#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bk7 s VAL 2 N 0.00 0.00 0.00 2.03 -7.23 -1.26 -5.17 120.40 108.77 3bk7 s VAL 2 Ca 0.00 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.07 3bk7 s VAL 2 Cb 0.00 -2.83 0.00 0.00 0.56 0.00 0.00 36.38 34.11 3bk7 s VAL 2 CO 0.00 0.00 0.00 -1.14 -0.31 0.00 0.00 175.10 173.65 3bk7 n ARG 3 N -0.54 0.00 -3.64 4.82 0.63 -1.26 -4.98 116.66 111.69 3bk7 n ARG 3 Ca -0.07 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.83 3bk7 n ARG 3 Cb 0.60 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.45 3bk7 n ARG 3 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 3bk7 s LYS 4 N -1.70 0.35 0.16 -0.14 2.20 -1.26 -3.83 119.74 115.52 3bk7 s LYS 4 Ca 0.00 0.58 0.08 0.00 -0.36 0.00 0.00 55.97 56.26 3bk7 s LYS 4 Cb 0.00 0.09 -0.04 0.00 -1.51 0.00 0.00 37.83 36.37 3bk7 s LYS 4 CO 0.00 -0.07 -0.05 -1.64 -0.36 0.00 0.00 175.35 173.23 3bk7 s MET 5 N 1.12 2.24 -0.04 4.03 -1.94 0.69 -4.71 119.30 120.70 3bk7 s MET 5 Ca -0.07 -1.14 -0.01 0.00 -1.71 0.00 0.00 55.69 52.76 3bk7 s MET 5 Cb -0.04 -2.28 -0.04 0.00 2.01 0.00 0.00 34.83 34.48 3bk7 s MET 5 CO -0.13 0.46 0.04 1.03 -0.01 0.00 0.00 175.02 176.41 3bk7 s ARG 6 N -2.76 2.99 -0.06 2.03 0.52 -1.26 -0.11 118.95 120.29 3bk7 s ARG 6 Ca 0.25 -0.47 -0.00 0.00 -0.52 0.00 0.00 55.73 54.99 3bk7 s ARG 6 Cb -0.09 -2.81 0.03 0.00 0.52 0.00 0.00 34.95 32.59 3bk7 s ARG 6 CO 0.17 0.67 -0.02 0.42 0.02 0.00 0.00 175.30 176.55 3bk7 s ILE 7 N -1.06 0.49 -0.14 1.52 1.01 -0.25 -4.92 121.20 117.85 3bk7 s ILE 7 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.83 3bk7 s ILE 7 Cb -0.12 -0.58 -0.01 0.00 0.01 0.00 0.00 42.46 41.76 3bk7 s ILE 7 CO 0.09 0.25 -0.15 0.00 0.00 0.00 0.00 174.94 175.13 3bk7 s ALA 8 N 1.51 2.52 -0.04 9.38 0.00 -1.26 -1.49 121.76 132.38 3bk7 s ALA 8 Ca -0.02 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.02 3bk7 s ALA 8 Cb -0.13 -1.18 -0.00 0.00 0.00 0.00 0.00 23.12 21.81 3bk7 s ALA 8 CO -0.03 0.13 -0.15 0.08 0.00 0.00 0.00 175.76 175.78 3bk7 s VAL 9 N 0.55 1.30 -0.21 0.00 1.01 -0.81 -3.99 120.40 118.24 3bk7 s VAL 9 Ca -0.09 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.27 3bk7 s VAL 9 Cb -0.16 -1.13 0.04 0.00 0.00 0.00 0.00 36.38 35.14 3bk7 s VAL 9 CO 0.04 0.38 -0.14 -0.63 0.00 0.00 0.00 175.10 174.75 3bk7 s ILE 10 N 0.12 1.99 -0.87 2.22 1.01 -0.88 -1.62 121.20 123.16 3bk7 s ILE 10 Ca -0.05 -1.21 -0.25 0.00 0.00 0.00 0.00 60.65 59.15 3bk7 s ILE 10 Cb -0.11 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.39 3bk7 s ILE 10 CO 0.02 0.23 1.64 -0.62 0.00 0.00 0.00 174.94 176.22 3bk7 s ASP 11 N 1.25 5.83 0.45 3.58 3.68 -0.59 -4.78 116.67 126.08 3bk7 s ASP 11 Ca -0.02 -0.77 0.13 0.00 2.13 0.00 0.00 52.55 54.02 3bk7 s ASP 11 Cb -0.16 -2.56 1.04 0.00 -1.45 0.00 0.00 42.92 39.79 3bk7 s ASP 11 CO -0.09 -2.09 2.03 1.88 0.13 0.00 0.00 175.17 177.03 3bk7 h TYR 12 N 11.08 0.37 0.00 -5.34 -1.99 -1.95 -0.30 116.97 118.84 3bk7 h TYR 12 Ca 0.02 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.76 3bk7 h TYR 12 Cb 1.04 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.65 3bk7 h TYR 12 CO 1.20 0.20 0.03 -3.47 -0.00 0.00 0.00 178.16 176.11 3bk7 n ASP 13 N -4.47 0.00 -0.00 3.88 -0.08 -1.26 -0.49 116.55 114.13 3bk7 n ASP 13 Ca 0.06 0.29 0.02 0.00 -1.51 0.00 0.00 54.79 53.65 3bk7 n ASP 13 Cb 0.27 -0.29 -0.02 0.00 2.34 0.00 0.00 41.12 43.41 3bk7 n ASP 13 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3bk7 n LYS 14 N -1.28 5.21 -3.06 -0.67 5.02 -0.13 -5.03 118.16 118.22 3bk7 n LYS 14 Ca 0.00 -0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.92 3bk7 n LYS 14 Cb 0.03 -0.73 -0.06 0.00 -0.02 0.00 0.00 35.03 34.25 3bk7 n LYS 14 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3bk7 s ASN 16 N -1.63 -0.47 0.49 0.00 3.04 -1.26 -5.00 114.94 110.10 3bk7 s ASN 16 Ca 0.44 -1.54 0.34 0.00 0.04 0.00 0.00 52.86 52.14 3bk7 s ASN 16 Cb -0.17 1.31 1.47 0.00 -1.54 0.00 0.00 41.25 42.32 3bk7 s ASN 16 CO 0.21 -0.16 1.70 -0.65 -3.04 0.00 0.00 177.10 175.17 3bk7 h PRO 17 N 6.27 0.10 0.00 0.43 0.11 -1.90 -0.79 132.00 136.21 3bk7 h PRO 17 Ca 0.08 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.15 3bk7 h PRO 17 Cb 1.10 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3bk7 h PRO 17 CO 0.13 0.06 -0.16 -0.44 -0.21 0.00 0.00 178.00 177.38 3bk7 h ASP 18 N 0.10 0.00 0.61 -2.05 3.32 -1.97 -3.27 116.42 113.16 3bk7 h ASP 18 Ca 0.71 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.49 3bk7 h ASP 18 Cb 2.50 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 42.02 3bk7 h ASP 18 CO -0.17 0.16 -1.49 0.50 -1.72 0.00 0.00 179.24 176.52 3bk7 h LYS 19 N 0.00 0.05 -0.69 3.56 3.64 -1.58 -3.34 116.57 118.22 3bk7 h LYS 19 Ca -0.00 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3bk7 h LYS 19 Cb 0.91 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 3bk7 h LYS 19 CO 0.02 0.77 0.00 0.00 -2.27 0.00 0.00 179.45 177.97 3bk7 n GLY 21 N 0.53 0.94 2.98 0.00 0.00 -1.24 -3.94 105.19 104.46 3bk7 n GLY 21 Ca 0.19 -1.33 -0.30 0.00 0.00 0.00 0.00 46.02 44.58 3bk7 n GLY 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3bk7 s HIS 22 N 0.00 3.41 -0.57 1.61 2.46 -1.25 -4.10 115.29 116.84 3bk7 s HIS 22 Ca 0.00 -3.11 -0.23 0.00 0.47 0.00 0.00 55.06 52.19 3bk7 s HIS 22 Cb 0.00 -2.86 0.03 0.00 -0.13 0.00 0.00 32.58 29.62 3bk7 s HIS 22 CO 0.00 -0.82 0.64 1.19 -2.47 0.00 0.00 174.74 173.28 3bk7 n PHE 23 N 3.54 -2.65 -0.05 3.88 3.01 -1.23 -4.69 117.46 119.27 3bk7 n PHE 23 Ca 0.05 1.09 0.24 0.00 1.01 0.00 0.00 57.45 59.84 3bk7 n PHE 23 Cb 0.36 -2.53 0.59 0.00 -0.01 0.00 0.00 39.48 37.89 3bk7 n PHE 23 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 3bk7 h LEU 24 N 1.32 0.00 0.00 4.37 5.85 -1.87 -3.01 115.31 121.96 3bk7 h LEU 24 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3bk7 h LEU 24 Cb 1.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 3bk7 h LEU 24 CO 0.27 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.37 3bk7 h GLU 26 N 0.00 0.00 0.24 0.00 4.81 -1.81 0.56 114.58 118.38 3bk7 h GLU 26 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3bk7 h GLU 26 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3bk7 h GLU 26 CO 0.00 0.00 -0.11 -0.09 -0.73 0.00 0.00 179.01 178.08 3bk7 h ARG 27 N 0.00 -0.31 0.00 1.92 2.43 -1.59 -3.33 114.38 113.50 3bk7 h ARG 27 Ca 0.37 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.56 3bk7 h ARG 27 Cb 1.82 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 31.44 3bk7 h ARG 27 CO -0.00 -0.11 -0.02 0.28 -1.51 0.00 0.00 179.97 178.60 3bk7 h VAL 28 N -1.05 0.06 -2.23 0.20 2.07 0.07 -3.45 116.25 111.91 3bk7 h VAL 28 Ca -0.03 -0.63 -0.58 0.00 0.82 0.00 0.00 66.70 66.28 3bk7 h VAL 28 Cb 0.34 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3bk7 h VAL 28 CO 0.05 0.02 1.39 0.00 0.02 0.00 0.00 177.57 179.06 3bk7 h PRO 30 N 13.84 0.26 -0.73 0.00 0.13 -1.89 0.56 132.00 144.17 3bk7 h PRO 30 Ca -0.40 -0.02 0.02 0.00 -0.87 0.00 0.00 66.00 64.74 3bk7 h PRO 30 Cb 1.22 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3bk7 h PRO 30 CO 0.98 0.17 0.47 0.28 -0.23 0.00 0.00 178.00 179.67 3bk7 h VAL 31 N 0.27 1.14 0.00 1.56 2.07 -1.94 -0.30 116.25 119.05 3bk7 h VAL 31 Ca 0.29 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 3bk7 h VAL 31 Cb 0.40 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 3bk7 h VAL 31 CO -0.36 0.17 -0.40 0.78 0.02 0.00 0.00 177.57 177.78 3bk7 h ASN 32 N 0.94 0.00 0.10 0.57 4.21 -1.54 0.54 