 40 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 1xa7 n LYS 40 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1xa7 n ASP 41 N -1.39 -1.97 -4.03 4.39 2.03 0.94 -4.99 116.55 111.53 1xa7 n ASP 41 Ca 0.05 -1.00 -0.08 0.00 0.52 0.00 0.00 54.79 54.28 1xa7 n ASP 41 Cb 0.34 -3.22 -0.11 0.00 -0.72 0.00 0.00 41.12 37.42 1xa7 n ASP 41 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1xa7 s LYS 42 N -6.35 0.45 -0.00 -0.67 2.47 -1.17 -4.99 119.74 109.49 1xa7 s LYS 42 Ca 0.15 -0.89 -0.02 0.00 -1.56 0.00 0.00 55.97 53.65 1xa7 s LYS 42 Cb -0.06 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.42 1xa7 s LYS 42 CO 0.87 -0.08 0.17 0.71 0.16 0.00 0.00 175.35 177.19 1xa7 s TYR 43 N -2.59 3.51 -0.11 4.03 2.02 -1.26 -1.56 117.35 121.39 1xa7 s TYR 43 Ca -0.05 0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.98 1xa7 s TYR 43 Cb -0.02 -1.81 0.02 0.00 -0.40 0.00 0.00 41.96 39.75 1xa7 s TYR 43 CO -0.05 0.63 -0.11 0.71 -1.57 0.00 0.00 175.55 175.16 1xa7 s TYR 44 N -1.32 1.69 -0.03 2.71 2.02 -1.25 -3.10 117.35 118.06 1xa7 s TYR 44 Ca 0.27 -0.83 0.02 0.00 -0.37 0.00 0.00 57.07 56.16 1xa7 s TYR 44 Cb -0.13 -1.31 0.01 0.00 -0.40 0.00 0.00 41.96 40.13 1xa7 s TYR 44 CO 0.19 -0.50 -0.08 -1.50 -1.57 0.00 0.00 175.55 172.08 1xa7 s ILE 45 N 1.40 0.71 -0.21 2.71 1.10 -1.11 -4.37 121.20 121.43 1xa7 s ILE 45 Ca 0.00 -0.29 -0.12 0.00 -0.51 0.00 0.00 60.65 59.73 1xa7 s ILE 45 Cb -0.13 -0.66 -0.05 0.00 0.15 0.00 0.00 42.46 41.77 1xa7 s ILE 45 CO -0.06 0.24 0.24 -0.47 -2.11 0.00 0.00 174.94 172.77 1xa7 s TYR 46 N 0.43 3.37 -0.45 3.50 6.14 -0.83 -0.97 117.35 128.54 1xa7 s TYR 46 Ca -0.07 0.40 -0.02 0.00 0.64 0.00 0.00 57.07 58.03 1xa7 s TYR 46 Cb -0.11 -2.33 -0.02 0.00 0.42 0.00 0.00 41.96 39.93 1xa7 s TYR 46 CO 0.01 0.11 0.41 -1.71 0.64 0.00 0.00 175.55 175.01 1xa7 n ASN 47 N 4.08 -4.53 -0.32 4.32 2.85 -1.26 -2.37 115.26 118.02 1xa7 n ASN 47 Ca -0.13 -0.22 0.12 0.00 -0.11 0.00 0.00 54.58 54.24 1xa7 n ASN 47 Cb 0.52 -2.95 0.29 0.00 1.24 0.00 0.00 39.78 38.88 1xa7 n ASN 47 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1xa7 h GLU 48 N -0.22 0.59 -0.25 1.20 4.22 -1.93 -0.76 114.58 117.44 1xa7 h GLU 48 Ca -0.18 -0.04 -0.12 0.00 0.08 0.00 0.00 59.36 59.11 1xa7 h GLU 48 Cb 1.09 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 1xa7 h GLU 48 CO 0.19 0.39 -0.32 -0.22 -2.18 0.00 0.00 179.01 176.88 1xa7 h LYS 49 N 0.61 0.66 -0.14 1.92 3.64 -2.00 -3.07 116.57 118.19 1xa7 h LYS 49 Ca 0.54 -0.37 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 1xa7 h LYS 49 Cb 0.89 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1xa7 h LYS 49 CO -0.42 0.98 -0.35 1.49 -2.27 0.00 0.00 179.45 178.88 1xa7 h GLU 50 N 0.37 0.49 -0.27 1.90 4.22 -1.73 -2.61 114.58 116.95 1xa7 h GLU 50 Ca 0.03 -0.34 0.08 0.00 0.08 0.00 0.00 59.36 59.22 1xa7 h GLU 50 Cb 0.89 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1xa7 h GLU 50 CO 0.08 0.95 0.94 0.66 -2.18 0.00 0.00 179.01 179.45 1xa7 h SER 51 N 0.10 0.00 -0.02 1.04 4.64 -1.16 0.59 113.55 118.74 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 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1xa7 h SER 51 CO 0.08 0.00 -0.38 0.54 -0.87 0.00 0.00 176.83 176.20 1xa7 n ARG 52 N -2.80 1.44 -2.66 4.77 1.74 -0.98 -1.09 116.66 117.08 1xa7 n ARG 52 Ca 0.06 -1.17 -0.41 0.00 -0.77 0.00 0.00 57.85 55.56 1xa7 n ARG 52 Cb 1.03 -1.46 -0.05 0.00 -1.02 0.00 0.00 32.46 30.96 1xa7 n ARG 52 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1xa7 s LYS 53 N -2.35 4.72 -0.20 5.56 -0.14 0.20 -1.06 119.74 126.47 1xa7 s LYS 53 Ca 0.20 1.57 -0.21 0.00 -1.36 0.00 0.00 55.97 56.17 1xa7 s LYS 53 Cb 0.18 -3.30 -0.02 0.00 -1.68 0.00 0.00 37.83 33.01 1xa7 s LYS 53 CO 0.51 0.29 0.64 1.03 -0.76 0.00 0.00 175.35 177.05 1xa7 s ARG 54 N -0.65 4.21 0.26 1.68 0.52 -1.26 -3.94 118.95 119.76 1xa7 s ARG 54 Ca 0.45 0.63 0.07 0.00 -0.52 0.00 0.00 55.73 56.36 1xa7 s ARG 54 Cb -0.27 -3.58 -0.05 0.00 0.52 0.00 0.00 34.95 31.57 1xa7 s ARG 54 CO 0.33 -0.26 -0.10 0.71 0.02 0.00 0.00 175.30 176.01 1xa7 s TYR 55 N 1.97 1.92 0.36 -0.53 2.02 -0.32 -4.78 117.35 118.00 1xa7 s TYR 55 Ca 0.29 -0.63 -0.27 0.00 -0.37 0.00 0.00 57.07 56.09 1xa7 s TYR 55 Cb -0.16 -1.02 -0.09 0.00 -0.40 0.00 0.00 41.96 40.29 1xa7 s TYR 55 CO 0.10 0.35 1.24 0.45 -1.57 0.00 0.00 175.55 176.12 1xa7 s SER 56 N -3.42 6.67 0.00 2.29 0.15 -1.26 0.96 113.70 119.10 1xa7 s SER 56 Ca 0.28 2.52 0.28 0.00 0.70 0.00 0.00 55.95 59.73 1xa7 s SER 56 Cb 0.02 -2.63 1.14 0.00 -1.71 0.00 0.00 66.02 62.83 1xa7 s SER 56 CO 0.11 -0.59 1.82 -0.81 1.20 0.00 0.00 173.24 174.97 1xa7 n PRO 57 N 0.50 0.39 0.00 5.44 -0.04 -1.25 -4.85 135.00 135.19 1xa7 n PRO 57 Ca 0.02 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1xa7 n PRO 57 Cb 0.44 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 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 -1.20 0.00 0.00 3.54 0.23 -0.75 -3.88 115.26 113.20 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 0.76 5.53 -2.24 -1.25 -4.38 114.28 112.71 1xa7 n THR 60 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 1xa7 n THR 60 Cb 0.00 0.00 0.50 0.00 -2.10 0.00 0.00 70.33 68.73 1xa7 n THR 60 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xa7 n TYR 61 N 0.00 0.29 0.06 4.78 9.36 -1.25 -2.80 117.16 127.60 1xa7 n TYR 61 Ca 0.00 0.09 0.11 0.00 3.32 0.00 0.00 57.90 61.42 1xa7 n TYR 61 Cb 0.00 -0.65 0.57 0.00 -0.63 0.00 0.00 39.34 38.63 1xa7 n TYR 61 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 1xa7 h LYS 62 N 0.00 0.21 -0.54 2.98 1.57 -1.93 0.32 116.57 119.19 1xa7 h LYS 62 Ca 0.00 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.88 1xa7 h LYS 62 Cb 0.50 -0.05 -0.10 0.00 0.08 0.00 0.00 32.23 32.66 1xa7 h LYS 62 CO 0.00 0.14 -0.13 0.82 -0.57 0.00 0.00 179.45 179.71 1xa7 h ILE 63 N 0.22 0.46 0.00 1.86 2.04 -1.92 0.79 117.51 120.95 1xa7 h ILE 63 Ca 0.16 -0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.84 1xa7 h ILE 63 Cb 0.35 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1xa7 h ILE 63 CO -0.03 0.00 -0.83 1.88 0.00 0.00 0.00 178.15 179.17 1xa7 h TYR 64 N 0.00 0.00 -0.43 1.37 0.05 -1.21 -3.22 116.97 113.53 1xa7 h TYR 64 Ca 0.26 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.92 1xa7 h TYR 64 Cb 0.40 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 1xa7 h TYR 64 CO -0.45 0.83 -0.21 -0.07 -1.05 0.00 0.00 178.16 177.21 1xa7 h LEU 65 N 0.00 0.93 -1.09 3.88 4.07 -0.43 -0.29 115.31 122.38 1xa7 h LEU 65 Ca -0.01 -0.40 0.00 0.00 0.08 0.00 0.00 57.88 57.55 1xa7 h LEU 65 Cb 1.51 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.99 1xa7 h LEU 65 CO 0.11 1.13 0.00 0.00 -1.08 0.00 0.00 178.44 178.60 1xa7 n ALA 66 N -2.50 1.12 0.00 1.53 0.00 0.21 -1.13 120.51 119.74 1xa7 n ALA 66 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1xa7 n ALA 66 Cb 0.44 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 0.52 0.00 -0.04 0.00 3.72 -0.12 -1.18 117.46 120.36 1xa7 n PHE 68 Ca 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 1xa7 n PHE 68 Cb 0.01 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.52 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 0.85 1.97 1.37 0.00 -1.37 -1.70 103.07 104.19 1xa7 h GLY 69 Ca 0.00 -1.10 -0.18 0.00 0.00 0.00 0.00 47.33 46.05 1xa7 h GLY 69 CO 0.00 0.98 -0.85 1.41 0.00 0.00 0.00 176.54 178.08 1xa7 h LEU 70 N 0.56 0.03 -0.03 3.11 3.38 -1.31 0.49 115.31 121.54 1xa7 h LEU 70 Ca -0.02 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1xa7 h LEU 70 Cb 1.27 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1xa7 h LEU 70 CO 0.14 0.87 -0.07 -0.78 0.09 0.00 0.00 178.44 178.68 1xa7 h ASP 71 N 0.01 0.12 0.00 -0.43 3.58 -1.77 -3.09 116.42 114.84 1xa7 h ASP 71 Ca -0.01 -0.58 0.00 0.00 0.42 0.00 0.00 57.03 56.86 1xa7 h ASP 71 Cb 1.50 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.52 1xa7 h ASP 71 CO 0.11 0.68 0.00 0.54 -2.88 0.00 0.00 179.24 177.69 1xa7 n ARG 72 N -4.71 0.95 -0.67 0.28 1.74 -0.66 -4.91 116.66 108.68 1xa7 n ARG 72 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1xa7 n ARG 72 Cb 0.34 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 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 -0.96 0.00 -0.45 -1.55 8.25 -1.01 -4.86 115.22 114.63 1xa7 n HIS 73 Ca 0.21 0.00 0.39 0.00 -0.26 0.00 0.00 57.72 58.06 1xa7 n HIS 73 Cb 0.10 -0.50 0.72 0.00 1.12 0.00 0.00 29.99 31.43 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 0.26 -4.45 1.59 1.08 -1.21 -3.39 117.51 111.39 1xa7 h ILE 74 Ca 0.00 -0.02 -0.20 0.00 -0.39 0.00 0.00 64.86 64.24 1xa7 h ILE 74 Cb 0.00 0.18 -0.15 0.00 -3.07 0.00 0.00 36.82 33.79 1xa7 h ILE 74 CO 0.00 0.01 -0.60 0.27 -0.69 0.00 0.00 178.15 177.14 1xa7 s ILE 75 N -5.06 0.05 0.10 -0.67 -4.36 -0.97 -5.01 121.20 105.28 1xa7 s ILE 75 Ca -0.06 -1.91 -0.04 0.00 -0.26 0.00 0.00 60.65 58.38 1xa7 s ILE 75 Cb 0.26 -2.25 0.01 0.00 1.25 0.00 0.00 42.46 41.73 1xa7 s ILE 75 CO 0.83 -0.23 0.20 -0.46 0.24 0.00 0.00 174.94 175.53 1xa7 n ASN 76 N -0.19 -0.59 -0.08 4.36 0.23 -1.07 -4.19 115.26 113.73 1xa7 n ASN 76 Ca -0.02 -1.42 -0.09 0.00 -0.53 0.00 0.00 54.58 52.53 1xa7 n ASN 76 Cb 0.65 0.99 -0.02 0.00 -2.08 0.00 0.00 39.78 39.31 1xa7 n ASN 76 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 1xa7 h ASP 77 N 0.51 -1.05 0.39 0.53 3.58 -1.97 -3.08 116.42 115.34 1xa7 h ASP 77 Ca -0.09 0.17 -0.31 0.00 0.42 0.00 0.00 57.03 57.23 1xa7 h ASP 77 Cb 0.32 0.48 -0.05 0.00 1.72 0.00 0.00 39.33 41.79 1xa7 h ASP 77 CO 0.11 -0.33 -1.84 -0.62 -2.88 0.00 0.00 179.24 173.68 1xa7 n GLU 78 N -5.41 0.64 -3.21 0.28 -0.58 -1.26 -4.49 120.64 106.61 1xa7 n GLU 78 Ca -0.01 0.24 -0.25 0.00 -0.42 0.00 0.00 57.16 56.73 1xa7 n GLU 78 Cb 0.33 -1.74 -0.06 0.00 -0.57 0.00 0.00 31.44 29.40 1xa7 n GLU 78 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xa7 n ASN 79 N -2.99 2.59 0.00 1.62 3.02 -1.23 -4.67 115.26 113.60 1xa7 n ASN 79 Ca -0.20 -3.25 0.15 0.00 -0.03 0.00 0.00 54.58 51.25 1xa7 n ASN 79 Cb 1.07 -0.63 0.89 0.00 -0.61 0.00 0.00 39.78 40.51 1xa7 n ASN 79 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xa7 n SER 80 N 0.61 0.00 -3.32 6.41 7.64 -1.17 -2.61 113.62 121.18 1xa7 n SER 80 Ca 0.27 -1.01 -0.22 0.00 1.01 0.00 0.00 58.87 58.92 1xa7 n SER 80 Cb 0.48 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 63.89 1xa7 n SER 80 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1xa7 n ARG 81 N -0.98 -3.16 -4.28 1.43 0.00 -1.25 -4.28 116.66 104.14 1xa7 n ARG 81 Ca 0.23 -1.05 -0.23 0.00 -0.00 0.00 0.00 57.85 56.79 1xa7 n ARG 81 Cb 0.10 -1.59 -0.08 0.00 -0.00 0.00 0.00 32.46 30.90 1xa7 n ARG 81 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1xa7 s SER 83 N -2.55 4.43 0.28 2.89 1.04 -1.26 -4.98 113.70 113.55 1xa7 s SER 83 Ca 0.48 -0.78 -0.28 0.00 0.48 0.00 0.00 55.95 55.85 1xa7 s SER 83 Cb -0.09 -0.71 -0.09 0.00 0.10 0.00 0.00 66.02 65.23 1xa7 s SER 83 CO 0.40 -0.11 0.97 0.86 0.98 0.00 0.00 173.24 176.35 1xa7 s TRP 84 N -2.40 3.78 -0.71 5.02 -0.00 -1.26 -4.94 118.94 118.43 1xa7 s TRP 84 Ca 0.33 1.82 0.08 0.00 -0.00 0.00 0.00 56.10 58.34 1xa7 s TRP 84 Cb -0.04 -3.02 0.46 0.00 -0.00 0.00 0.00 33.47 30.87 1xa7 s TRP 84 CO 0.20 0.14 1.23 0.27 -0.00 0.00 0.00 176.95 178.79 1xa7 n ASN 85 N 1.05 3.58 -2.76 5.86 6.94 -1.26 -4.89 115.26 123.78 1xa7 n ASN 85 Ca -0.00 -2.48 -0.16 0.00 -0.02 0.00 0.00 54.58 51.92 1xa7 n ASN 85 Cb 0.48 -0.58 -0.00 0.00 -2.36 0.00 0.00 39.78 37.32 1xa7 n ASN 85 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1xa7 n HIS 86 N 0.40 -1.58 -3.62 -2.53 8.25 -1.26 -4.95 115.22 109.93 1xa7 n HIS 86 Ca 0.16 0.17 -0.37 0.00 -0.26 0.00 0.00 57.72 57.43 1xa7 n HIS 86 Cb 0.75 -2.88 -0.09 0.00 1.12 0.00 0.00 29.99 28.90 1xa7 n HIS 86 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1xa7 s LYS 87 N -5.37 4.09 -0.48 -0.41 2.47 -1.26 -5.04 119.74 113.75 1xa7 s LYS 87 Ca 0.14 -0.19 -0.28 0.00 -1.56 0.00 0.00 55.97 54.08 1xa7 s LYS 87 Cb -0.07 -3.53 -0.00 0.00 -1.46 0.00 0.00 37.83 32.76 1xa7 s LYS 87 CO 0.17 0.06 1.61 -1.58 0.16 0.00 0.00 175.35 175.77 1xa7 s HIS 88 N 1.07 2.05 0.32 4.03 5.65 -1.26 -4.97 115.29 122.18 1xa7 s HIS 88 Ca 0.09 0.62 -0.05 0.00 0.25 0.00 0.00 55.06 55.98 1xa7 s HIS 88 Cb -0.14 -4.24 -0.05 0.00 -1.18 0.00 0.00 32.58 26.97 1xa7 s HIS 88 CO 0.05 -2.31 0.59 0.71 -0.65 0.00 0.00 174.74 173.13 1xa7 s TYR 89 N 6.80 3.49 0.16 3.88 1.51 -1.26 -5.03 117.35 126.90 1xa7 s TYR 89 Ca 0.65 0.66 -0.15 0.00 -1.01 0.00 0.00 57.07 57.21 1xa7 s TYR 89 Cb -0.15 -2.13 0.10 0.00 -0.11 0.00 0.00 41.96 39.68 1xa7 s TYR 89 CO 0.28 0.10 1.73 -1.00 -1.11 0.00 0.00 175.55 175.55 1xa7 h PRO 90 N 1.39 0.22 -6.30 -1.71 0.13 -2.02 -3.41 132.00 120.30 1xa7 h PRO 90 Ca -0.48 -0.01 -0.55 0.00 -0.87 0.00 0.00 66.00 64.09 1xa7 h PRO 90 Cb 1.19 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1xa7 h PRO 90 CO 0.65 0.15 0.96 -0.06 -0.23 0.00 0.00 178.00 179.46 1xa7 s PHE 91 N -6.16 2.46 -0.46 1.56 0.40 -1.26 -4.89 117.98 109.63 1xa7 s PHE 91 Ca -0.13 0.55 0.24 0.00 -0.60 0.00 0.00 56.93 56.99 1xa7 s PHE 91 Cb 0.13 -3.76 0.99 0.00 0.51 0.00 0.00 43.02 40.89 1xa7 s PHE 91 CO 0.71 -3.01 1.73 -0.25 0.70 0.00 0.00 175.22 175.10 1xa7 n ASP 92 N 6.30 0.71 0.11 1.36 9.92 -1.26 -2.89 116.55 130.80 1xa7 n ASP 92 Ca 0.15 0.67 -0.02 0.00 -0.53 0.00 0.00 54.79 55.06 1xa7 n ASP 92 Cb 0.43 -0.82 0.02 0.00 -0.64 0.00 0.00 41.12 40.11 1xa7 n ASP 92 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xa7 h ALA 93 N 2.26 0.62 0.00 2.24 0.00 -1.95 -3.05 119.26 119.38 1xa7 h ALA 93 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1xa7 h ALA 93 Cb 0.38 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1xa7 h ALA 93 CO 0.00 0.93 0.00 0.91 0.00 0.00 0.00 179.25 181.09 1xa7 n TRP 94 N -3.43 0.33 -3.13 0.00 7.02 -1.14 -4.45 117.44 112.64 1xa7 n TRP 94 Ca 0.00 0.13 -0.38 0.00 -1.02 0.00 