115.58 120.40 3bk7 h ASN 32 Ca 0.28 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.77 3bk7 h ASN 32 Cb -0.04 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.16 3bk7 h ASN 32 CO -0.09 0.40 -0.09 -0.09 -1.29 0.00 0.00 177.43 176.28 3bk7 h ARG 33 N 0.00 0.00 -1.15 0.81 2.43 0.83 -2.52 114.38 114.78 3bk7 h ARG 33 Ca -0.00 0.00 -0.62 0.00 -0.81 0.00 0.00 59.98 58.54 3bk7 h ARG 33 Cb 0.77 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 29.95 3bk7 h ARG 33 CO 0.05 0.09 -0.12 -1.33 -1.51 0.00 0.00 179.97 177.15 3bk7 n MET 34 N -4.36 3.23 -3.50 0.20 2.81 -0.80 -4.93 117.12 109.77 3bk7 n MET 34 Ca -0.03 -3.94 -0.18 0.00 -1.81 0.00 0.00 57.70 51.74 3bk7 n MET 34 Cb 0.16 -2.27 0.07 0.00 -0.71 0.00 0.00 33.22 30.47 3bk7 n MET 34 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3bk7 n GLY 35 N -0.69 -0.37 3.55 3.03 0.00 -0.95 -5.02 105.19 104.74 3bk7 n GLY 35 Ca 0.49 0.12 -0.25 0.00 0.00 0.00 0.00 46.02 46.38 3bk7 n GLY 35 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3bk7 s GLY 36 N -4.33 2.38 -0.57 -0.02 0.00 0.14 -4.97 107.32 99.94 3bk7 s GLY 36 Ca 0.02 -1.88 0.04 0.00 0.00 0.00 0.00 44.72 42.90 3bk7 s GLY 36 CO 0.75 -1.95 1.18 1.18 0.00 0.00 0.00 173.10 174.26 3bk7 n GLU 37 N -0.87 3.45 -0.03 2.90 1.02 -1.26 -4.04 120.64 121.82 3bk7 n GLU 37 Ca -0.05 -4.57 -0.14 0.00 -0.02 0.00 0.00 57.16 52.38 3bk7 n GLU 37 Cb 0.67 -2.26 -0.10 0.00 -0.02 0.00 0.00 31.44 29.72 3bk7 n GLU 37 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3bk7 h ALA 38 N 2.89 0.03 -3.12 0.62 0.00 -1.88 -3.40 119.26 114.40 3bk7 h ALA 38 Ca 0.28 -0.34 -0.67 0.00 0.00 0.00 0.00 54.91 54.18 3bk7 h ALA 38 Cb 0.63 -0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.10 3bk7 h ALA 38 CO 0.92 -0.12 -0.78 0.42 0.00 0.00 0.00 179.25 179.69 3bk7 s ILE 39 N -3.67 2.71 0.06 0.00 1.01 -1.26 0.66 121.20 120.72 3bk7 s ILE 39 Ca -0.16 -0.84 0.05 0.00 0.00 0.00 0.00 60.65 59.69 3bk7 s ILE 39 Cb 0.01 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 3bk7 s ILE 39 CO 0.70 0.39 -0.04 -0.63 0.00 0.00 0.00 174.94 175.36 3bk7 s ILE 40 N 1.36 3.80 -0.19 2.92 1.01 0.20 -4.73 121.20 125.56 3bk7 s ILE 40 Ca 0.04 -0.96 -0.13 0.00 0.00 0.00 0.00 60.65 59.60 3bk7 s ILE 40 Cb -0.15 -2.75 -0.05 0.00 0.01 0.00 0.00 42.46 39.53 3bk7 s ILE 40 CO -0.07 0.21 0.27 -0.63 0.00 0.00 0.00 174.94 174.72 3bk7 s ILE 41 N -1.19 5.31 -1.03 2.92 1.01 -1.26 0.85 121.20 127.80 3bk7 s ILE 41 Ca 0.22 0.46 -0.15 0.00 0.00 0.00 0.00 60.65 61.18 3bk7 s ILE 41 Cb -0.11 -3.61 0.18 0.00 0.01 0.00 0.00 42.46 38.93 3bk7 s ILE 41 CO 0.14 0.35 1.17 -0.62 0.00 0.00 0.00 174.94 175.98 3bk7 s ASP 42 N 0.72 6.89 -1.28 3.58 3.68 0.03 -4.91 116.67 125.37 3bk7 s ASP 42 Ca 0.14 -2.68 -0.16 0.00 2.13 0.00 0.00 52.55 51.98 3bk7 s ASP 42 Cb -0.13 -2.34 -0.01 0.00 -1.45 0.00 0.00 42.92 38.99 3bk7 s ASP 42 CO 0.04 -0.77 2.14 -0.62 0.13 0.00 0.00 175.17 176.09 3bk7 n GLU 43 N 5.30 2.52 0.04 4.34 1.02 -1.26 -0.66 120.64 131.93 3bk7 n GLU 43 Ca 0.26 -2.42 0.00 0.00 -0.02 0.00 0.00 57.16 54.98 3bk7 n GLU 43 Cb 0.45 -3.20 0.00 0.00 -0.02 0.00 0.00 31.44 28.67 3bk7 n GLU 43 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 3bk7 n GLU 44 N 6.38 0.00 0.00 3.49 2.13 -1.26 -4.82 120.64 126.55 3bk7 n GLU 44 Ca 0.51 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.49 3bk7 n GLU 44 Cb 0.40 0.00 0.82 0.00 0.27 0.00 0.00 31.44 32.92 3bk7 n GLU 44 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3bk7 n ASN 45 N -2.43 0.07 -3.56 4.31 3.02 -1.22 -4.94 115.26 110.52 3bk7 n ASN 45 Ca 0.00 -0.55 -0.22 0.00 -0.03 0.00 0.00 54.58 53.78 3bk7 n ASN 45 Cb 0.00 -0.15 0.02 0.00 -0.61 0.00 0.00 39.78 39.05 3bk7 n ASN 45 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3bk7 n TYR 46 N -1.11 -2.20 -4.10 3.10 -0.00 0.16 -5.03 117.16 107.98 3bk7 n TYR 46 Ca 0.18 0.71 -0.09 0.00 -0.00 0.00 0.00 57.90 58.70 3bk7 n TYR 46 Cb 0.19 -3.44 -0.09 0.00 -0.00 0.00 0.00 39.34 36.00 3bk7 n TYR 46 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 3bk7 s LYS 47 N -5.01 0.94 0.16 2.98 1.02 -1.10 -4.86 119.74 113.88 3bk7 s LYS 47 Ca 0.25 -1.35 0.04 0.00 0.02 0.00 0.00 55.97 54.93 3bk7 s LYS 47 Cb -0.09 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.46 3bk7 s LYS 47 CO 0.84 -0.28 0.22 -1.25 -0.92 0.00 0.00 175.35 173.96 3bk7 s PRO 48 N -4.01 3.20 -0.03 -1.68 0.04 -1.26 -0.79 135.00 130.47 3bk7 s PRO 48 Ca 0.21 -0.72 0.01 0.00 0.04 0.00 0.00 61.00 60.53 3bk7 s PRO 48 Cb 0.07 -2.82 0.02 0.00 0.04 0.00 0.00 34.50 31.80 3bk7 s PRO 48 CO -0.00 0.50 -0.03 0.42 0.04 0.00 0.00 177.00 177.93 3bk7 s ILE 49 N -1.76 0.35 -0.29 0.56 1.01 0.25 -4.87 121.20 116.46 3bk7 s ILE 49 Ca 0.33 -0.07 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 3bk7 s ILE 49 Cb -0.11 -0.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.94 3bk7 s ILE 49 CO 0.26 0.16 0.19 -0.63 0.00 0.00 0.00 174.94 174.92 3bk7 s ILE 50 N 0.66 5.23 -0.98 2.92 1.01 -1.26 0.58 121.20 129.35 3bk7 s ILE 50 Ca -0.07 0.09 -0.20 0.00 0.00 0.00 0.00 60.65 60.46 3bk7 s ILE 50 Cb -0.11 -3.52 0.10 0.00 0.01 0.00 0.00 42.46 38.95 3bk7 s ILE 50 CO -0.01 0.22 1.26 -1.10 0.00 0.00 0.00 174.94 175.32 3bk7 s GLN 51 N 1.74 3.61 0.52 2.79 -0.21 0.21 -4.84 119.66 123.48 3bk7 s GLN 51 Ca 0.07 -1.55 0.11 0.00 0.02 0.00 0.00 55.36 54.01 3bk7 s GLN 51 Cb -0.16 -5.10 0.60 0.00 1.00 0.00 0.00 33.01 29.35 3bk7 s GLN 51 CO 0.10 -1.94 1.26 0.93 -2.12 0.00 0.00 175.29 173.52 3bk7 h GLU 52 N 9.13 0.00 0.00 2.91 5.08 -1.91 0.63 114.58 130.41 3bk7 h GLU 52 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3bk7 h GLU 52 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3bk7 h GLU 52 CO 1.24 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 179.25 3bk7 h ALA 53 N 0.63 1.00 -3.00 3.43 0.00 -1.92 -3.38 119.26 116.01 3bk7 h ALA 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3bk7 h ALA 53 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3bk7 h ALA 53 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.68 3bk7 n SER 54 N -2.58 0.00 0.00 0.00 7.64 0.22 -5.04 113.62 113.85 3bk7 n SER 54 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 3bk7 n SER 54 Cb 0.21 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 3bk7 n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3bk7 n THR 56 N 0.19 0.65 -0.96 0.00 -2.24 -1.26 -4.87 114.28 105.78 3bk7 n THR 56 Ca 0.00 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3bk7 n THR 56 Cb 0.00 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.42 3bk7 n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bk7 n GLY 57 N 0.77 0.42 0.29 3.38 0.00 -1.26 -4.91 105.19 103.87 3bk7 n GLY 57 Ca 0.04 -0.93 0.15 0.00 0.00 0.00 0.00 46.02 45.28 3bk7 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bk7 n GLY 59 N -1.14 0.87 0.07 0.00 0.00 -1.26 -4.94 105.19 98.79 3bk7 n GLY 59 Ca -0.03 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.26 3bk7 n GLY 59 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3bk7 h ILE 60 N 0.00 1.32 -0.85 -0.61 2.04 -1.94 -2.96 117.51 114.50 3bk7 h ILE 60 Ca -0.13 -0.99 0.16 0.00 1.00 0.00 0.00 64.86 64.90 3bk7 h ILE 60 Cb 0.47 1.89 -0.06 0.00 -0.74 0.00 0.00 36.82 38.38 3bk7 h ILE 60 CO 0.19 0.27 0.56 0.00 0.00 0.00 0.00 178.15 179.17 3bk7 h VAL 62 N 0.53 1.23 -0.26 0.00 2.07 -1.86 -1.89 116.25 116.07 3bk7 h VAL 62 Ca 0.43 -0.79 -0.13 0.00 0.82 0.00 0.00 66.70 67.03 3bk7 h VAL 62 Cb 0.88 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3bk7 