0.00 57.50 56.24 1xa7 n TRP 94 Cb 0.78 -0.72 -0.02 0.00 -2.42 0.00 0.00 31.31 28.94 1xa7 n TRP 94 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1xa7 n ASN 95 N -1.81 5.64 -3.64 -0.99 3.02 -1.16 -4.93 115.26 111.40 1xa7 n ASN 95 Ca 0.03 -3.43 0.00 0.00 -0.03 0.00 0.00 54.58 51.15 1xa7 n ASN 95 Cb 0.17 -1.09 0.00 0.00 -0.61 0.00 0.00 39.78 38.26 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 -2.72 0.69 0.56 3.52 -2.85 -1.26 -5.07 119.74 112.61 1xa7 s LYS 96 Ca 0.34 -0.41 -0.20 0.00 -1.00 0.00 0.00 55.97 54.70 1xa7 s LYS 96 Cb 0.08 0.22 -0.05 0.00 -2.06 0.00 0.00 37.83 36.01 1xa7 s LYS 96 CO 0.07 -0.32 1.12 -1.91 0.10 0.00 0.00 175.35 174.41 1xa7 n GLU 97 N -0.61 1.22 -4.42 1.78 4.07 -1.26 -4.31 120.64 117.11 1xa7 n GLU 97 Ca -0.05 0.46 -0.25 0.00 -0.06 0.00 0.00 57.16 57.26 1xa7 n GLU 97 Cb 0.61 -2.30 -0.10 0.00 -0.06 0.00 0.00 31.44 29.59 1xa7 n GLU 97 CO 0.00 0.00 0.00 -0.65 -0.06 0.00 0.00 177.13 176.42 1xa7 s GLN 98 N -2.73 1.78 0.18 5.31 -1.52 -1.26 -5.02 119.66 116.40 1xa7 s GLN 98 Ca 0.73 -1.62 0.02 0.00 -1.95 0.00 0.00 55.36 52.54 1xa7 s GLN 98 Cb -0.43 -1.88 -0.01 0.00 -0.22 0.00 0.00 33.01 30.47 1xa7 s GLN 98 CO 0.49 0.36 0.06 -0.40 -0.25 0.00 0.00 175.29 175.55 1xa7 n ASP 99 N -0.42 1.08 0.10 5.90 5.68 -1.26 -3.89 116.55 123.74 1xa7 n ASP 99 Ca -0.07 -1.93 -0.13 0.00 -0.50 0.00 0.00 54.79 52.15 1xa7 n ASP 99 Cb 0.59 0.44 -0.08 0.00 -1.14 0.00 0.00 41.12 40.92 1xa7 n ASP 99 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1xa7 h LEU 100 N 0.00 -0.21 -0.47 -2.12 5.85 -1.95 -0.28 115.31 116.13 1xa7 h LEU 100 Ca -0.14 -0.19 0.09 0.00 0.84 0.00 0.00 57.88 58.49 1xa7 h LEU 100 Cb 0.52 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 1xa7 h LEU 100 CO 0.22 0.07 -0.01 0.78 -0.34 0.00 0.00 178.44 179.16 1xa7 h ASN 101 N -0.50 -0.23 -0.48 1.25 2.35 -1.92 -2.66 115.58 113.39 1xa7 h ASN 101 Ca -0.03 0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 1xa7 h ASN 101 Cb 0.38 0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.94 1xa7 h ASN 101 CO 0.04 -0.08 0.27 0.74 -1.65 0.00 0.00 177.43 176.76 1xa7 h THR 102 N 0.10 1.16 0.00 2.81 2.02 -1.89 -0.34 112.91 116.78 1xa7 h THR 102 Ca 0.23 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1xa7 h THR 102 Cb 0.35 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1xa7 h THR 102 CO -0.40 0.17 0.00 0.00 0.37 0.00 0.00 175.52 175.66 1xa7 n ALA 103 N -2.27 2.07 0.00 6.16 0.00 -0.13 -1.85 120.51 124.49 1xa7 n ALA 103 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1xa7 n ALA 103 Cb 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1xa7 n ALA 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xa7 n GLN 105 N 0.37 0.00 -0.29 0.00 6.02 -0.14 -0.83 117.38 122.52 1xa7 n GLN 105 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.07 1xa7 n GLN 105 Cb 0.24 0.00 0.23 0.00 1.02 0.00 0.00 30.24 31.73 1xa7 n GLN 105 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1xa7 n ASN 106 N 0.00 3.45 -4.11 1.08 3.02 -0.77 -4.99 115.26 112.93 1xa7 n ASN 106 Ca 0.00 -2.07 -0.44 0.00 -0.03 0.00 0.00 54.58 52.04 1xa7 n ASN 106 Cb 0.00 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 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 -3.25 -4.53 6.41 2.88 -0.21 -4.83 113.62 110.99 1xa7 n SER 107 Ca 0.17 -1.29 -0.43 0.00 -1.33 0.00 0.00 58.87 56.00 1xa7 n SER 107 Cb 0.55 -1.70 -0.04 0.00 -0.75 0.00 0.00 64.21 62.27 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 -3.68 4.24 0.24 2.46 1.01 -0.01 -4.91 120.40 119.75 1xa7 s VAL 108 Ca 0.41 0.35 -0.07 0.00 0.00 0.00 0.00 61.98 62.67 1xa7 s VAL 108 Cb -0.22 -4.63 0.23 0.00 0.00 0.00 0.00 36.38 31.75 1xa7 s VAL 108 CO 0.98 -1.27 1.90 0.78 0.00 0.00 0.00 175.10 177.49 1xa7 h ASN 109 N 9.46 1.04 -0.12 3.32 2.35 -1.88 -2.83 115.58 126.91 1xa7 h ASN 109 Ca -0.26 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.42 1xa7 h ASN 109 Cb 1.07 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.17 1xa7 h ASN 109 CO 1.14 0.73 -0.06 4.11 -1.65 0.00 0.00 177.43 181.71 1xa7 h TRP 110 N 1.22 0.41 -0.43 1.19 5.08 -1.97 -0.79 115.95 120.65 1xa7 h TRP 110 Ca 0.35 -0.04 -0.06 0.00 1.08 0.00 0.00 58.89 60.22 1xa7 h TRP 110 Cb -0.08 -0.12 -0.02 0.00 -3.00 0.00 0.00 29.16 25.95 1xa7 h TRP 110 CO -0.01 0.46 0.03 -0.92 -1.28 0.00 0.00 178.44 176.71 1xa7 h TYR 111 N 0.38 0.80 -0.05 0.12 5.03 -1.91 -1.10 116.97 120.23 1xa7 h TYR 111 Ca 0.08 -0.13 -0.17 0.00 2.58 0.00 0.00 58.73 61.09 1xa7 h TYR 111 Cb 0.34 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.40 1xa7 h TYR 111 CO 0.01 0.78 -0.73 0.74 -1.32 0.00 0.00 178.16 177.65 1xa7 h PHE 112 N 0.58 0.39 -0.09 -3.82 0.04 -1.45 -2.73 116.94 109.87 1xa7 h PHE 112 Ca 0.12 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.63 1xa7 h PHE 112 Cb 0.45 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 1xa7 h PHE 112 CO 0.03 0.92 -0.35 0.93 -0.60 0.00 0.00 178.31 179.24 1xa7 h GLU 113 N 0.20 0.18 0.00 1.51 5.08 -1.02 -0.66 114.58 119.86 1xa7 h GLU 113 Ca -0.03 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.15 1xa7 h GLU 113 Cb 1.29 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 1xa7 h GLU 113 CO 0.12 0.52 -0.53 0.00 -1.00 0.00 0.00 179.01 178.11 1xa7 h ARG 114 N 0.16 0.00 -0.23 2.33 3.08 -1.10 -1.87 114.38 116.74 1xa7 h ARG 114 Ca 0.02 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1xa7 h ARG 114 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 1xa7 h ARG 114 CO 0.05 0.53 -0.00 0.82 -1.07 0.00 0.00 179.97 180.30 1xa7 h ILE 115 N 0.00 1.26 -0.41 2.04 2.04 -1.08 -3.14 117.51 118.22 1xa7 h ILE 115 Ca -0.01 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 64.96 1xa7 h ILE 115 Cb 1.02 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 1xa7 h ILE 115 CO 0.07 0.28 0.25 -1.28 0.00 0.00 0.00 178.15 177.47 1xa7 h SER 116 N 0.18 0.47 -0.76 1.72 0.87 -0.90 -2.12 113.55 113.01 1xa7 h SER 116 Ca 0.07 -0.02 0.11 0.00 -1.23 0.00 0.00 61.79 60.71 1xa7 h SER 116 Cb 0.41 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.20 1xa7 h SER 116 CO 0.01 0.36 0.50 0.44 -0.53 0.00 0.00 176.83 177.61 1xa7 h ASP 117 N 0.56 0.57 -0.31 6.23 5.19 -1.29 -1.94 116.42 125.42 1xa7 h ASP 117 Ca 0.15 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1xa7 h ASP 117 Cb -0.04 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.37 1xa7 h ASP 117 CO -0.03 0.33 0.00 0.00 -3.12 0.00 0.00 179.24 176.42 1xa7 n GLN 118 N -4.50 2.69 -3.89 3.56 6.02 -0.80 -4.86 117.38 115.60 1xa7 n GLN 118 Ca 0.13 -1.52 -0.29 0.00 -0.01 0.00 0.00 57.00 55.31 1xa7 n GLN 118 Cb 0.37 -1.74 -0.16 0.00 1.02 0.00 0.00 30.24 29.73 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 -1.79 1.22 0.30 5.09 1.01 -0.73 -5.06 121.20 121.24 1xa7 s ILE 119 Ca 0.27 -0.87 -0.29 0.00 0.00 0.00 0.00 60.65 59.75 1xa7 s ILE 119 Cb 0.19 -1.47 -0.11 0.00 0.01 0.00 0.00 42.46 41.08 1xa7 s ILE 119 CO 0.10 -0.01 1.48 -2.84 0.00 0.00 0.00 174.94 173.67 1xa7 s PRO 120 N 1.56 4.20 0.49 2.79 0.02 -1.26 -4.86 135.00 137.94 1xa7 s PRO 120 Ca -0.02 2.43 0.35 0.00 0.02 0.00 0.00 61.00 63.78 1xa7 s PRO 120 Cb -0.17 -3.05 1.49 0.00 0.02 0.00 0.00 34.50 32.79 1xa7 s PRO 120 CO -0.07 -0.48 1.69 -0.22 -0.33 0.00 0.00 177.00 177.59 1xa7 h LYS 121 N 4.29 0.09 0.02 5.54 3.64 -1.97 0.17 116.57 128.35 1xa7 h LYS 121 Ca -0.48 -0.01 -0.22 0.00 -1.27 0.00 0.00 60.65 58.68 1xa7 h LYS 121 Cb 1.22 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1xa7 h LYS 121 CO 0.73 0.06 -0.96 -2.95 -2.27 0.00 0.00 179.45 174.06 1xa7 h ASN 122 N 0.09 0.30 -0.20 4.20 -0.00 -1.98 0.20 115.58 118.20 1xa7 h ASN 122 Ca 0.74 -0.27 -0.02 0.00 -0.00 0.00 0.00 56.30 56.75 1xa7 h ASN 122 Cb 2.59 -0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 40.81 1xa7 h ASN 122 CO -0.18 1.10 0.05 0.22 -0.00 0.00 0.00 177.43 178.61 1xa7 h TYR 123 N 0.11 0.34 -0.22 4.14 5.03 -1.34 -1.55 116.97 123.47 1xa7 h TYR 123 Ca -0.06 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.19 1xa7 h TYR 123 Cb 1.61 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 39.79 1xa7 h TYR 123 CO 0.04 0.44 0.08 1.15 -1.32 0.00 0.00 178.16 178.55 1xa7 h THR 124 N 0.14 1.18 -0.65 1.81 2.02 -1.48 0.16 112.91 116.09 1xa7 h THR 124 Ca 0.06 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 1xa7 h THR 124 Cb 0.28 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 1xa7 h THR 124 CO 0.00 0.19 0.37 0.00 0.37 0.00 0.00 175.52 176.45 1xa7 h ALA 125 N 0.91 0.83 -0.58 6.16 0.00 -1.01 0.25 119.26 125.82 1xa7 h ALA 125 Ca 0.07 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1xa7 h ALA 125 Cb 0.22 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1xa7 h ALA 125 CO -0.00 0.33 0.32 1.15 0.00 0.00 0.00 179.25 181.05 1xa7 h THR 126 N 0.88 0.99 -0.51 0.00 2.02 -1.11 -2.07 112.91 113.11 1xa7 h THR 126 Ca 0.23 -0.21 -0.09 0.00 0.77 0.00 0.00 66.41 67.11 1xa7 h THR 126 Cb 0.02 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.73 1xa7 h THR 126 CO -0.04 0.11 -0.04 1.56 0.37 0.00 0.00 175.52 177.49 1xa7 h GLN 127 N 0.62 0.93 0.00 6.66 1.08 0.08 -1.36 115.11 123.12 1xa7 h GLN 127 Ca 0.25 -0.32 -0.07 0.00 -1.45 0.00 0.00 58.65 57.06 1xa7 h GLN 127 Cb 0.12 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 1xa7 h GLN 127 CO -0.15 0.97 -0.34 -0.07 -0.95 0.00 0.00 178.83 178.29 1xa7 h LEU 128 N 0.80 0.00 0.03 1.46 4.07 -0.87 -0.79 115.31 120.01 1xa7 h LEU 128 Ca 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.10 1xa7 h LEU 128 Cb 0.58 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.32 1xa7 h LEU 128 CO 0.03 0.34 -0.01 0.50 -1.08 0.00 0.00 178.44 178.22 1xa7 h LYS 129 N 0.00 -0.03 -0.82 1.13 3.64 -1.17 -1.04 116.57 118.28 1xa7 h LYS 129 Ca -0.00 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.52 1xa7 h LYS 129 Cb 0.69 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.43 1xa7 h LYS 129 CO 0.04 0.68 0.40 1.96 -2.27 0.00 0.00 179.45 180.26 1xa7 h GLN 130 N -0.89 0.56 0.00 1.90 4.20 -1.04 -2.76 115.11 117.09 1xa7 h GLN 130 Ca -0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1xa7 h GLN 130 Cb 0.73 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1xa7 h GLN 130 CO 0.01 0.37 0.00 -0.07 -0.67 0.00 0.00 178.83 178.46 1xa7 h LEU 131 N 0.57 0.00 -1.47 1.46 3.38 -1.18 -3.48 115.31 114.60 1xa7 h LEU 131 Ca 0.45 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.09 1xa7 h LEU 131 Cb 0.64 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.55 1xa7 h LEU 131 CO -0.37 0.00 -0.71 0.59 0.09 0.00 0.00 178.44 178.04 1xa7 n ASN 132 N -2.77 -3.04 -4.54 -0.43 3.02 -0.48 -4.80 115.26 102.21 1xa7 n ASN 132 Ca 0.05 -0.57 -0.41 0.00 -0.03 0.00 0.00 54.58 53.61 1xa7 n ASN 132 Cb 0.49 -4.89 -0.03 0.00 -0.61 0.00 0.00 39.78 34.74 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 -3.33 2.62 0.00 3.10 5.04 -0.67 -4.93 117.35 119.17 1xa7 s TYR 133 Ca 0.14 -0.91 0.00 0.00 -2.44 0.00 0.00 57.07 53.86 1xa7 s TYR 133 Cb -0.06 -4.63 0.00 0.00 0.35 0.00 0.00 41.96 37.62 1xa7 s TYR 133 CO 0.70 -1.87 0.00 0.41 -1.34 0.00 0.00 175.55 173.45 1xa7 n GLY 134 N 6.60 1.02 0.00 8.97 0.00 -1.26 -1.36 105.19 119.16 1xa7 n GLY 134 Ca 0.30 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.36 0.00 -1.97 1.61 5.03 -0.97 -4.82 115.26 110.78 1xa7 n ASN 135 Ca 0.00 0.00 -0.20 0.00 0.87 0.00 0.00 54.58 55.25 1xa7 n ASN 135 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 38.71 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 -2.58 -1.57 -3.29 3.52 5.02 -0.46 -4.91 118.16 113.88 1xa7 n LYS 136 Ca 0.00 1.10 -0.45 0.00 -2.02 0.00 0.00 58.31 56.93 1xa7 n LYS 136 Cb 0.00 -5.61 -0.06 0.00 -0.02 0.00 0.00 35.03 29.35 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 -2.41 6.18 0.73 4.39 3.04 -1.26 -5.03 114.94 120.58 1xa7 s ASN 137 Ca 0.00 -1.58 -0.12 0.00 0.04 0.00 0.00 52.86 51.21 1xa7 s ASN 137 Cb 0.00 -2.22 0.03 0.00 -1.54 0.00 0.00 41.25 37.52 1xa7 s ASN 137 CO 0.00 -0.85 1.11 -0.76 -3.04 0.00 0.00 177.10 173.57 1xa7 s LEU 138 N 1.82 2.81 0.00 3.21 1.43 -1.26 -1.39 118.68 125.30 1xa7 s LEU 138 Ca 0.05 1.07 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 1xa7 s LEU 138 Cb -0.27 -3.79 0.00 0.00 0.03 0.00 0.00 46.19 42.16 1xa7 s LEU 138 CO 0.05 -1.48 0.00 0.61 0.23 0.00 0.00 176.35 175.76 1xa7 n GLY 139 N -3.04 0.96 0.17 -3.19 0.00 -1.26 -4.83 105.19 94.00 1xa7 n GLY 139 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 1xa7 n GLY 139 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1xa7 n SER 140 N 0.00 0.51 -2.02 1.61 2.88 -1.26 -4.92 113.62 110.43 1xa7 n SER 140 Ca 0.00 -1.39 -0.08 0.00 -1.33 0.00 0.00 58.87 56.06 1xa7 n SER 140 Cb 0.00 -0.02 0.04 0.00 -0.75 0.00 0.00 64.21 63.48 1xa7 n SER 140 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xa7 n TYR 141 N -0.50 -1.04 0.00 0.66 4.19 -1.26 -5.02 117.16 114.19 1xa7 n TYR 141 Ca 0.17 0.42 0.00 0.00 3.31 0.00 0.00 57.90 61.81 1xa7 n TYR 141 Cb 0.16 -3.21 0.00 0.00 0.49 0.00 0.00 39.34 36.78 1xa7 n TYR 141 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 1xa7 n LYS 142 N -2.41 0.00 -2.92 2.98 4.76 -1.26 -4.88 118.16 114.43 1xa7 n LYS 142 Ca -0.09 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.93 1xa7 n LYS 142 Cb 0.56 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.76 1xa7 n LYS 142 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1xa7 n SER 143 N 0.00 6.59 0.17 4.39 7.64 -1.26 -4.80 113.62 126.34 1xa7 n SER 143 Ca 0.00 -3.49 0.13 0.00 1.01 0.00 0.00 58.87 56.52 1xa7 n SER 143 Cb 0.00 -1.22 0.56 0.00 -1.01 0.00 0.00 64.21 62.54 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 5.05 0.00 -1.26 1.43 -0.00 -1.98 -3.44 116.97 116.77 1xa7 h TYR 144 Ca 0.29 0.00 -0.75 0.00 0.00 0.00 0.00 58.73 58.27 1xa7 h TYR 144 Cb 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 36.73 37.13 1xa7 h TYR 144 CO 1.09 0.00 