h VAL 62 CO -0.18 0.27 -0.37 0.45 0.02 0.00 0.00 177.57 177.77 3bk7 h HIS 63 N 0.43 0.68 -0.13 1.57 -0.00 -1.16 -3.29 115.15 113.25 3bk7 h HIS 63 Ca 0.11 -0.19 -0.09 0.00 -0.00 0.00 0.00 60.37 60.21 3bk7 h HIS 63 Cb 0.33 -0.15 0.00 0.00 -0.00 0.00 0.00 27.41 27.59 3bk7 h HIS 63 CO 0.02 0.87 -0.25 0.87 -0.00 0.00 0.00 177.93 179.43 3bk7 h LYS 64 N 0.48 0.39 -4.72 2.45 6.56 -1.20 -3.45 116.57 117.09 3bk7 h LYS 64 Ca 0.05 -0.26 -0.59 0.00 -1.06 0.00 0.00 60.65 58.80 3bk7 h LYS 64 Cb 0.86 0.03 -0.04 0.00 -0.57 0.00 0.00 32.23 32.51 3bk7 h LYS 64 CO 0.07 0.86 1.12 0.00 -2.06 0.00 0.00 179.45 179.44 3bk7 h PRO 66 N 7.67 0.00 0.00 0.00 0.13 -1.92 -3.32 132.00 134.56 3bk7 h PRO 66 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 3bk7 h PRO 66 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3bk7 h PRO 66 CO 0.92 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.88 3bk7 n PHE 67 N -2.45 0.00 0.00 1.56 3.01 -1.26 -5.07 117.46 113.25 3bk7 n PHE 67 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3bk7 n PHE 67 Cb 0.57 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.04 3bk7 n PHE 67 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 3bk7 n ASN 68 N 0.00 0.00 -1.02 4.37 5.15 -1.25 -5.01 115.26 117.50 3bk7 n ASN 68 Ca 0.00 0.00 0.06 0.00 -0.60 0.00 0.00 54.58 54.04 3bk7 n ASN 68 Cb 0.00 0.00 0.22 0.00 -0.53 0.00 0.00 39.78 39.47 3bk7 n ASN 68 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3bk7 n ALA 69 N 0.00 2.73 -2.89 5.20 0.00 -1.26 -4.84 120.51 119.45 3bk7 n ALA 69 Ca 0.00 -0.93 -0.19 0.00 0.00 0.00 0.00 53.44 52.31 3bk7 n ALA 69 Cb 0.00 -1.00 -0.15 0.00 0.00 0.00 0.00 19.45 18.30 3bk7 n ALA 69 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3bk7 s ILE 70 N -1.61 0.71 -0.02 0.00 1.01 -1.26 -1.54 121.20 118.49 3bk7 s ILE 70 Ca 0.32 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.63 3bk7 s ILE 70 Cb 0.19 -0.62 0.02 0.00 0.01 0.00 0.00 42.46 42.07 3bk7 s ILE 70 CO 0.18 0.21 0.00 -0.44 0.00 0.00 0.00 174.94 174.89 3bk7 s SER 71 N 0.03 0.31 -0.11 3.58 0.01 -0.64 -4.85 113.70 112.03 3bk7 s SER 71 Ca -0.00 -0.02 -0.01 0.00 1.31 0.00 0.00 55.95 57.23 3bk7 s SER 71 Cb -0.06 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.05 3bk7 s SER 71 CO 0.00 -0.08 -0.04 -0.63 0.41 0.00 0.00 173.24 172.90 3bk7 s ILE 72 N 0.80 0.78 0.07 1.44 -1.09 -1.26 -1.93 121.20 120.00 3bk7 s ILE 72 Ca -0.08 -0.20 0.09 0.00 -2.23 0.00 0.00 60.65 58.24 3bk7 s ILE 72 Cb -0.11 -0.89 -0.03 0.00 -1.58 0.00 0.00 42.46 39.85 3bk7 s ILE 72 CO -0.02 0.27 -0.24 0.68 -1.23 0.00 0.00 174.94 174.41 3bk7 s VAL 73 N 1.80 1.94 -0.37 2.92 -7.23 -0.55 -4.97 120.40 113.94 3bk7 s VAL 73 Ca 0.04 -1.42 -0.09 0.00 -1.81 0.00 0.00 61.98 58.70 3bk7 s VAL 73 Cb -0.13 -1.69 0.04 0.00 0.56 0.00 0.00 36.38 35.15 3bk7 s VAL 73 CO -0.07 0.20 0.18 0.20 -0.31 0.00 0.00 175.10 175.30 3bk7 s ASN 74 N -1.47 5.58 0.25 4.85 -0.87 -1.26 -1.09 114.94 120.93 3bk7 s ASN 74 Ca 0.10 -1.12 0.09 0.00 -1.57 0.00 0.00 52.86 50.36 3bk7 s ASN 74 Cb -0.10 -1.97 -0.04 0.00 -0.02 0.00 0.00 41.25 39.13 3bk7 s ASN 74 CO 0.03 -0.39 0.00 -0.76 -2.57 0.00 0.00 177.10 173.41 3bk7 s LEU 75 N 1.48 3.23 0.23 0.60 1.43 0.84 -4.91 118.68 121.59 3bk7 s LEU 75 Ca 0.01 -0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 52.23 3bk7 s LEU 75 Cb -0.20 -1.78 -0.09 0.00 0.03 0.00 0.00 46.19 44.15 3bk7 s LEU 75 CO 0.05 0.02 1.04 -2.16 0.23 0.00 0.00 176.35 175.52 3bk7 s PRO 76 N -3.52 4.71 0.03 1.29 0.04 -1.26 0.25 135.00 136.54 3bk7 s PRO 76 Ca 0.30 1.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 3bk7 s PRO 76 Cb -0.07 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 31.16 3bk7 s PRO 76 CO 0.20 0.29 1.28 -1.21 0.04 0.00 0.00 177.00 177.59 3bk7 s GLU 77 N -1.03 4.36 0.00 4.56 2.02 -1.25 -3.53 118.70 123.83 3bk7 s GLU 77 Ca 0.44 1.84 0.00 0.00 0.02 0.00 0.00 54.97 57.27 3bk7 s GLU 77 Cb -0.29 -3.43 0.00 0.00 0.10 0.00 0.00 34.13 30.51 3bk7 s GLU 77 CO 0.36 -0.40 0.00 0.94 0.02 0.00 0.00 175.26 176.18 3bk7 n GLN 78 N 4.56 0.00 0.20 1.61 -0.06 -1.26 -4.82 117.38 117.61 3bk7 n GLN 78 Ca 0.11 0.00 0.06 0.00 -2.00 0.00 0.00 57.00 55.16 3bk7 n GLN 78 Cb 0.45 0.00 0.39 0.00 -4.06 0.00 0.00 30.24 27.02 3bk7 n GLN 78 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 3bk7 h LEU 79 N 0.00 0.00 -2.51 1.69 3.38 -1.97 -1.66 115.31 114.24 3bk7 h LEU 79 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3bk7 h LEU 79 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3bk7 h LEU 79 CO 0.00 0.35 0.15 -0.78 0.09 0.00 0.00 178.44 178.25 3bk7 h ASP 80 N 0.00 0.00 -0.07 -0.43 -0.00 -1.89 0.50 116.42 114.53 3bk7 h ASP 80 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3bk7 h ASP 80 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.12 3bk7 h ASP 80 CO 0.05 0.00 0.00 -0.62 -0.00 0.00 0.00 179.24 178.67 3bk7 n GLU 81 N -3.13 2.13 -0.09 0.28 -0.58 -0.63 -3.87 120.64 114.75 3bk7 n GLU 81 Ca -0.02 -1.65 0.04 0.00 -0.42 0.00 0.00 57.16 55.11 3bk7 n GLU 81 Cb 0.22 -1.47 0.06 0.00 -0.57 0.00 0.00 31.44 29.68 3bk7 n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3bk7 n ASP 82 N 0.98 1.66 -4.70 1.62 10.43 0.16 -5.05 116.55 121.65 3bk7 n ASP 82 Ca 0.16 -2.33 -0.42 0.00 2.57 0.00 0.00 54.79 54.77 3bk7 n ASP 82 Cb 0.52 -0.20 -0.03 0.00 1.84 0.00 0.00 41.12 43.25 3bk7 n ASP 82 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3bk7 n VAL 84 N 4.33 0.97 -3.64 0.00 0.31 -0.20 -4.62 118.33 115.48 3bk7 n VAL 84 Ca 0.15 -0.43 -0.08 0.00 -0.01 0.00 0.00 64.34 63.96 3bk7 n VAL 84 Cb 0.39 -0.97 -0.07 0.00 -0.91 0.00 0.00 33.84 32.28 3bk7 n VAL 84 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 3bk7 s HIS 85 N -2.34 -0.47 -0.02 3.52 2.46 -1.08 -1.88 115.29 115.48 3bk7 s HIS 85 Ca -0.18 1.13 0.02 0.00 0.47 0.00 0.00 55.06 56.50 3bk7 s HIS 85 Cb 0.05 0.37 0.00 0.00 -0.13 0.00 0.00 32.58 32.88 3bk7 s HIS 85 CO 0.44 -0.23 -0.07 0.50 -2.47 0.00 0.00 174.74 172.91 3bk7 s ARG 86 N 0.34 0.81 -0.02 2.88 3.52 -1.26 0.40 118.95 125.61 3bk7 s ARG 86 Ca 0.02 -0.25 0.03 0.00 -0.13 0.00 0.00 55.73 55.40 3bk7 s ARG 86 Cb -0.05 -0.77 0.12 0.00 -1.56 0.00 0.00 34.95 32.69 3bk7 s ARG 86 CO -0.07 0.08 0.86 0.66 -0.81 0.00 0.00 175.30 176.02 3bk7 n TYR 87 N 3.33 0.26 0.00 5.12 4.02 -0.23 -4.82 117.16 124.83 3bk7 n TYR 87 Ca -0.18 -0.10 0.00 0.00 -0.01 0.00 0.00 57.90 57.61 3bk7 n TYR 87 Cb 0.55 -0.10 0.00 0.00 -0.02 0.00 0.00 39.34 39.77 3bk7 n TYR 87 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3bk7 n GLY 88 N 0.34 0.75 3.64 2.72 0.00 -1.26 -4.84 105.19 106.54 3bk7 n GLY 88 Ca 0.04 -2.19 -0.44 0.00 0.00 0.00 0.00 46.02 43.43 3bk7 n GLY 88 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3bk7 n VAL 89 N 0.31 0.59 -1.43 1.61 0.31 -1.26 -1.30 118.33 117.17 3bk7 n VAL 89 Ca 0.00 -0.24 -0.15 0.00 -0.01 0.00 0.00 64.34 63.95 3bk7 n VAL 89 Cb 0.00 -2.30 -0.06 0.00 -0.91 0.00 0.00 33.84 30.57 3bk7 n VAL 89 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3bk7 n ASN 90 N 8.77 -4.85 -5.02 4.52 5.03 -1.26 -4.92 115.26 117.53 3bk7 n ASN 90 Ca 0.24 0.36 -0.19 0.00 0.87 0.00 0.00 54.58 55.87 3bk7 n ASN 90 Cb 0.39 -3.65 0.04 0.00 -1.02 0.00 0.00 39.78 35.55 3bk7 n ASN 90 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3bk7 s ALA 91 N -2.52 4.63 0.43 5.41 0.00 -0.42 -2.07 121.76 127.23 3bk7 s ALA 91 Ca 0.00 -1.98 -0.26 0.00 0.00 0.00 0.00 51.96 49.73 3bk7 s ALA 91 Cb 0.00 -1.53 -0.08 0.00 0.00 0.00 