2.27 -2.67 -0.00 0.00 0.00 178.16 178.85 1xa7 n TRP 145 N -2.42 2.69 -1.48 0.10 2.14 -1.26 -2.85 117.44 114.37 1xa7 n TRP 145 Ca 0.01 -2.81 -0.12 0.00 2.07 0.00 0.00 57.50 56.66 1xa7 n TRP 145 Cb 0.22 -1.86 -0.10 0.00 -0.81 0.00 0.00 31.31 28.76 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 2.38 0.07 0.00 -2.67 -0.58 -1.26 -1.82 120.64 116.77 1xa7 n GLU 147 Ca 0.55 -1.43 0.00 0.00 -0.42 0.00 0.00 57.16 55.86 1xa7 n GLU 147 Cb 0.28 -3.47 0.00 0.00 -0.57 0.00 0.00 31.44 27.68 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 17.53 1.39 -0.13 1.62 -0.08 -1.26 -5.07 116.55 130.55 1xa7 n ASP 148 Ca 0.34 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.52 1xa7 n ASP 148 Cb 0.47 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.92 1xa7 n ASP 148 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1xa7 h SER 149 N 0.00 0.62 -3.46 1.67 4.64 -1.80 -3.44 113.55 111.79 1xa7 h SER 149 Ca 0.00 -0.29 -0.52 0.00 -0.47 0.00 0.00 61.79 60.51 1xa7 h SER 149 Cb 0.00 -0.17 0.02 0.00 -0.31 0.00 0.00 62.40 61.94 1xa7 h SER 149 CO 0.00 0.76 0.57 -0.22 -0.87 0.00 0.00 176.83 177.07 1xa7 s LEU 150 N -9.48 4.44 -0.07 5.97 2.96 -0.48 -4.66 118.68 117.37 1xa7 s LEU 150 Ca -0.13 2.23 -0.13 0.00 -0.22 0.00 0.00 54.13 55.89 1xa7 s LEU 150 Cb 0.09 -3.61 0.03 0.00 0.50 0.00 0.00 46.19 43.21 1xa7 s LEU 150 CO 0.78 -0.39 0.31 -0.54 -1.32 0.00 0.00 176.35 175.19 1xa7 s LYS 151 N -0.15 0.51 -0.01 1.98 1.02 -1.26 -4.25 119.74 117.59 1xa7 s LYS 151 Ca 0.53 0.12 -0.07 0.00 0.02 0.00 0.00 55.97 56.57 1xa7 s LYS 151 Cb -0.33 0.24 0.00 0.00 -0.52 0.00 0.00 37.83 37.22 1xa7 s LYS 151 CO 0.36 -0.11 0.15 -1.50 -0.92 0.00 0.00 175.35 173.33 1xa7 s ILE 152 N -0.58 0.07 0.52 2.17 2.07 0.27 -2.29 121.20 123.43 1xa7 s ILE 152 Ca -0.07 -0.59 -0.07 0.00 -1.41 0.00 0.00 60.65 58.51 1xa7 s ILE 152 Cb -0.04 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.10 1xa7 s ILE 152 CO 0.02 -0.32 0.86 -0.94 -1.91 0.00 0.00 174.94 172.65 1xa7 s SER 153 N -1.18 6.27 0.22 4.50 1.04 -1.25 -1.17 113.70 122.13 1xa7 s SER 153 Ca -0.13 1.09 -0.08 0.00 0.48 0.00 0.00 55.95 57.32 1xa7 s SER 153 Cb -0.07 -2.32 0.18 0.00 0.10 0.00 0.00 66.02 63.91 1xa7 s SER 153 CO 0.02 -0.65 1.83 -1.13 0.98 0.00 0.00 173.24 174.28 1xa7 h ASN 154 N 0.14 1.07 -0.40 7.02 -0.00 -1.61 -0.68 115.58 121.11 1xa7 h ASN 154 Ca -0.46 -0.11 -0.00 0.00 -0.00 0.00 0.00 56.30 55.72 1xa7 h ASN 154 Cb 1.20 -0.27 -0.02 0.00 -0.00 0.00 0.00 38.32 39.23 1xa7 h ASN 154 CO 0.62 0.88 0.25 0.25 -0.00 0.00 0.00 177.43 179.42 1xa7 h LEU 155 N 1.17 0.48 -0.49 0.34 5.85 -1.48 -2.54 115.31 118.65 1xa7 h LEU 155 Ca 0.29 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.97 1xa7 h LEU 155 Cb 0.07 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1xa7 h LEU 155 CO -0.04 0.39 0.32 -0.33 -0.34 0.00 0.00 178.44 178.44 1xa7 h GLU 156 N 0.53 0.64 -0.82 1.25 5.08 -1.72 -1.57 114.58 117.97 1xa7 h GLU 156 Ca 0.14 -0.04 0.19 0.00 -1.00 0.00 0.00 59.36 58.65 1xa7 h GLU 156 Cb -0.01 -0.14 -0.11 0.00 0.50 0.00 0.00 28.75 28.98 1xa7 h GLU 156 CO -0.03 0.42 0.30 1.96 -1.00 0.00 0.00 179.01 180.67 1xa7 h GLN 157 N 0.66 0.36 -0.10 2.33 1.08 -0.73 0.31 115.11 119.02 1xa7 h GLN 157 Ca 0.18 -0.02 -0.06 0.00 -1.45 0.00 0.00 58.65 57.30 1xa7 h GLN 157 Cb -0.07 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1xa7 h GLN 157 CO -0.04 0.24 -0.18 0.28 -0.95 0.00 0.00 178.83 178.18 1xa7 h VAL 158 N 0.37 1.39 -0.05 -0.54 2.07 -0.97 -2.58 116.25 115.93 1xa7 h VAL 158 Ca 0.49 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1xa7 h VAL 158 Cb 0.86 2.10 -0.00 0.00 -1.52 0.00 0.00 31.29 32.73 1xa7 h VAL 158 CO -0.50 0.41 0.00 0.40 0.02 0.00 0.00 177.57 177.90 1xa7 h ILE 159 N -0.15 1.25 -0.65 4.57 2.04 -0.58 -1.65 117.51 122.33 1xa7 h ILE 159 Ca 0.01 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.12 1xa7 h ILE 159 Cb 0.75 1.66 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 1xa7 h ILE 159 CO 0.04 0.21 0.42 0.58 0.00 0.00 0.00 178.15 179.40 1xa7 h VAL 160 N -0.19 1.13 -0.31 1.67 2.07 -0.52 0.23 116.25 120.32 1xa7 h VAL 160 Ca 0.02 -0.29 -0.09 0.00 0.82 0.00 0.00 66.70 67.15 1xa7 h VAL 160 Cb 0.33 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1xa7 h VAL 160 CO 0.00 0.15 -0.17 0.15 0.02 0.00 0.00 177.57 177.73 1xa7 h PHE 161 N 0.84 0.78 -0.76 1.57 -0.00 -1.46 -3.11 116.94 114.80 1xa7 h PHE 161 Ca 0.25 -0.20 -0.06 0.00 -0.00 0.00 0.00 57.97 57.96 1xa7 h PHE 161 Cb -0.04 -0.18 -0.03 0.00 -0.00 0.00 0.00 35.95 35.70 1xa7 h PHE 161 CO -0.04 0.90 0.24 -0.22 -0.00 0.00 0.00 178.31 179.20 1xa7 h LYS 162 N 0.43 1.18 -4.84 1.11 3.64 -0.97 -3.41 116.57 113.71 1xa7 h LYS 162 Ca 0.07 -0.25 -0.58 0.00 -1.27 0.00 0.00 60.65 58.62 1xa7 h LYS 162 Cb 0.71 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1xa7 h LYS 162 CO 0.05 0.99 2.12 0.09 -2.27 0.00 0.00 179.45 180.43 1xa7 n ASN 163 N -4.25 3.24 0.00 4.20 3.02 0.79 -4.19 115.26 118.06 1xa7 n ASN 163 Ca 0.06 -2.75 0.00 0.00 -0.03 0.00 0.00 54.58 51.87 1xa7 n ASN 163 Cb 0.23 -1.46 0.00 0.00 -0.61 0.00 0.00 39.78 37.93 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 7.36 0.00 -1.69 3.52 -0.58 -1.26 -4.88 120.64 123.11 1xa7 n GLU 166 Ca 0.49 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.80 1xa7 n GLU 166 Cb 0.43 -0.36 -0.01 0.00 -0.57 0.00 0.00 31.44 30.93 1xa7 n GLU 166 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1xa7 n GLN 167 N 0.00 2.11 -2.20 3.49 1.13 -1.26 -4.85 117.38 115.80 1xa7 n GLN 167 Ca 0.00 0.74 -0.31 0.00 -1.94 0.00 0.00 57.00 55.49 1xa7 n GLN 167 Cb 0.00 -2.33 -0.04 0.00 0.11 0.00 0.00 30.24 27.98 1xa7 n GLN 167 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1xa7 s ASN 168 N -0.25 5.53 0.30 1.08 3.84 -1.26 -4.85 114.94 119.34 1xa7 s ASN 168 Ca 0.57 -1.18 0.03 0.00 0.21 0.00 0.00 52.86 52.48 1xa7 s ASN 168 Cb -0.58 -2.57 -0.01 0.00 -0.55 0.00 0.00 41.25 37.54 1xa7 s ASN 168 CO 0.61 -2.44 0.09 -0.46 -2.79 0.00 0.00 177.10 172.11 1xa7 n ASN 169 N 12.58 1.36 0.09 -4.21 6.94 -1.26 -5.07 115.26 125.68 1xa7 n ASN 169 Ca 0.40 -2.57 0.13 0.00 -0.02 0.00 0.00 54.58 52.52 1xa7 n ASN 169 Cb 0.48 0.69 0.40 0.00 -2.36 0.00 0.00 39.78 38.99 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 -0.69 0.79 -2.42 -2.53 1.44 -1.26 -4.73 115.22 105.82 1xa7 n HIS 170 Ca -0.05 0.23 -0.41 0.00 -2.01 0.00 0.00 57.72 55.48 1xa7 n HIS 170 Cb 0.44 -0.86 -0.04 0.00 0.12 0.00 0.00 29.99 29.65 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 -3.09 3.48 0.35 -1.40 0.40 -1.26 -5.02 117.98 111.44 1xa7 s PHE 171 Ca 0.11 1.49 -0.24 0.00 -0.60 0.00 0.00 56.93 57.68 1xa7 s PHE 171 Cb 0.13 -3.38 -0.10 0.00 0.51 0.00 0.00 43.02 40.18 1xa7 s PHE 171 CO 0.60 -1.00 0.94 -1.54 0.70 0.00 0.00 175.22 174.92 1xa7 s SER 172 N 0.00 7.21 0.47 1.36 1.04 -1.26 -4.93 113.70 117.59 1xa7 s SER 172 Ca 0.51 1.78 0.28 0.00 0.48 0.00 0.00 55.95 59.01 1xa7 s SER 172 Cb -0.32 -2.56 1.35 0.00 0.10 0.00 0.00 66.02 64.59 1xa7 s SER 172 CO 0.37 -0.16 1.76 0.50 0.98 0.00 0.00 173.24 176.69 1xa7 h LYS 173 N 2.78 0.17 -0.24 4.02 1.63 -1.95 -1.51 116.57 121.47 1xa7 h LYS 173 Ca -0.47 -0.01 -0.08 0.00 -0.85 0.00 0.00 60.65 59.24 1xa7 h LYS 173 Cb 1.19 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.77 1xa7 h LYS 173 CO 0.64 0.11 -0.14 -0.22 -3.45 0.00 0.00 179.45 176.39 1xa7 h LYS 174 N 0.18 0.53 -0.23 1.90 3.11 -1.99 -0.79 116.57 119.28 1xa7 h LYS 174 Ca 0.62 -0.24 -0.12 0.00 -2.81 0.00 0.00 60.65 58.10 1xa7 h LYS 174 Cb 2.01 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 33.22 1xa7 h LYS 174 CO -0.18 0.80 -0.36 0.00 -2.81 0.00 0.00 179.45 176.91 1xa7 h ALA 175 N 0.71 0.95 -0.98 5.00 0.00 -1.69 -0.98 119.26 122.28 1xa7 h ALA 175 Ca 0.05 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.60 1xa7 h ALA 175 Cb 0.66 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1xa7 h ALA 175 CO 0.04 0.61 0.64 0.87 0.00 0.00 0.00 179.25 181.41 1xa7 h LYS 176 N 0.42 1.16 0.04 0.00 1.57 -1.24 -1.21 116.57 117.32 1xa7 h LYS 176 Ca 0.05 -0.07 -0.23 0.00 -1.87 0.00 0.00 60.65 58.52 1xa7 h LYS 176 Cb 0.82 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 1xa7 h LYS 176 CO 0.07 0.77 -1.03 -0.91 -0.57 0.00 0.00 179.45 177.78 1xa7 h ASN 177 N 1.19 0.36 -0.49 0.86 2.35 -0.62 -1.40 115.58 117.84 1xa7 h ASN 177 Ca 0.41 -0.33 -0.12 0.00 -0.55 0.00 0.00 56.30 55.71 1xa7 h ASN 177 Cb 0.08 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1xa7 h ASN 177 CO -0.15 1.18 -0.14 1.56 -1.65 0.00 0.00 177.43 178.23 1xa7 h GLN 178 N 0.12 0.98 0.36 0.81 4.20 -1.00 -1.74 115.11 118.83 1xa7 h GLN 178 Ca -0.08 -0.37 -0.00 0.00 0.06 0.00 0.00 58.65 58.25 1xa7 h GLN 178 Cb 1.70 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 29.40 1xa7 h GLN 178 CO 0.16 1.05 -0.34 1.25 -0.67 0.00 0.00 178.83 180.28 1xa7 h LEU 179 N 0.86 -0.91 -0.80 1.46 5.85 -1.16 -1.88 115.31 118.74 1xa7 h LEU 179 Ca 0.13 0.08 0.18 0.00 0.84 0.00 0.00 57.88 59.10 1xa7 h LEU 179 Cb 0.70 0.30 -0.15 0.00 0.37 0.00 0.00 40.66 41.89 1xa7 h LEU 179 CO 0.05 -0.48 -0.08 0.28 -0.34 0.00 0.00 178.44 177.87 1xa7 h SER 180 N -0.72 -0.53 -0.64 1.25 0.02 -1.12 0.07 113.55 111.88 1xa7 h SER 180 Ca -0.02 0.22 0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1xa7 h SER 180 Cb 0.64 0.42 -0.03 0.00 0.14 0.00 0.00 62.40 63.57 1xa7 h SER 180 CO -0.05 -0.24 0.42 0.28 -1.14 0.00 0.00 176.83 176.11 1xa7 h SER 181 N 0.05 0.72 0.25 3.07 0.02 -1.10 -2.32 113.55 114.23 1xa7 h SER 181 Ca 0.42 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.35 1xa7 h SER 181 Cb 0.72 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 1xa7 h SER 181 CO -0.76 0.52 -0.03 0.77 -1.14 0.00 0.00 176.83 176.19 1xa7 h SER 182 N 0.86 0.00 -0.01 3.07 4.64 -0.16 -3.14 113.55 118.81 1xa7 h SER 182 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1xa7 h SER 182 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1xa7 h SER 182 CO -0.06 0.03 -0.54 0.18 -0.87 0.00 0.00 176.83 175.58 1xa7 n LEU 183 N -3.40 1.48 -4.77 5.97 4.77 -0.82 -4.22 117.00 116.01 1xa7 n LEU 183 Ca -0.02 -0.68 -0.41 0.00 -0.03 0.00 0.00 56.01 54.87 1xa7 n LEU 183 Cb 0.15 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1xa7 n LEU 183 CO 0.25 0.30 1.12 -0.22 -1.33 0.00 0.00 177.39 177.51 1xa7 s LEU 184 N -2.42 4.34 0.05 2.23 2.96 -1.06 -0.90 118.68 123.88 1xa7 s LEU 184 Ca 0.13 2.98 0.00 0.00 -0.22 0.00 0.00 54.13 57.02 1xa7 s LEU 184 Cb 0.14 -3.66 0.00 0.00 0.50 0.00 0.00 46.19 43.17 1xa7 s LEU 184 CO 0.56 -0.82 0.00 -0.38 -1.32 0.00 0.00 176.35 174.38 1xa7 n ILE 185 N 0.70 0.15 -4.27 6.68 5.41 -0.27 -4.90 119.36 122.86 1xa7 n ILE 185 Ca 0.02 0.05 -0.19 0.00 1.00 0.00 0.00 62.75 63.63 1xa7 n ILE 185 Cb 0.39 -1.00 -0.13 0.00 -0.71 0.00 0.00 39.64 38.20 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 -2.00 0.86 -0.12 0.38 1.02 -1.08 -5.01 119.74 113.78 1xa7 s LYS 186 Ca 0.00 -0.82 -0.08 0.00 0.02 0.00 0.00 55.97 55.09 1xa7 s LYS 186 Cb 0.00 -0.86 0.04 0.00 -0.52 0.00 0.00 37.83 36.50 1xa7 s LYS 186 CO 0.00 0.20 0.31 0.21 -0.92 0.00 0.00 175.35 175.15 1xa7 s LYS 187 N -1.36 0.31 0.00 1.68 2.20 -1.26 -0.17 119.74 121.14 1xa7 s LYS 187 Ca -0.00 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 1xa7 s LYS 187 Cb -0.09 0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.25 1xa7 s LYS 187 CO 0.02 -0.12 0.00 0.27 -0.36 0.00 0.00 175.35 175.16 1xa7 n ASN 188 N 3.73 0.40 -0.20 1.43 0.23 -0.76 -5.03 115.26 115.06 1xa7 n ASN 188 Ca -0.20 -0.19 -0.06 0.00 -0.53 0.00 0.00 54.58 53.59 1xa7 n ASN 188 Cb 0.55 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.29 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 0.77 -0.01 -3.83 9.09 -2.03 -3.29 114.58 115.28 1xa7 h GLU 189 Ca 0.00 -0.05 -0.16 0.00 0.05 0.00 0.00 59.36 59.20 1xa7 h GLU 189 Cb 0.00 -0.17 0.01 0.00 -1.65 0.00 0.00 28.75 26.94 1xa7 h GLU 189 CO 0.00 0.52 -0.62 0.87 0.05 0.00 0.00 179.01 179.83 1xa7 h LYS 190 N 0.78 0.43 -4.34 1.06 1.57 -1.98 -3.46 116.57 110.64 1xa7 h LYS 190 Ca 0.21 -0.46 -0.16 0.00 -1.87 0.00 0.00 60.65 58.37 1xa7 h LYS 190 Cb -0.07 0.13 -0.15 0.00 0.08 0.00 0.00 32.23 32.22 1xa7 h LYS 190 CO -0.04 1.11 -0.62 1.52 -0.57 0.00 0.00 179.45 180.85 1xa7 s TYR 191 N -3.25 0.75 -0.09 -1.35 1.13 -1.24 -3.10 117.35 110.20 1xa7 s TYR 191 Ca -0.13 -1.16 0.03 0.00 -1.41 0.00 0.00 57.07 54.40 1xa7 s TYR 191 Cb 0.04 -0.42 0.01 0.00 -1.10 0.00 0.00 41.96 40.48 1xa7 s TYR 191 CO 0.83 -0.51 -0.19 -1.21 -2.51 0.00 0.00 175.55 171.96 1xa7 s GLU 192 N -4.01 2.52 -0.17 -3.49 2.02 -0.38 -1.82 118.70 113.36 1xa7 s GLU 192 Ca 0.20 -0.69 -0.02 0.00 0.02 0.00 0.00 54.97 54.48 1xa7 s GLU 192 Cb 0.07 -1.98 -0.01 0.00 0.10 0.00 0.00 34.13 32.31 1xa7 s GLU 192 CO -0.01 0.08 -0.08 -1.17 0.02 0.00 0.00 175.26 174.10 1xa7 s LEU 193 N 0.58 2.86 0.00 1.80 2.96 0.77 -1.27 118.68 126.37 1xa7 s LEU 193 Ca -0.15 -0.33 0.08 0.00 -0.22 0.00 0.00 54.13 53.51 1xa7 s LEU 193 Cb -0.17 -1.69 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1xa7 s LEU 193 CO 0.05 0.09 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.61 1xa7 s TYR 194 N 0.84 2.18 0.00 5.38 2.02 0.23 -1.12 117.35 126.88 1xa7 s TYR 194 Ca -0.03 -0.41 0.00 0.00 -0.37 0.00 0.00 57.07 56.27 1xa7 s TYR 194 Cb -0.15 -1.37 0.00 0.00 -0.40 0.00 0.00 41.96 40.04 1xa7 s TYR 194 CO 0.01 0.01 0.00 0.41 -1.57 0.00 0.00 175.55 174.41 1xa7 n GLY 195 N 2.26 -0.81 2.87 0.71 0.00 -0.08 -0.26 105.19 109.88 1xa7 n GLY 195 Ca -0.16 -1.06 -0.18 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.00 0.54 0.44 1.61 2.47 0.53 -4.77 119.74 118.56 1xa7 s LYS 196 Ca 0.00 -0.04 -0.17 0.00 -1.56 0.00 0.00 55.97 54.20 1xa7 s LYS 196 Cb 0.00 -0.62 -0.09 0.00 -1.46 0.00 0.00 37.83 35.66 1xa7 s LYS 196 CO 0.00 -0.08 0.90 0.95 0.16 0.00 0.00 175.35 177.29 1xa7 s THR 197 N 0.82 4.54 -0.01 3.43 -4.23 -1.26 -1.67 115.64 