0.00 23.12 21.51 3bk7 s ALA 91 CO 0.00 -0.67 1.36 0.12 0.00 0.00 0.00 175.76 176.57 3bk7 s PHE 92 N -2.57 2.64 0.01 0.00 5.36 -1.26 -4.69 117.98 117.47 3bk7 s PHE 92 Ca 0.60 1.34 0.03 0.00 -0.96 0.00 0.00 56.93 57.94 3bk7 s PHE 92 Cb -0.07 -3.78 -0.01 0.00 -0.34 0.00 0.00 43.02 38.81 3bk7 s PHE 92 CO 0.37 -2.49 -0.10 0.54 -1.46 0.00 0.00 175.22 172.08 3bk7 s VAL 93 N -1.24 0.80 -0.03 3.12 0.11 -0.66 -1.07 120.40 121.43 3bk7 s VAL 93 Ca 0.59 -0.57 0.04 0.00 -2.93 0.00 0.00 61.98 59.11 3bk7 s VAL 93 Cb -0.41 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 33.72 3bk7 s VAL 93 CO 0.52 0.13 -0.14 -0.22 -3.33 0.00 0.00 175.10 172.06 3bk7 s LEU 94 N -0.51 2.76 -0.05 2.54 2.96 0.16 -1.99 118.68 124.56 3bk7 s LEU 94 Ca 0.02 -0.22 0.06 0.00 -0.22 0.00 0.00 54.13 53.77 3bk7 s LEU 94 Cb -0.05 -1.57 -0.01 0.00 0.50 0.00 0.00 46.19 45.05 3bk7 s LEU 94 CO 0.00 0.33 -0.24 -0.31 -1.32 0.00 0.00 176.35 174.80 3bk7 s TYR 95 N -0.78 2.44 0.41 5.38 1.51 0.69 -1.04 117.35 125.96 3bk7 s TYR 95 Ca 0.12 -0.63 0.00 0.00 -1.01 0.00 0.00 57.07 55.55 3bk7 s TYR 95 Cb -0.11 -1.58 0.00 0.00 -0.11 0.00 0.00 41.96 40.16 3bk7 s TYR 95 CO 0.02 -0.16 0.00 0.54 -1.11 0.00 0.00 175.55 174.84 3bk7 n ARG 96 N 2.82 -2.46 -4.05 -0.62 1.74 -0.58 -2.04 116.66 111.46 3bk7 n ARG 96 Ca -0.17 1.90 -0.09 0.00 -0.77 0.00 0.00 57.85 58.71 3bk7 n ARG 96 Cb 0.52 -2.92 -0.11 0.00 -1.02 0.00 0.00 32.46 28.93 3bk7 n ARG 96 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3bk7 s LEU 97 N -6.67 2.36 0.61 0.55 1.43 -1.26 -4.55 118.68 111.15 3bk7 s LEU 97 Ca 0.00 -0.74 -0.13 0.00 -1.03 0.00 0.00 54.13 52.23 3bk7 s LEU 97 Cb 0.00 0.06 -0.03 0.00 0.03 0.00 0.00 46.19 46.25 3bk7 s LEU 97 CO 0.00 -0.40 1.04 -2.16 0.23 0.00 0.00 176.35 175.05 3bk7 s PRO 98 N -2.58 3.41 -0.18 1.29 0.04 -1.26 -4.98 135.00 130.75 3bk7 s PRO 98 Ca -0.04 0.95 -0.09 0.00 0.04 0.00 0.00 61.00 61.87 3bk7 s PRO 98 Cb -0.02 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 3bk7 s PRO 98 CO -0.04 -0.72 0.13 0.42 0.04 0.00 0.00 177.00 176.82 3bk7 s ILE 99 N -2.86 5.38 -0.16 0.56 1.09 -1.26 -5.09 121.20 118.85 3bk7 s ILE 99 Ca 0.59 0.17 -0.10 0.00 -1.10 0.00 0.00 60.65 60.21 3bk7 s ILE 99 Cb -0.13 -3.42 -0.05 0.00 -1.06 0.00 0.00 42.46 37.81 3bk7 s ILE 99 CO 0.46 0.49 0.17 0.68 -0.10 0.00 0.00 174.94 176.64 3bk7 s VAL 100 N -0.04 5.40 -0.11 2.92 -7.23 -1.26 -4.87 120.40 115.22 3bk7 s VAL 100 Ca 0.10 0.28 0.02 0.00 -1.81 0.00 0.00 61.98 60.57 3bk7 s VAL 100 Cb -0.11 -3.49 0.01 0.00 0.56 0.00 0.00 36.38 33.35 3bk7 s VAL 100 CO -0.00 0.49 -0.17 -0.54 -0.31 0.00 0.00 175.10 174.57 3bk7 s LYS 101 N -0.05 2.33 0.18 4.82 1.02 -1.26 -5.10 119.74 121.67 3bk7 s LYS 101 Ca 0.12 -0.61 -0.33 0.00 0.02 0.00 0.00 55.97 55.17 3bk7 s LYS 101 Cb -0.12 -1.94 -0.13 0.00 -0.52 0.00 0.00 37.83 35.12 3bk7 s LYS 101 CO 0.01 -0.03 1.62 -0.25 -0.92 0.00 0.00 175.35 175.79 3bk7 n ASP 102 N 4.08 3.39 -0.02 2.83 10.43 -1.26 -2.15 116.55 133.86 3bk7 n ASP 102 Ca -0.19 1.08 -0.00 0.00 2.57 0.00 0.00 54.79 58.24 3bk7 n ASP 102 Cb 0.51 -1.48 -0.00 0.00 1.84 0.00 0.00 41.12 42.00 3bk7 n ASP 102 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3bk7 n GLY 103 N 3.52 0.47 3.22 0.44 0.00 -0.92 -4.86 105.19 107.06 3bk7 n GLY 103 Ca 0.16 -0.14 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 3bk7 n GLY 103 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3bk7 s MET 104 N -0.42 1.15 -0.32 1.61 -1.94 -0.91 -4.59 119.30 113.87 3bk7 s MET 104 Ca 0.00 -1.54 -0.05 0.00 -1.71 0.00 0.00 55.69 52.39 3bk7 s MET 104 Cb 0.00 0.28 0.04 0.00 2.01 0.00 0.00 34.83 37.16 3bk7 s MET 104 CO 0.00 -0.38 0.07 0.08 -0.01 0.00 0.00 175.02 174.79 3bk7 s VAL 105 N -4.11 3.60 -0.37 -6.03 1.01 -1.26 -0.18 120.40 113.05 3bk7 s VAL 105 Ca 0.33 -1.13 -0.17 0.00 0.00 0.00 0.00 61.98 61.01 3bk7 s VAL 105 Cb 0.06 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.43 3bk7 s VAL 105 CO 0.09 -0.12 0.45 -0.69 0.00 0.00 0.00 175.10 174.83 3bk7 s VAL 106 N 1.38 5.08 0.44 2.92 1.01 0.21 0.42 120.40 131.86 3bk7 s VAL 106 Ca -0.02 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 3bk7 s VAL 106 Cb -0.19 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 3bk7 s VAL 106 CO 0.02 -0.26 0.78 -0.83 0.00 0.00 0.00 175.10 174.80 3bk7 s GLY 107 N 1.78 1.74 -0.06 4.51 0.00 0.20 -1.79 107.32 113.71 3bk7 s GLY 107 Ca 0.15 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.53 3bk7 s GLY 107 CO 0.13 -0.16 -0.05 -0.42 0.00 0.00 0.00 173.10 172.60 3bk7 s ILE 108 N -2.55 0.64 0.03 0.90 1.01 0.85 -1.54 121.20 120.53 3bk7 s ILE 108 Ca 0.49 -0.14 0.02 0.00 0.00 0.00 0.00 60.65 61.02 3bk7 s ILE 108 Cb -0.10 -0.67 -0.02 0.00 0.01 0.00 0.00 42.46 41.68 3bk7 s ILE 108 CO 0.38 0.26 -0.07 0.54 0.00 0.00 0.00 174.94 176.05 3bk7 s VAL 109 N 1.15 0.48 0.00 2.92 0.11 -0.54 -2.01 120.40 122.51 3bk7 s VAL 109 Ca -0.07 -0.77 0.00 0.00 -2.93 0.00 0.00 61.98 58.21 3bk7 s VAL 109 Cb -0.14 -0.51 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 3bk7 s VAL 109 CO -0.01 -0.21 0.00 0.61 -3.33 0.00 0.00 175.10 172.16 3bk7 n GLY 110 N 2.00 2.46 3.72 6.54 0.00 -1.26 -1.39 105.19 117.25 3bk7 n GLY 110 Ca -0.19 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.53 3bk7 n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3bk7 s PRO 111 N -2.00 1.98 0.75 1.61 0.04 -1.26 -4.63 135.00 131.49 3bk7 s PRO 111 Ca 0.00 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.61 3bk7 s PRO 111 Cb 0.00 -1.82 0.05 0.00 0.04 0.00 0.00 34.50 32.77 3bk7 s PRO 111 CO 0.00 -1.94 1.10 -0.80 0.04 0.00 0.00 177.00 175.40 3bk7 s ASN 112 N -2.23 4.54 0.00 6.66 0.01 -1.26 -3.59 114.94 119.08 3bk7 s ASN 112 Ca 0.72 1.90 0.00 0.00 -0.71 0.00 0.00 52.86 54.77 3bk7 s ASN 112 Cb -0.27 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 38.86 3bk7 s ASN 112 CO 0.48 -2.01 0.00 0.61 -1.51 0.00 0.00 177.10 174.67 3bk7 n GLY 113 N -0.93 0.42 0.58 0.66 0.00 -1.26 -4.57 105.19 100.09 3bk7 n GLY 113 Ca 0.10 -0.87 0.06 0.00 0.00 0.00 0.00 46.02 45.32 3bk7 n GLY 113 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3bk7 n THR 114 N -2.97 1.74 -1.06 2.61 -2.24 -1.24 0.48 114.28 111.61 3bk7 n THR 114 Ca 0.00 -2.56 -0.02 0.00 -2.27 0.00 0.00 64.05 59.20 3bk7 n THR 114 Cb 0.00 -0.05 -0.01 0.00 -2.10 0.00 0.00 70.33 68.18 3bk7 n THR 114 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bk7 n GLY 115 N -0.93 0.55 0.37 3.38 0.00 -1.26 -4.40 105.19 102.89 3bk7 n GLY 115 Ca 0.16 -0.62 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 3bk7 n GLY 115 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bk7 h LYS 116 N 0.29 -0.73 0.00 1.61 1.57 -1.95 -0.70 116.57 116.65 3bk7 h LYS 116 Ca -0.04 0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 3bk7 h LYS 116 Cb 0.18 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3bk7 h LYS 116 CO 0.06 -0.49 -0.21 1.15 -0.57 0.00 0.00 179.45 179.39 3bk7 h THR 117 N -0.76 0.78 -0.39 -0.16 2.02 -1.99 -2.63 112.91 109.78 3bk7 h THR 117 Ca -0.04 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.26 3bk7 h THR 117 Cb 0.66 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 3bk7 h THR 117 CO -0.01 0.20 0.04 0.74 0.37 0.00 0.00 175.52 176.86 3bk7 h THR 118 N 0.00 1.25 -0.32 3.16 2.02 -1.79 -2.62 112.91 114.60 3bk7 h THR 118 Ca -0.00 -0.92 -0.00 0.00 0.77 0.00 0.00 66.41 66.25 3bk7 h THR 118 Cb 0.49 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3bk7 h THR 118 CO 0.03 0.31 0.18 0.00 0.37 0.00 