117.25 1xa7 s THR 197 Ca -0.10 1.20 0.01 0.00 -1.18 0.00 0.00 61.69 61.62 1xa7 s THR 197 Cb -0.13 -3.66 0.01 0.00 1.34 0.00 0.00 72.50 70.06 1xa7 s THR 197 CO -0.01 -0.45 -0.03 -0.83 -0.54 0.00 0.00 174.62 172.77 1xa7 s GLY 198 N -2.62 0.22 -0.09 3.99 0.00 -0.27 -3.78 107.32 104.76 1xa7 s GLY 198 Ca 0.58 -0.06 -0.03 0.00 0.00 0.00 0.00 44.72 45.21 1xa7 s GLY 198 CO 0.22 0.11 0.07 -1.59 0.00 0.00 0.00 173.10 171.91 1xa7 s THR 199 N 0.29 -0.06 0.01 0.90 2.01 -1.26 -0.98 115.64 116.55 1xa7 s THR 199 Ca -0.03 0.17 -0.10 0.00 0.31 0.00 0.00 61.69 62.03 1xa7 s THR 199 Cb -0.06 -0.35 -0.05 0.00 0.01 0.00 0.00 72.50 72.05 1xa7 s THR 199 CO -0.01 0.00 0.34 -0.83 -0.69 0.00 0.00 174.62 173.44 1xa7 s GLY 200 N 2.14 2.35 0.30 4.40 0.00 0.61 -4.99 107.32 112.12 1xa7 s GLY 200 Ca 0.04 -0.40 0.06 0.00 0.00 0.00 0.00 44.72 44.42 1xa7 s GLY 200 CO -0.05 -0.13 0.23 4.51 0.00 0.00 0.00 173.10 177.65 1xa7 n ILE 201 N 1.38 0.00 0.00 0.90 0.00 -1.26 -2.88 119.36 117.51 1xa7 n ILE 201 Ca -0.12 -2.11 0.00 0.00 0.00 0.00 0.00 62.75 60.52 1xa7 n ILE 201 Cb 0.53 1.02 0.00 0.00 0.00 0.00 0.00 39.64 41.19 1xa7 n ILE 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xa7 n GLY 204 N -0.54 0.00 3.31 4.50 0.00 -1.26 -4.84 105.19 106.37 1xa7 n GLY 204 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 1xa7 n GLY 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xa7 s LYS 205 N -1.60 1.20 -0.29 1.61 0.00 -1.26 -5.11 119.74 114.28 1xa7 s LYS 205 Ca 0.00 -1.22 -0.28 0.00 0.00 0.00 0.00 55.97 54.46 1xa7 s LYS 205 Cb 0.00 -1.51 0.01 0.00 0.00 0.00 0.00 37.83 36.33 1xa7 s LYS 205 CO 0.00 0.35 1.04 0.71 0.00 0.00 0.00 175.35 177.45 1xa7 s TYR 206 N -1.18 3.21 -0.00 1.78 1.51 -1.26 -4.92 117.35 116.49 1xa7 s TYR 206 Ca 0.09 1.24 0.00 0.00 -1.01 0.00 0.00 57.07 57.39 1xa7 s TYR 206 Cb -0.10 -3.53 0.00 0.00 -0.11 0.00 0.00 41.96 38.22 1xa7 s TYR 206 CO 0.05 -0.67 0.55 0.27 -1.11 0.00 0.00 175.55 174.64 1xa7 n ASN 207 N 6.66 0.09 -3.09 2.29 0.23 -1.14 -4.55 115.26 115.75 1xa7 n ASN 207 Ca 0.11 -1.10 0.02 0.00 -0.53 0.00 0.00 54.58 53.09 1xa7 n ASN 207 Cb 0.47 -0.01 -0.00 0.00 -2.08 0.00 0.00 39.78 38.15 1xa7 n ASN 207 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1xa7 s ASN 208 N -0.10 -1.17 -0.04 0.53 2.47 -1.24 -4.50 114.94 110.88 1xa7 s ASN 208 Ca 0.00 -0.34 0.03 0.00 0.42 0.00 0.00 52.86 52.97 1xa7 s ASN 208 Cb 0.00 1.56 -0.03 0.00 -1.45 0.00 0.00 41.25 41.34 1xa7 s ASN 208 CO 0.00 -0.16 -0.10 -0.83 -3.72 0.00 0.00 177.10 172.29 1xa7 s GLY 209 N 2.21 1.63 0.03 1.21 0.00 -0.23 -0.28 107.32 111.89 1xa7 s GLY 209 Ca 0.16 -0.96 -0.02 0.00 0.00 0.00 0.00 44.72 43.89 1xa7 s GLY 209 CO -0.15 -0.76 0.02 -0.98 0.00 0.00 0.00 173.10 171.23 1xa7 s TRP 210 N -0.81 0.28 -0.21 1.90 0.52 -0.15 0.18 118.94 120.64 1xa7 s TRP 210 Ca 0.13 -0.61 -0.04 0.00 0.02 0.00 0.00 56.10 55.61 1xa7 s TRP 210 Cb -0.11 -0.21 0.11 0.00 -1.15 0.00 0.00 33.47 32.11 1xa7 s TRP 210 CO 0.02 -0.29 0.29 0.12 0.02 0.00 0.00 176.95 177.12 1xa7 s PHE 211 N -2.31 -0.53 -0.04 -1.98 5.36 -0.67 -1.12 117.98 116.70 1xa7 s PHE 211 Ca -0.08 0.59 0.06 0.00 -0.96 0.00 0.00 56.93 56.54 1xa7 s PHE 211 Cb -0.03 -0.15 -0.02 0.00 -0.34 0.00 0.00 43.02 42.47 1xa7 s PHE 211 CO -0.04 -0.62 -0.22 0.14 -1.46 0.00 0.00 175.22 173.02 1xa7 s VAL 212 N 2.43 2.36 0.00 3.12 -7.23 -0.67 -1.49 120.40 118.92 1xa7 s VAL 212 Ca 0.08 -0.98 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 1xa7 s VAL 212 Cb -0.15 -1.86 0.00 0.00 0.56 0.00 0.00 36.38 34.93 1xa7 s VAL 212 CO -0.13 0.58 0.00 0.61 -0.31 0.00 0.00 175.10 175.85 1xa7 n GLY 213 N 2.56 1.14 3.36 2.32 0.00 -0.62 -0.35 105.19 113.61 1xa7 n GLY 213 Ca -0.17 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.37 -0.35 -0.05 1.61 1.13 0.64 -1.52 117.35 117.44 1xa7 s TYR 214 Ca 0.00 0.30 0.03 0.00 -1.41 0.00 0.00 57.07 55.99 1xa7 s TYR 214 Cb 0.00 0.31 0.01 0.00 -1.10 0.00 0.00 41.96 41.17 1xa7 s TYR 214 CO 0.00 -0.64 -0.13 0.54 -2.51 0.00 0.00 175.55 172.81 1xa7 s VAL 215 N -2.74 1.14 -0.29 -3.49 0.11 0.13 -0.60 120.40 114.66 1xa7 s VAL 215 Ca -0.04 -0.52 -0.11 0.00 -2.93 0.00 0.00 61.98 58.38 1xa7 s VAL 215 Cb -0.00 -1.01 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 1xa7 s VAL 215 CO -0.04 0.35 0.18 -0.63 -3.33 0.00 0.00 175.10 171.62 1xa7 s ILE 216 N 0.34 5.10 0.58 7.04 1.01 -0.40 -0.81 121.20 134.07 1xa7 s ILE 216 Ca -0.08 -0.01 0.10 0.00 0.00 0.00 0.00 60.65 60.66 1xa7 s ILE 216 Cb -0.13 -3.48 0.09 0.00 0.01 0.00 0.00 42.46 38.96 1xa7 s ILE 216 CO 0.02 0.20 0.81 0.42 0.00 0.00 0.00 174.94 176.39 1xa7 s THR 217 N 1.72 2.10 0.41 2.92 -4.23 -0.14 -1.24 115.64 117.17 1xa7 s THR 217 Ca 0.07 -0.99 0.10 0.00 -1.18 0.00 0.00 61.69 59.68 1xa7 s THR 217 Cb -0.16 -2.10 0.18 0.00 1.34 0.00 0.00 72.50 71.76 1xa7 s THR 217 CO 0.09 0.00 1.96 -0.55 -0.54 0.00 0.00 174.62 175.58 1xa7 h ASN 218 N 0.14 0.22 0.00 3.99 -0.00 -1.88 -3.33 115.58 114.73 1xa7 h ASN 218 Ca -0.29 -0.04 -0.14 0.00 -0.00 0.00 0.00 56.30 55.84 1xa7 h ASN 218 Cb 1.29 -0.06 -0.02 0.00 -0.00 0.00 0.00 38.32 39.53 1xa7 h ASN 218 CO 0.40 0.33 -0.85 0.45 -0.00 0.00 0.00 177.43 177.76 1xa7 h HIS 219 N 0.24 0.00 -2.77 4.14 3.86 -1.95 -3.50 115.15 115.16 1xa7 h HIS 219 Ca 0.05 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.77 1xa7 h HIS 219 Cb 0.28 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.61 1xa7 h HIS 219 CO 0.00 1.00 -0.58 0.34 0.86 0.00 0.00 177.93 179.56 1xa7 s ASP 220 N -6.44 2.46 -0.04 2.45 3.68 -1.25 -5.02 116.67 112.51 1xa7 s ASP 220 Ca -0.23 -1.47 0.02 0.00 2.13 0.00 0.00 52.55 53.00 1xa7 s ASP 220 Cb 0.04 0.12 0.02 0.00 -1.45 0.00 0.00 42.92 41.64 1xa7 s ASP 220 CO 0.48 -0.72 -0.07 -0.75 0.13 0.00 0.00 175.17 174.25 1xa7 s LYS 221 N -3.85 1.00 -0.02 4.34 2.20 -1.26 -0.96 119.74 121.18 1xa7 s LYS 221 Ca 0.32 -0.20 0.02 0.00 -0.36 0.00 0.00 55.97 55.75 1xa7 s LYS 221 Cb 0.07 -0.93 0.00 0.00 -1.51 0.00 0.00 37.83 35.46 1xa7 s LYS 221 CO 0.15 -0.01 -0.07 0.71 -0.36 0.00 0.00 175.35 175.76 1xa7 s TYR 222 N 0.68 0.77 0.07 4.03 2.02 0.01 -4.52 117.35 120.40 1xa7 s TYR 222 Ca -0.10 -0.18 0.02 0.00 -0.37 0.00 0.00 57.07 56.43 1xa7 s TYR 222 Cb -0.13 -0.56 -0.04 0.00 -0.40 0.00 0.00 41.96 40.83 1xa7 s TYR 222 CO 0.01 -0.08 0.14 0.71 -1.57 0.00 0.00 175.55 174.76 1xa7 s TYR 223 N 0.21 3.34 0.27 2.71 1.51 -0.87 0.21 117.35 124.73 1xa7 s TYR 223 Ca -0.03 0.16 -0.19 0.00 -1.01 0.00 0.00 57.07 56.00 1xa7 s TYR 223 Cb -0.08 -1.69 0.02 0.00 -0.11 0.00 0.00 41.96 40.10 1xa7 s TYR 223 CO 0.00 0.55 0.66 -0.59 -1.11 0.00 0.00 175.55 175.07 1xa7 s PHE 224 N -1.44 -0.09 -0.12 2.71 -0.12 -0.58 -0.03 117.98 118.31 1xa7 s PHE 224 Ca 0.32 -0.34 -0.30 0.00 -0.05 0.00 0.00 56.93 56.57 1xa7 s PHE 224 Cb -0.13 0.59 0.08 0.00 -0.63 0.00 0.00 43.02 42.94 1xa7 s PHE 224 CO 0.25 -1.16 0.76 0.00 -0.05 0.00 0.00 175.22 175.01 1xa7 s ALA 225 N -3.93 -1.81 -0.10 1.99 0.00 0.22 -1.59 121.76 116.53 