0.00 175.52 176.41 3bk7 h ALA 119 N 0.90 1.71 -0.12 6.16 0.00 -0.78 -2.96 119.26 124.18 3bk7 h ALA 119 Ca 0.11 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3bk7 h ALA 119 Cb 0.41 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3bk7 h ALA 119 CO 0.01 0.25 -0.09 0.28 0.00 0.00 0.00 179.25 179.70 3bk7 h VAL 120 N 0.44 1.34 0.00 0.00 2.07 -1.33 -2.36 116.25 116.43 3bk7 h VAL 120 Ca 0.12 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.38 3bk7 h VAL 120 Cb 0.01 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 3bk7 h VAL 120 CO -0.02 0.35 -0.25 0.11 0.02 0.00 0.00 177.57 177.78 3bk7 h LYS 121 N -0.12 0.00 0.15 1.57 1.57 -1.36 -1.65 116.57 116.74 3bk7 h LYS 121 Ca 0.02 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3bk7 h LYS 121 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 3bk7 h LYS 121 CO 0.02 0.25 -0.07 0.82 -0.57 0.00 0.00 179.45 179.90 3bk7 h ILE 122 N 0.00 0.97 0.00 1.86 2.04 -1.49 0.13 117.51 121.03 3bk7 h ILE 122 Ca -0.00 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.81 3bk7 h ILE 122 Cb 0.44 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 3bk7 h ILE 122 CO 0.03 0.23 0.00 -0.07 0.00 0.00 0.00 178.15 178.34 3bk7 h LEU 123 N -0.75 0.00 -0.84 1.44 3.38 -1.33 -1.77 115.31 115.45 3bk7 h LEU 123 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3bk7 h LEU 123 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3bk7 h LEU 123 CO 0.03 0.00 -0.37 0.00 0.09 0.00 0.00 178.44 178.19 3bk7 n ALA 124 N -1.89 3.33 0.00 1.53 0.00 -0.63 -4.85 120.51 118.00 3bk7 n ALA 124 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.89 3bk7 n ALA 124 Cb 0.18 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.70 3bk7 n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bk7 n GLY 125 N 1.38 1.78 0.25 0.00 0.00 -0.67 -4.57 105.19 103.37 3bk7 n GLY 125 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 3bk7 n GLY 125 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3bk7 h GLN 126 N 2.82 0.45 -4.61 1.61 4.20 -1.06 -3.42 115.11 115.10 3bk7 h GLN 126 Ca 0.00 -0.13 -0.55 0.00 0.06 0.00 0.00 58.65 58.03 3bk7 h GLN 126 Cb 0.00 -0.05 -0.34 0.00 0.30 0.00 0.00 27.48 27.39 3bk7 h GLN 126 CO 0.00 0.59 -0.82 -1.17 -0.67 0.00 0.00 178.83 176.75 3bk7 s LEU 127 N -8.82 1.63 -0.39 1.46 2.96 -0.28 -4.97 118.68 110.28 3bk7 s LEU 127 Ca -0.07 -0.36 -0.21 0.00 -0.22 0.00 0.00 54.13 53.26 3bk7 s LEU 127 Cb 0.15 -0.96 0.01 0.00 0.50 0.00 0.00 46.19 45.89 3bk7 s LEU 127 CO 0.77 0.01 0.69 -0.63 -1.32 0.00 0.00 176.35 175.87 3bk7 s ILE 128 N 0.93 4.81 0.36 6.68 1.01 -1.26 -3.89 121.20 129.83 3bk7 s ILE 128 Ca -0.09 0.54 -0.27 0.00 0.00 0.00 0.00 60.65 60.83 3bk7 s ILE 128 Cb -0.15 -4.17 -0.12 0.00 0.01 0.00 0.00 42.46 38.03 3bk7 s ILE 128 CO 0.00 -0.45 1.21 -0.81 0.00 0.00 0.00 174.94 174.88 3bk7 n PRO 129 N 6.27 1.88 -0.34 2.79 -0.04 -1.26 -4.90 135.00 139.40 3bk7 n PRO 129 Ca 0.00 0.66 0.11 0.00 -0.04 0.00 0.00 63.50 64.23 3bk7 n PRO 129 Cb 0.48 -2.23 0.29 0.00 -0.04 0.00 0.00 33.50 32.01 3bk7 n PRO 129 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3bk7 n ASN 130 N 0.71 3.57 -2.80 3.54 0.23 -1.24 -4.70 115.26 114.57 3bk7 n ASN 130 Ca 0.06 -2.01 -0.14 0.00 -0.53 0.00 0.00 54.58 51.96 3bk7 n ASN 130 Cb 0.36 -0.45 -0.01 0.00 -2.08 0.00 0.00 39.78 37.61 3bk7 n ASN 130 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3bk7 n LEU 131 N 1.43 -1.08 -3.65 -4.53 4.77 -0.79 0.21 117.00 113.36 3bk7 n LEU 131 Ca 0.22 0.03 -0.27 0.00 -0.03 0.00 0.00 56.01 55.95 3bk7 n LEU 131 Cb 0.57 -1.93 0.02 0.00 -2.33 0.00 0.00 43.42 39.74 3bk7 n LEU 131 CO 0.15 -0.01 0.05 0.00 -1.33 0.00 0.00 177.39 176.25 3bk7 n GLU 133 N -4.32 0.00 -0.34 0.00 2.13 0.13 -4.95 120.64 113.29 3bk7 n GLU 133 Ca 0.01 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.91 3bk7 n GLU 133 Cb 0.54 0.00 0.18 0.00 0.27 0.00 0.00 31.44 32.43 3bk7 n GLU 133 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 3bk7 n ASP 134 N 0.00 2.05 -4.77 4.31 3.85 -1.25 -4.92 116.55 115.81 3bk7 n ASP 134 Ca 0.00 -3.50 -0.41 0.00 -0.71 0.00 0.00 54.79 50.17 3bk7 n ASP 134 Cb 0.00 -0.48 -0.00 0.00 -1.35 0.00 0.00 41.12 39.28 3bk7 n ASP 134 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 3bk7 s ASN 135 N -3.04 6.33 -0.01 -1.12 3.84 -1.20 -4.94 114.94 114.80 3bk7 s ASN 135 Ca 0.35 3.05 0.02 0.00 0.21 0.00 0.00 52.86 56.49 3bk7 s ASN 135 Cb 0.33 -2.66 0.03 0.00 -0.55 0.00 0.00 41.25 38.39 3bk7 s ASN 135 CO -0.02 -0.90 0.80 -0.90 -2.79 0.00 0.00 177.10 173.29 3bk7 n ASP 136 N 0.74 0.41 -4.33 -4.21 5.68 -1.26 -4.32 116.55 109.26 3bk7 n ASP 136 Ca 0.02 -1.66 -0.18 0.00 -0.50 0.00 0.00 54.79 52.47 3bk7 n ASP 136 Cb 0.39 -0.11 -0.10 0.00 -1.14 0.00 0.00 41.12 40.15 3bk7 n ASP 136 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3bk7 s SER 137 N -0.73 2.31 0.08 -1.12 1.04 -1.26 -5.04 113.70 108.98 3bk7 s SER 137 Ca 0.03 -1.07 0.05 0.00 0.48 0.00 0.00 55.95 55.44 3bk7 s SER 137 Cb 0.02 -0.09 -0.23 0.00 0.10 0.00 0.00 66.02 65.82 3bk7 s SER 137 CO 0.00 -0.28 1.13 -0.50 0.98 0.00 0.00 173.24 174.58 3bk7 h TRP 138 N 2.56 0.12 -0.66 5.02 4.06 -1.98 -3.29 115.95 121.78 3bk7 h TRP 138 Ca -0.38 -0.09 0.02 0.00 2.06 0.00 0.00 58.89 60.51 3bk7 h TRP 138 Cb 1.22 -0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.33 3bk7 h TRP 138 CO 0.68 1.08 0.42 -0.44 -3.56 0.00 0.00 178.44 176.62 3bk7 h ASP 139 N 0.02 0.69 0.26 -3.49 3.32 -1.96 0.32 116.42 115.58 3bk7 h ASP 139 Ca -0.09 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 3bk7 h ASP 139 Cb 1.86 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 41.25 3bk7 h ASP 139 CO 0.14 0.48 -0.21 0.78 -1.72 0.00 0.00 179.24 178.71 3bk7 h ASN 140 N 0.83 0.00 0.08 6.45 -0.26 -2.00 -0.97 115.58 119.70 3bk7 h ASN 140 Ca 0.26 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 56.00 3bk7 h ASN 140 Cb -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 3bk7 h ASN 140 CO -0.10 0.21 -0.04 0.58 -1.06 0.00 0.00 177.43 177.03 3bk7 h VAL 141 N 0.00 1.19 -0.62 2.81 2.07 -0.94 -2.14 116.25 118.62 3bk7 h VAL 141 Ca -0.00 -1.13 0.11 0.00 0.82 0.00 0.00 66.70 66.50 3bk7 h VAL 141 Cb 0.40 1.89 -0.08 0.00 -1.52 0.00 0.00 31.29 31.98 3bk7 h VAL 141 CO 0.03 0.27 0.18 0.40 0.02 0.00 0.00 177.57 178.47 3bk7 h ILE 142 N -0.64 0.69 -0.40 4.57 2.04 -0.17 -1.03 117.51 122.57 3bk7 h ILE 142 Ca -0.01 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.74 3bk7 h ILE 142 Cb 0.52 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 3bk7 h ILE 142 CO 0.02 0.06 0.26 0.03 0.00 0.00 0.00 178.15 178.52 3bk7 h ARG 143 N 0.33 0.54 -0.37 2.37 3.08 -1.19 -2.38 114.38 116.75 3bk7 h ARG 143 Ca 0.32 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.35 3bk7 h ARG 143 Cb 0.45 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3bk7 h ARG 143 CO -0.37 0.36 0.25 0.00 -1.07 0.00 0.00 179.97 179.14 3bk7 h ALA 144 N 1.14 1.77 -0.57 0.04 0.00 -0.54 -1.96 119.26 119.15 3bk7 h ALA 144 Ca 0.15 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 3bk7 h ALA 144 Cb -0.05 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.52 3bk7 h ALA 144 CO -0.03 0.20 0.18 1.19 0.00 0.00 0.00 179.25 180.78 3bk7 n PHE 145 N -4.48 1.94 -1.99 0.00 3.01 -0.52 -4.95 117.46 110.47 3bk7 n PHE 145 Ca 0.03 -0.91 -0.42 0.00 1.01 0.00 0.00 57.45 57.15 3bk7 n PHE 145 Cb 0.09 -0.56 -0.03 0.00 -0.01 0.00 0.00 39.48 38.97 3bk7 n PHE 145 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 3bk7 s ARG 146 N -2.49 4.24 0.00 -1.08 3.52 -0.74 -1.68 118.95 120.72 3bk7 s ARG 146 Ca 0.44 2.29 0.00 0.00 -0.13 0.00 0.00 55.73 58.34 3bk7 s ARG 146 Cb 0.35 -3.19 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 3bk7 s ARG 146 CO 0.11 -0.57 0.00 0.41 -0.81 0.00 0.00 175.30 174.44 3bk7 n GLY 147 N 3.70 3.16 3.86 8.12 0.00 -1.26 -5.04 105.19 117.73 3bk7 n GLY 147 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 3bk7 n GLY 147 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3bk7 s ASN 148 N 0.15 6.64 0.00 1.61 2.47 -0.68 -4.93 114.94 120.20 3bk7 s ASN 148 Ca 0.00 1.34 0.18 0.00 0.42 0.00 0.00 52.86 54.80 3bk7 s ASN 148 Cb 0.00 -2.41 0.90 0.00 -1.45 0.00 0.00 41.25 38.29 3bk7 s ASN 148 CO 0.00 -0.42 1.53 -1.84 -3.72 0.00 0.00 177.10 172.65 3bk7 n GLU 149 N -1.15 0.26 0.11 0.43 0.28 -1.26 -2.00 120.64 117.30 3bk7 n GLU 149 Ca 0.04 0.12 0.12 0.00 -0.16 0.00 0.00 57.16 57.28 3bk7 n GLU 149 Cb 0.54 -1.50 0.13 0.00 1.43 0.00 0.00 31.44 32.04 3bk7 n GLU 149 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 3bk7 h LEU 150 N 0.00 0.00 -0.84 -1.84 3.38 -1.92 -3.34 115.31 110.75 3bk7 h LEU 150 Ca 0.00 -0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.04 3bk7 h LEU 150 Cb 0.16 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.82 3bk7 h LEU 150 CO 0.00 0.04 0.41 -0.61 0.09 0.00 0.00 178.44 178.37 3bk7 h GLN 151 N 0.00 0.55 -0.22 1.13 4.15 -1.45 -0.56 115.11 118.71 3bk7 h GLN 151 Ca 0.00 -0.03 -0.20 0.00 0.77 0.00 0.00 58.65 59.18 3bk7 h GLN 151 Cb 0.88 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3bk7 h GLN 151 CO 0.00 0.36 -0.66 -0.97 -1.93 0.00 0.00 178.83 175.64 3bk7 h ASN 152 N 0.56 0.95 -0.42 -0.69 -1.24 -1.78 -2.41 115.58 110.54 3bk7 h ASN 152 Ca 0.47 -0.56 0.07 0.00 0.71 0.00 0.00 56.30 56.99 3bk7 h ASN 152 Cb 0.70 -0.28 -0.06 0.00 0.73 0.00 0.00 38.32 39.41 3bk7 h ASN 152 CO -0.39 1.36 0.05 0.22 -1.29 0.00 0.00 177.43 177.38 3bk7 h TYR 153 N 0.61 0.06 -0.00 0.67 3.20 -1.39 -1.34 116.97 118.77 3bk7 h TYR 153 Ca -0.02 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.79 3bk7 h TYR 153 Cb 1.27 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.56 3bk7 h TYR 153 CO 0.08 -0.04 -0.44 0.74 -1.64 0.00 0.00 178.16 176.86 3bk7 h PHE 154 N 0.17 0.01 -0.34 -3.82 0.04 -1.13 0.31 116.94 112.17 3bk7 h PHE 154 Ca 0.21 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.94 3bk7 h PHE 154 Cb 0.28 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.41 3bk7 h PHE 154 CO -0.24 0.45 0.07 0.93 -0.60 0.00 0.00 178.31 178.91 3bk7 h GLU 155 N 0.01 0.56 -0.49 1.51 5.08 -0.85 -1.34 114.58 119.05 3bk7 h GLU 155 Ca -0.00 -0.14 -0.12 0.00 -1.00 0.00 0.00 59.36 58.09 3bk7 h GLU 155 Cb 0.78 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 3bk7 h GLU 155 CO 0.06 0.63 -0.17 0.00 -1.00 0.00 0.00 179.01 178.53 3bk7 h ARG 156 N 0.40 0.97 -0.63 2.33 3.08 -0.95 -1.88 114.38 117.71 3bk7 h ARG 156 Ca 0.10 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.77 3bk7 h ARG 156 Cb 0.33 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 3bk7 h ARG 156 CO 0.00 1.06 0.41 1.25 -1.07 0.00 0.00 179.97 181.62 3bk7 h LEU 157 N 0.85 0.72 0.13 3.04 5.85 -0.15 -2.17 115.31 123.59 3bk7 h LEU 157 Ca 0.12 -0.02 -0.29 0.00 0.84 0.00 0.00 57.88 58.53 3bk7 h LEU 157 Cb 0.73 -0.18 0.02 0.00 0.37 0.00 0.00 40.66 41.60 3bk7 h LEU 157 CO 0.06 0.53 -1.28 0.07 -0.34 0.00 0.00 178.44 177.48 3bk7 h LYS 158 N 0.85 0.39 0.00 1.25 2.10 -1.07 -3.25 116.57 116.85 3bk7 h LYS 158 Ca 0.23 -0.63 -0.01 0.00 -2.00 0.00 0.00 60.65 58.24 3bk7 h LYS 158 Cb -0.09 0.23 -0.00 0.00 -0.90 0.00 0.00 32.23 31.47 3bk7 h LYS 158 CO -0.05 1.29 -0.07 -0.91 -2.00 0.00 0.00 179.45 177.71 3bk7 h ASN 159 N 0.13 0.00 0.00 7.07 -0.26 -0.97 -3.46 115.58 118.09 3bk7 h ASN 159 Ca -0.17 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.57 3bk7 h ASN 159 Cb 1.99 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.25 3bk7 h ASN 159 CO 0.22 0.07 0.00 0.61 -1.06 0.00 0.00 177.43 177.27 3bk7 n GLY 160 N -1.14 0.84 0.15 2.83 0.00 -0.86 -4.99 105.19 102.02 3bk7 n GLY 160 Ca -0.03 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 3bk7 n GLY 160 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3bk7 h GLU 161 N 1.37 -0.27 -6.22 1.61 5.08 -1.73 -3.44 114.58 110.97 3bk7 h GLU 161 Ca 0.00 0.02 -0.68 0.00 -1.00 0.00 0.00 59.36 57.70 3bk7 h GLU 161 Cb 0.00 0.06 -0.19 0.00 0.50 0.00 0.00 28.75 29.12 3bk7 h GLU 161 CO 0.00 0.12 -0.71 0.96 -1.00 0.00 0.00 179.01 178.39 3bk7 s ILE 162 N -3.92 3.60 -0.30 3.13 -5.25 -1.25 -5.07 121.20 112.15 3bk7 s ILE 162 Ca -0.13 -0.62 -0.02 0.00 -0.99 0.00 0.00 60.65 58.89 3bk7 s ILE 162 Cb 0.01 -2.50 0.12 0.00 2.95 0.00 0.00 42.46 43.04 3bk7 s ILE 162 CO 0.51 0.52 0.23 0.00 -1.79 0.00 0.00 174.94 174.41 3bk7 s ARG 163 N -1.03 0.30 0.57 0.37 1.70 -1.26 -4.62 118.95 114.98 3bk7 s ARG 163 Ca 0.14 -0.39 -0.18 0.00 -0.47 0.00 0.00 55.73 54.83 3bk7 s ARG 163 Cb -0.11 -0.89 -0.08 0.00 -0.57 0.00 0.00 34.95 33.31 3bk7 s ARG 163 CO 0.04 -1.05 0.63 -2.30 -1.08 0.00 0.00 175.30 171.54 3bk7 n PRO 164 N 5.16 0.60 -3.95 3.89 -0.02 -1.26 -4.84 135.00 134.57 3bk7 n PRO 164 Ca -0.02 0.23 -0.35 0.00 -2.02 0.00 0.00 63.50 61.34 3bk7 n PRO 164 Cb 0.44 -1.81 -0.06 0.00 -0.02 0.00 0.00 33.50 32.06 3bk7 n PRO 164 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3bk7 s VAL 165 N -1.67 5.29 -0.07 -1.45 1.01 -0.26 -5.00 120.40 118.25 3bk7 s VAL 165 Ca 0.70 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.64 3bk7 s VAL 165 Cb -0.44 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.58 3bk7 s VAL 165 CO 0.53 0.47 -0.06 -0.69 0.00 0.00 0.00 175.10 175.34 3bk7 s VAL 166 N -1.16 0.75 -0.49 2.92 1.01 -1.26 -0.57 120.40 121.61 3bk7 s VAL 166 Ca 0.21 -0.20 -0.20 0.00 0.00 0.00 0.00 61.98 61.79 3bk7 s VAL 166 Cb -0.12 -0.77 0.04 0.00 0.00 0.00 0.00 36.38 35.53 3bk7 s VAL 166 CO 0.11 0.29 0.68 -0.75 0.00 0.00 0.00 175.10 175.43 3bk7 s LYS 167 N 1.22 3.21 0.54 2.72 2.36 -0.05 -4.99 119.74 124.76 3bk7 s LYS 167 Ca -0.05 -0.60 -0.21 0.00 -2.55 0.00 0.00 55.97 52.55 3bk7 s LYS 167 Cb -0.14 -4.04 -0.05 0.00 -1.05 0.00 0.00 37.83 32.55 3bk7 s LYS 167 CO -0.02 -1.19 1.27 -1.25 1.55 0.00 0.00 175.35 175.71 3bk7 s PRO 168 N 2.91 3.20 0.04 4.03 0.04 -1.26 -1.77 135.00 142.19 3bk7 s PRO 168 Ca 0.20 2.01 -0.25 0.00 0.04 0.00 0.00 61.00 63.00 3bk7 s PRO 168 Cb -0.16 -2.18 -0.14 0.00 0.04 0.00 0.00 34.50 32.06 3bk7 s PRO 168 CO 0.16 -1.07 1.32 0.37 0.04 0.00 0.00 177.00 177.81 3bk7 h GLN 169 N 1.38 -0.87 -5.75 4.56 4.15 -1.96 -3.38 115.11 113.24 3bk7 h GLN 169 Ca -0.50 0.06 -0.34 0.00 0.77 0.00 0.00 58.65 58.63 3bk7 h GLN 169 Cb 1.29 0.20 -0.06 0.00 0.21 0.00 0.00 27.48 29.12 3bk7 h GLN 169 CO 0.57 -0.58 0.88 0.71 -1.93 0.00 0.00 178.83 178.48 3bk7 s TYR 170 N -4.88 1.93 -0.43 3.99 2.02 -1.26 -4.76 117.35 113.97 3bk7 s TYR 170 Ca -0.13 0.39 0.23 0.00 -0.37 0.00 0.00 57.07 57.18 3bk7 s TYR 170 Cb 0.01 -4.14 0.34 0.00 -0.40 0.00 0.00 41.96 37.77 3bk7 s TYR 170 CO 0.40 -1.73 1.61 -0.39 -1.57 0.00 0.00 175.55 173.87 3bk7 h VAL 171 N 7.09 0.03 0.00 0.71 -1.51 -1.97 -3.28 116.25 117.31 3bk7 h VAL 171 Ca 0.13 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.56 3bk7 h VAL 171 Cb 1.00 2.01 0.00 0.00 -2.13 0.00 0.00 31.29 32.17 3bk7 h VAL 171 CO 1.24 0.01 0.00 0.47 -1.23 0.00 0.00 177.57 178.07 3bk7 n ASP 172 N -3.10 0.48 0.00 4.19 9.92 -1.26 -2.22 116.55 124.56 3bk7 n ASP 172 Ca 0.04 -1.31 0.00 0.00 -0.53 