1xa7 s ALA 225 Ca 0.13 1.51 0.02 0.00 0.00 0.00 0.00 51.96 53.61 1xa7 s ALA 225 Cb -0.05 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1xa7 s ALA 225 CO 0.06 -0.35 -0.14 0.99 0.00 0.00 0.00 175.76 176.33 1xa7 s THR 226 N -0.85 1.37 0.06 0.00 2.01 -0.56 -0.90 115.64 116.77 1xa7 s THR 226 Ca -0.07 -0.57 0.02 0.00 0.31 0.00 0.00 61.69 61.38 1xa7 s THR 226 Cb -0.01 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1xa7 s THR 226 CO 0.06 0.41 0.10 -2.28 -0.69 0.00 0.00 174.62 172.23 1xa7 s HIS 227 N 1.01 3.27 -0.08 4.92 2.46 -0.98 -1.66 115.29 124.23 1xa7 s HIS 227 Ca -0.07 0.14 0.02 0.00 0.47 0.00 0.00 55.06 55.62 1xa7 s HIS 227 Cb -0.15 -1.67 0.01 0.00 -0.13 0.00 0.00 32.58 30.64 1xa7 s HIS 227 CO -0.01 0.54 -0.13 -0.51 -2.47 0.00 0.00 174.74 172.16 1xa7 s LEU 228 N -2.27 1.63 -0.08 8.88 1.43 0.13 -2.06 118.68 126.34 1xa7 s LEU 228 Ca 0.29 -0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.11 1xa7 s LEU 228 Cb -0.12 -0.90 -0.09 0.00 0.03 0.00 0.00 46.19 45.11 1xa7 s LEU 228 CO 0.21 0.02 -0.00 -1.54 0.23 0.00 0.00 176.35 175.27 1xa7 n SER 229 N 3.98 3.08 -3.72 2.29 3.41 -0.67 -1.07 113.62 120.92 1xa7 n SER 229 Ca -0.21 -0.01 -0.11 0.00 -0.26 0.00 0.00 58.87 58.28 1xa7 n SER 229 Cb 0.51 0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 64.87 1xa7 n SER 229 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1xa7 s ASP 230 N -4.25 -0.13 0.00 4.04 -4.77 -1.22 -4.61 116.67 105.73 1xa7 s ASP 230 Ca -0.07 -0.31 0.00 0.00 -3.30 0.00 0.00 52.55 48.88 1xa7 s ASP 230 Cb 0.03 0.40 0.00 0.00 -1.09 0.00 0.00 42.92 42.26 1xa7 s ASP 230 CO 0.30 -0.73 0.00 0.61 0.70 0.00 0.00 175.17 176.06 1xa7 n GLY 231 N 0.16 1.37 2.33 2.12 0.00 -1.26 -0.56 105.19 109.35 1xa7 n GLY 231 Ca -0.17 -0.79 -0.25 0.00 0.00 0.00 0.00 46.02 44.81 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 0.40 -2.01 1.61 4.76 -1.26 -4.99 118.16 116.67 1xa7 n LYS 232 Ca 0.00 -3.15 -0.26 0.00 -2.87 0.00 0.00 58.31 52.04 1xa7 n LYS 232 Cb 0.00 -1.49 -0.05 0.00 -1.84 0.00 0.00 35.03 31.65 1xa7 n LYS 232 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1xa7 s PRO 233 N -0.39 2.45 0.06 1.97 0.04 -1.26 -4.75 135.00 133.12 1xa7 s PRO 233 Ca 0.34 -0.33 0.05 0.00 0.04 0.00 0.00 61.00 61.10 1xa7 s PRO 233 Cb 0.09 -5.06 -0.03 0.00 0.04 0.00 0.00 34.50 29.54 1xa7 s PRO 233 CO -0.16 -3.56 -0.14 -1.54 0.04 0.00 0.00 177.00 171.63 1xa7 s SER 234 N 8.10 1.66 0.20 6.66 1.04 -1.26 -3.90 113.70 126.19 1xa7 s SER 234 Ca 0.72 -0.58 -0.11 0.00 0.48 0.00 0.00 55.95 56.46 1xa7 s SER 234 Cb -0.06 -0.06 0.19 0.00 0.10 0.00 0.00 66.02 66.19 1xa7 s SER 234 CO 0.02 -0.05 1.80 1.23 0.98 0.00 0.00 173.24 177.22 1xa7 h GLY 235 N 4.45 0.86 0.49 7.32 0.00 -1.77 -1.51 103.07 112.91 1xa7 h GLY 235 Ca -0.40 -0.23 0.08 0.00 0.00 0.00 0.00 47.33 46.78 1xa7 h GLY 235 CO 0.41 0.14 0.26 1.70 0.00 0.00 0.00 176.54 179.05 1xa7 h LYS 236 N 0.61 0.46 0.00 4.80 3.64 -1.88 -2.31 116.57 121.89 1xa7 h LYS 236 Ca 0.26 -0.03 -0.14 0.00 -1.27 0.00 0.00 60.65 59.47 1xa7 h LYS 236 Cb 0.15 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1xa7 h LYS 236 CO -0.17 0.30 -0.69 -0.91 -2.27 0.00 0.00 179.45 175.72 1xa7 h ASN 237 N 0.47 0.00 -0.43 4.20 2.35 -1.71 -2.56 115.58 117.91 1xa7 h ASN 237 Ca 0.29 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.97 1xa7 h ASN 237 Cb 0.31 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1xa7 h ASN 237 CO -0.26 0.69 0.02 0.00 -1.65 0.00 0.00 177.43 176.23 1xa7 h ALA 238 N 1.31 1.10 -0.27 -0.83 0.00 -1.03 -0.84 119.26 118.71 1xa7 h ALA 238 Ca -0.01 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 1xa7 h ALA 238 Cb 1.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1xa7 h ALA 238 CO 0.09 0.58 -0.38 1.49 0.00 0.00 0.00 179.25 181.03 1xa7 h GLU 239 N 0.77 0.62 0.03 0.00 4.81 -1.18 -0.40 114.58 119.23 1xa7 h GLU 239 Ca 0.15 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1xa7 h GLU 239 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1xa7 h GLU 239 CO 0.02 0.90 -0.01 -0.07 -0.73 0.00 0.00 179.01 179.11 1xa7 h LEU 240 N 0.52 -0.04 -0.72 1.64 3.38 -1.05 -0.97 115.31 118.08 1xa7 h LEU 240 Ca 0.05 -0.41 0.09 0.00 0.09 0.00 0.00 57.88 57.70 1xa7 h LEU 240 Cb 0.89 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.58 1xa7 h LEU 240 CO 0.08 0.39 0.37 0.40 0.09 0.00 0.00 178.44 179.77 1xa7 h ILE 241 N -0.47 0.88 -0.93 1.22 2.04 -1.16 0.77 117.51 119.87 1xa7 h ILE 241 Ca -0.00 -0.22 0.05 0.00 1.00 0.00 0.00 64.86 65.68 1xa7 h ILE 241 Cb 0.44 0.18 -0.06 0.00 -0.74 0.00 0.00 36.82 36.64 1xa7 h ILE 241 CO 0.01 0.12 0.61 0.28 0.00 0.00 0.00 178.15 179.16 1xa7 h SER 242 N 0.64 0.98 -0.18 1.72 0.02 -0.92 -2.18 113.55 113.64 1xa7 h SER 242 Ca 0.35 -0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 61.08 1xa7 h SER 242 Cb 0.33 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 62.67 1xa7 h SER 242 CO -0.25 0.65 -0.71 -0.33 -1.14 0.00 0.00 176.83 175.05 1xa7 h GLU 243 N 1.13 0.80 0.00 3.45 5.08 0.49 -2.65 114.58 122.88 1xa7 h GLU 243 Ca 0.38 -0.62 -0.03 0.00 -1.00 0.00 0.00 59.36 58.10 1xa7 h GLU 243 Cb 0.08 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 1xa7 h GLU 243 CO -0.13 1.23 -0.12 0.87 -1.00 0.00 0.00 179.01 179.86 1xa7 h LYS 244 N 0.54 0.00 0.00 2.33 1.57 -0.61 -2.50 116.57 117.90 1xa7 h LYS 244 Ca -0.04 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1xa7 h LYS 244 Cb 1.34 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.65 1xa7 h LYS 244 CO 0.15 0.12 -0.08 0.82 -0.57 0.00 0.00 179.45 179.89 1xa7 h ILE 245 N 0.00 1.66 -0.04 1.86 1.08 -1.31 -2.36 117.51 118.41 1xa7 h ILE 245 Ca -0.00 -2.28 0.01 0.00 -0.39 0.00 0.00 64.86 62.20 1xa7 h ILE 245 Cb 0.35 3.17 -0.00 0.00 -3.07 0.00 0.00 36.82 37.27 1xa7 h ILE 245 CO 0.02 0.56 0.08 -0.07 -0.69 0.00 0.00 178.15 178.05 1xa7 h LEU 246 N -1.00 0.00 0.00 1.44 -0.00 -1.42 -3.04 115.31 111.29 1xa7 h LEU 246 Ca -0.02 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.73 1xa7 h LEU 246 Cb 0.97 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.62 1xa7 h LEU 246 CO -0.01 0.00 -0.69 0.11 -0.00 0.00 0.00 178.44 177.84 1xa7 h LYS 247 N 0.00 0.00 -0.72 1.13 1.57 -1.48 -2.88 116.57 114.19 1xa7 h LYS 247 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1xa7 h LYS 247 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1xa7 h LYS 247 CO -0.00 0.96 0.00 -1.91 -0.57 0.00 0.00 179.45 177.93 1xa7 n GLU 248 N -4.52 0.46 -2.86 3.15 2.13 -0.89 -4.18 120.64 113.94 1xa7 n GLU 248 Ca -0.22 0.00 -0.44 0.00 0.66 0.00 0.00 57.16 57.17 1xa7 n GLU 248 Cb 0.58 -1.24 -0.00 0.00 0.27 0.00 0.00 31.44 31.05 1xa7 n GLU 248 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1xa7 s GLY 250 N -0.18 2.18 0.00 8.31 0.00 -1.09 -5.07 107.32 111.48 1xa7 s GLY 250 Ca 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 44.72 41.52 1xa7 s GLY 250 CO 0.00 2.21 0.00 3.33 0.00 0.00 0.00 173.10 178.64