0.00 0.00 54.79 52.99 3bk7 n ASP 172 Cb 0.53 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 3bk7 n ASP 172 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3bk7 n LEU 173 N -0.01 0.00 -0.21 0.64 4.77 -1.24 -4.72 117.00 116.24 3bk7 n LEU 173 Ca 0.00 -0.04 -0.01 0.00 -0.03 0.00 0.00 56.01 55.93 3bk7 n LEU 173 Cb 0.12 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.28 3bk7 n LEU 173 CO 0.00 0.00 0.75 0.25 -1.33 0.00 0.00 177.39 177.06 3bk7 h LEU 174 N 0.00 -0.54 -0.87 2.23 6.46 -1.66 -1.44 115.31 119.49 3bk7 h LEU 174 Ca 0.00 0.18 0.16 0.00 -0.12 0.00 0.00 57.88 58.10 3bk7 h LEU 174 Cb 0.00 0.37 -0.10 0.00 -0.73 0.00 0.00 40.66 40.20 3bk7 h LEU 174 CO 0.00 -0.19 0.45 -0.65 -0.62 0.00 0.00 178.44 177.43 3bk7 h PRO 175 N 0.01 0.59 -1.81 5.25 0.11 -1.85 -2.23 132.00 132.07 3bk7 h PRO 175 Ca 0.30 -0.04 -0.52 0.00 0.11 0.00 0.00 66.00 65.85 3bk7 h PRO 175 Cb 0.46 -0.13 -0.19 0.00 0.11 0.00 0.00 31.00 31.25 3bk7 h PRO 175 CO -0.62 0.39 0.55 0.36 -0.21 0.00 0.00 178.00 178.47 3bk7 n LYS 176 N -4.89 2.36 0.00 1.05 2.85 -0.54 -3.75 118.16 115.24 3bk7 n LYS 176 Ca 0.19 -2.47 0.00 0.00 -1.05 0.00 0.00 58.31 54.98 3bk7 n LYS 176 Cb 0.48 -2.07 0.00 0.00 -0.65 0.00 0.00 35.03 32.79 3bk7 n LYS 176 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3bk7 n ALA 177 N 0.37 0.31 -2.64 0.58 0.00 -0.86 -5.06 120.51 113.21 3bk7 n ALA 177 Ca 0.47 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.62 3bk7 n ALA 177 Cb 0.51 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.88 3bk7 n ALA 177 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3bk7 s VAL 178 N -0.84 1.15 0.08 0.00 1.01 -1.10 -5.13 120.40 115.57 3bk7 s VAL 178 Ca 0.00 -2.00 -0.08 0.00 0.00 0.00 0.00 61.98 59.90 3bk7 s VAL 178 Cb 0.00 -2.41 -0.00 0.00 0.00 0.00 0.00 36.38 33.96 3bk7 s VAL 178 CO 0.00 0.00 0.17 -0.54 0.00 0.00 0.00 175.10 174.73 3bk7 s LYS 179 N -3.81 0.80 0.00 2.72 -0.14 -1.26 -4.87 119.74 113.18 3bk7 s LYS 179 Ca 0.18 -0.94 0.00 0.00 -1.36 0.00 0.00 55.97 53.85 3bk7 s LYS 179 Cb 0.04 0.32 0.00 0.00 -1.68 0.00 0.00 37.83 36.51 3bk7 s LYS 179 CO 0.10 -0.25 0.00 0.41 -0.76 0.00 0.00 175.35 174.85 3bk7 n GLY 180 N 0.05 -1.37 3.97 -3.33 0.00 -1.26 -4.89 105.19 98.36 3bk7 n GLY 180 Ca -0.15 -2.12 -0.23 0.00 0.00 0.00 0.00 46.02 43.52 3bk7 n GLY 180 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3bk7 n LYS 181 N -0.01 0.02 0.06 1.61 5.02 -1.26 -2.93 118.16 120.67 3bk7 n LYS 181 Ca 0.00 -2.86 -0.08 0.00 -2.02 0.00 0.00 58.31 53.34 3bk7 n LYS 181 Cb 0.00 -0.59 0.05 0.00 -0.02 0.00 0.00 35.03 34.47 3bk7 n LYS 181 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3bk7 h VAL 182 N -0.47 1.39 -0.70 -0.18 2.07 -0.82 -3.25 116.25 114.30 3bk7 h VAL 182 Ca -0.33 -2.13 0.04 0.00 0.82 0.00 0.00 66.70 65.11 3bk7 h VAL 182 Cb 1.25 2.10 -0.05 0.00 -1.52 0.00 0.00 31.29 33.08 3bk7 h VAL 182 CO 0.37 0.63 0.42 0.03 0.02 0.00 0.00 177.57 179.04 3bk7 h ARG 183 N 0.23 0.77 0.88 1.57 3.08 -1.38 -2.95 114.38 116.58 3bk7 h ARG 183 Ca -0.02 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 3bk7 h ARG 183 Cb 1.25 -0.17 0.01 0.00 0.08 0.00 0.00 29.97 31.14 3bk7 h ARG 183 CO 0.11 0.51 -0.42 1.49 -1.07 0.00 0.00 179.97 180.59 3bk7 h GLU 184 N 0.80 -1.14 -0.63 0.04 4.81 -1.85 -2.78 114.58 113.83 3bk7 h GLU 184 Ca 0.29 0.08 0.11 0.00 -0.13 0.00 0.00 59.36 59.71 3bk7 h GLU 184 Cb 0.10 0.26 -0.08 0.00 0.63 0.00 0.00 28.75 29.66 3bk7 h GLU 184 CO -0.14 -0.75 0.20 1.25 -0.73 0.00 0.00 179.01 178.83 3bk7 h LEU 185 N -1.27 0.15 -1.81 1.64 6.46 -1.62 -0.91 115.31 117.95 3bk7 h LEU 185 Ca -0.12 0.10 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 3bk7 h LEU 185 Cb 0.91 0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.94 3bk7 h LEU 185 CO 0.20 0.08 -0.10 -0.07 -0.62 0.00 0.00 178.44 177.93 3bk7 h LEU 186 N 0.35 0.00 0.31 2.25 3.38 -1.57 -1.93 115.31 118.11 3bk7 h LEU 186 Ca 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 3bk7 h LEU 186 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3bk7 h LEU 186 CO -0.36 0.10 -0.15 0.11 0.09 0.00 0.00 178.44 178.23 3bk7 h LYS 187 N 0.00 -0.41 0.18 1.13 1.79 -0.88 -2.76 116.57 115.62 3bk7 h LYS 187 Ca -0.00 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 3bk7 h LYS 187 Cb 0.41 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.12 3bk7 h LYS 187 CO 0.01 -0.12 -0.43 -0.22 -1.08 0.00 0.00 179.45 177.61 3bk7 h LYS 188 N -1.00 -0.65 0.00 3.15 3.64 -1.27 -1.82 116.57 118.62 3bk7 h LYS 188 Ca -0.04 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3bk7 h LYS 188 Cb 0.48 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 3bk7 h LYS 188 CO 0.07 -0.43 0.06 0.28 -2.27 0.00 0.00 179.45 177.16 3bk7 h VAL 189 N -0.67 0.00 -3.80 2.00 2.07 -1.50 -3.43 116.25 110.91 3bk7 h VAL 189 Ca -0.02 0.00 -0.53 0.00 0.82 0.00 0.00 66.70 66.97 3bk7 h VAL 189 Cb 0.65 0.63 0.09 0.00 -1.52 0.00 0.00 31.29 31.13 3bk7 h VAL 189 CO -0.19 0.00 0.76 -0.62 0.02 0.00 0.00 177.57 177.54 3bk7 s ASP 190 N -4.32 6.46 0.00 0.57 -1.08 -0.69 -3.92 116.67 113.70 3bk7 s ASP 190 Ca -0.03 2.93 0.00 0.00 -0.52 0.00 0.00 52.55 54.93 3bk7 s ASP 190 Cb 0.08 -2.66 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 3bk7 s ASP 190 CO 0.26 -0.79 0.03 -0.62 0.52 0.00 0.00 175.17 174.56 3bk7 n GLU 191 N 0.91 0.00 0.00 4.34 1.02 0.11 -4.84 120.64 122.18 3bk7 n GLU 191 Ca 0.02 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 3bk7 n GLU 191 Cb 0.40 -0.27 0.00 0.00 -0.02 0.00 0.00 31.44 31.55 3bk7 n GLU 191 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3bk7 n VAL 192 N 0.00 0.00 -2.79 2.62 0.31 -1.15 -4.54 118.33 112.78 3bk7 n VAL 192 Ca 0.00 -0.42 -0.06 0.00 -0.01 0.00 0.00 64.34 63.85 3bk7 n VAL 192 Cb 0.28 1.10 0.01 0.00 -0.91 0.00 0.00 33.84 34.31 3bk7 n VAL 192 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3bk7 n GLY 193 N 0.31 -1.24 1.83 2.92 0.00 -1.26 -4.99 105.19 102.75 3bk7 n GLY 193 Ca 0.00 0.97 -0.03 0.00 0.00 0.00 0.00 46.02 46.96 3bk7 n GLY 193 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3bk7 n LYS 194 N -0.67 0.66 -0.29 1.61 5.02 -1.26 -4.94 118.16 118.28 3bk7 n LYS 194 Ca 0.08 -1.45 0.28 0.00 -2.02 0.00 0.00 58.31 55.19 3bk7 n LYS 194 Cb 0.44 0.20 0.62 0.00 -0.02 0.00 0.00 35.03 36.27 3bk7 n LYS 194 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 3bk7 h PHE 195 N 0.74 0.33 0.05 2.13 3.57 -1.94 -2.46 116.94 119.36 3bk7 h PHE 195 Ca -0.44 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 3bk7 h PHE 195 Cb 1.42 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 40.06 3bk7 h PHE 195 CO -0.03 0.03 -0.03 0.93 -2.23 0.00 0.00 178.31 176.99 3bk7 h GLU 196 N 0.20 -0.07 0.10 1.11 5.08 -1.98 -2.89 114.58 116.13 3bk7 h GLU 196 Ca 0.55 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.93 3bk7 h GLU 196 Cb 1.77 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.99 3bk7 h GLU 196 CO -0.15 0.42 -0.49 1.49 -1.00 0.00 0.00 179.01 179.29 3bk7 h GLU 197 N -0.96 -0.68 0.21 2.33 4.81 -1.88 -0.57 114.58 117.84 3bk7 h GLU 197 Ca -0.01 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3bk7 h GLU 197 Cb 0.52 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 3bk7 h GLU 197 CO 0.01 -0.46 -0.39 0.28 -0.73 0.00 0.00 179.01 177.73 3bk7 h VAL 198 N -0.71 0.00 -0.37 0.32 2.07 -1.63 0.22 116.25 116.15 3bk7 h VAL 198 Ca 0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.64 3bk7 h VAL 198 Cb 0.73 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3bk7 h VAL 198 CO -0.29 0.00 0.39 0.58 0.02 0.00 0.00 177.57 178.27 3bk7 h VAL 199 N -0.65 0.41 0.00 2.57 2.07 -1.44 -1.58 116.25 117.63 3bk7 h VAL 199 Ca -0.02 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 3bk7 h VAL 199 Cb 0.61 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 3bk7 h VAL 199 CO -0.14 0.00 -0.35 0.50 0.02 0.00 0.00 177.57 177.60 3bk7 h LYS 200 N 0.00 0.00 -0.42 1.57 3.64 -0.47 0.88 116.57 121.77 3bk7 h LYS 200 Ca 0.18 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.61 3bk7 h LYS 200 Cb 0.95 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 3bk7 h LYS 200 CO -0.00 0.65 0.28 1.05 -2.27 0.00 0.00 179.45 179.16 3bk7 h GLU 201 N -1.00 0.33 -0.39 1.90 4.11 -0.67 0.46 114.58 119.33 3bk7 h GLU 201 Ca -0.08 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.33 3bk7 h GLU 201 Cb 0.78 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3bk7 h GLU 201 CO -0.05 0.22 0.00 1.28 0.07 0.00 0.00 179.01 180.53 3bk7 n LEU 202 N -4.48 2.15 -3.95 3.06 4.77 -0.62 -4.94 117.00 112.98 3bk7 n LEU 202 Ca 0.05 -1.06 -0.39 0.00 -0.03 0.00 0.00 56.01 54.58 3bk7 n LEU 202 Cb 0.24 -0.26 0.02 0.00 -2.33 0.00 0.00 43.42 41.08 3bk7 n LEU 202 CO 0.35 0.53 -0.16 -0.62 -1.33 0.00 0.00 177.39 176.15 3bk7 n GLU 203 N 0.67 -0.84 -0.00 3.23 1.02 0.16 -4.89 120.64 119.99 3bk7 n GLU 203 Ca 0.14 0.23 0.10 0.00 -0.02 0.00 0.00 57.16 57.60 3bk7 n GLU 203 Cb 0.34 -3.28 0.08 0.00 -0.02 0.00 0.00 31.44 28.56 3bk7 n GLU 203 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3bk7 n LEU 204 N -4.69 2.64 -0.34 -4.62 4.77 0.30 -4.71 117.00 110.36 3bk7 n LEU 204 Ca -0.14 -1.01 0.12 0.00 -0.03 0.00 0.00 56.01 54.95 3bk7 n LEU 204 Cb 0.59 -0.00 0.25 0.00 -2.33 0.00 0.00 43.42 41.92 3bk7 n LEU 204 CO 0.73 0.46 0.74 -0.62 -1.33 0.00 0.00 177.39 177.37 3bk7 n GLU 205 N 1.10 -0.08 0.05 3.23 4.71 -1.23 -2.46 120.64 125.95 3bk7 n GLU 205 Ca 0.11 1.47 -0.02 0.00 -0.01 0.00 0.00 57.16 58.72 3bk7 n GLU 205 Cb 0.49 -2.30 -0.01 0.00 -1.01 0.00 0.00 31.44 28.61 3bk7 n GLU 205 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 3bk7 h ASN 206 N 0.00 -0.11 -1.67 1.62 2.35 -1.94 -3.30 115.58 112.52 3bk7 h ASN 206 Ca 0.56 0.00 0.52 0.00 -0.55 0.00 0.00 56.30 56.83 3bk7 h ASN 206 Cb 1.08 0.03 -0.10 0.00 0.05 0.00 0.00 38.32 39.38 3bk7 h ASN 206 CO -0.94 -0.05 1.16 1.33 -1.65 0.00 0.00 177.43 177.28 3bk7 n VAL 207 N -2.48 -0.10 -0.23 2.81 0.24 -1.07 -3.26 118.33 114.24 3bk7 n VAL 207 Ca -0.02 1.57 0.05 0.00 -2.04 0.00 0.00 64.34 63.90 3bk7 n VAL 207 Cb 0.05 -2.59 0.10 0.00 -1.47 0.00 0.00 33.84 29.94 3bk7 n VAL 207 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3bk7 n LEU 208 N -4.18 -0.21 -0.51 1.34 4.77 -1.03 0.37 117.00 117.55 3bk7 n LEU 208 Ca 0.41 1.10 0.09 0.00 -0.03 0.00 0.00 56.01 57.58 3bk7 n LEU 208 Cb 1.77 -0.34 0.34 0.00 -2.33 0.00 0.00 43.42 42.86 3bk7 n LEU 208 CO 0.32 -1.06 0.75 0.47 -1.33 0.00 0.00 177.39 176.54 3bk7 n ASP 209 N -5.01 1.51 -4.91 -1.43 10.43 -1.20 -1.04 116.55 114.90 3bk7 n ASP 209 Ca 0.11 -1.74 -0.21 0.00 2.57 0.00 0.00 54.79 55.52 3bk7 n ASP 209 Cb 0.35 -0.12 0.06 0.00 1.84 0.00 0.00 41.12 43.24 3bk7 n ASP 209 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 3bk7 s ARG 210 N -1.77 2.32 0.20 -1.24 3.52 0.16 -4.87 118.95 117.27 3bk7 s ARG 210 Ca 0.29 -1.11 0.06 0.00 -0.13 0.00 0.00 55.73 54.85 3bk7 s ARG 210 Cb 0.16 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.98 3bk7 s ARG 210 CO 0.23 -0.86 0.12 -1.21 -0.81 0.00 0.00 175.30 172.77 3bk7 s GLU 211 N -4.77 2.76 0.22 5.12 2.02 -1.26 -1.79 118.70 120.99 3bk7 s GLU 211 Ca 0.60 -1.02 -0.16 0.00 0.02 0.00 0.00 54.97 54.42 3bk7 s GLU 211 Cb -0.08 -2.52 0.24 0.00 0.10 0.00 0.00 34.13 31.87 3bk7 s GLU 211 CO 0.39 0.44 1.59 -0.07 0.02 0.00 0.00 175.26 177.63 3bk7 h LEU 212 N 2.13 -0.97 -1.02 1.80 3.38 -1.85 0.10 115.31 118.89 3bk7 h LEU 212 Ca -0.47 0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3bk7 h LEU 212 Cb 1.22 0.55 0.00 0.00 0.09 0.00 0.00 40.66 42.52 3bk7 h LEU 212 CO 0.61 -0.28 0.00 1.12 0.09 0.00 0.00 178.44 179.98 3bk7 h HIS 213 N -0.06 0.00 -0.34 1.13 2.07 -1.89 -2.69 115.15 113.37 3bk7 h HIS 213 Ca 0.32 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.84 3bk7 h HIS 213 Cb 0.56 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.54 3bk7 h HIS 213 CO -0.65 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 175.25 3bk7 n GLN 214 N -2.72 1.88 -3.34 5.12 6.02 0.34 -4.91 117.38 119.76 3bk7 n GLN 214 Ca 0.02 -1.35 -0.26 0.00 -0.01 0.00 0.00 57.00 55.40 3bk7 n GLN 214 Cb 0.30 -1.33 -0.02 0.00 1.02 0.00 0.00 30.24 30.21 3bk7 n GLN 214 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3bk7 s LEU 215 N -1.15 4.02 0.00 1.08 1.43 -1.02 -4.89 118.68 118.16 3bk7 s LEU 215 Ca 0.28 0.56 0.03 0.00 -1.03 0.00 0.00 54.13 53.97 3bk7 s LEU 215 Cb 0.15 -3.41 0.06 0.00 0.03 0.00 0.00 46.19 43.01 3bk7 s LEU 215 CO 0.20 -0.26 0.44 -1.54 0.23 0.00 0.00 176.35 175.41 3bk7 n SER 216 N -1.46 0.94 0.19 2.29 3.41 -1.26 -4.84 113.62 112.89 3bk7 n SER 216 Ca -0.03 -1.71 -0.14 0.00 -0.26 0.00 0.00 58.87 56.72 3bk7 n SER 216 Cb 0.55 -0.25 -0.08 0.00 -0.26 0.00 0.00 64.21 64.17 3bk7 n SER 216 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3bk7 h GLY 217 N -0.06 -0.49 0.34 5.00 0.00 -1.98 0.93 103.07 106.81 3bk7 h GLY 217 Ca -0.15 0.18 0.08 0.00 0.00 0.00 0.00 47.33 47.45 3bk7 h GLY 217 CO 0.19 -0.18 0.06 -1.33 0.00 0.00 0.00 176.54 175.29 3bk7 h GLY 218 N -0.68 0.54 0.89 4.60 0.00 -1.87 0.16 103.07 106.70 3bk7 h GLY 218 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3bk7 h GLY 218 CO 0.08 -0.08 -0.11 0.83 0.00 0.00 0.00 176.54 177.25 3bk7 h GLU 219 N 0.19 -0.31 -0.46 4.80 5.08 -1.86 -1.10 114.58 120.92 3bk7 h GLU 219 Ca 0.23 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.71 3bk7 h GLU 219 Cb 0.32 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.56 3bk7 h GLU 219 CO -0.33 -0.12 -0.08 1.25 -1.00 0.00 0.00 179.01 178.73 3bk7 h LEU 220 N -0.43 -0.37 0.06 1.33 5.85 -0.43 0.13 115.31 121.45 3bk7 h LEU 220 Ca -0.03 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3bk7 h LEU 220 Cb 0.33 0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 3bk7 h LEU 220 CO 0.05 -0.13 -0.38 -0.61 -0.34 0.00 0.00 178.44 177.03 3bk7 h GLN 221 N 0.03 -0.55 -0.86 1.25 5.75 -0.55 -2.08 115.11 118.10 3bk7 h GLN 221 Ca 0.23 0.04 0.06 0.00 -0.15 0.00 0.00 58.65 58.82 3bk7 h GLN 221 Cb 0.35 0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.97 3bk7 h GLN 221 CO -0.45 -0.37 0.56 0.00 -2.65 0.00 0.00 178.83 175.92 3bk7 h ARG 222 N -0.58 0.95 -0.08 1.69 3.08 0.04 -0.01 114.38 119.48 3bk7 h ARG 222 Ca 0.04 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 3bk7 h ARG 222 Cb 0.63 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3bk7 h ARG 222 CO -0.26 0.63 -0.15 0.28 -1.07 0.00 0.00 179.97 179.40 3bk7 h VAL 223 N 0.98 1.15 -0.10 2.04 2.07 -0.34 -1.14 116.25 120.92 3bk7 h VAL 223 Ca 0.36 -0.68 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 3bk7 h VAL 223 Cb 0.16 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 3bk7 h VAL 223 CO -0.13 0.20 -0.20 0.00 0.02 0.00 0.00 177.57 177.47 3bk7 h ALA 224 N 1.74 0.16 -0.72 1.67 0.00 -0.36 -1.60 119.26 120.15 3bk7 h ALA 224 Ca 0.02 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.64 3bk7 h ALA 224 Cb 0.33 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 3bk7 h ALA 224 CO 0.02 0.10 0.40 0.82 0.00 0.00 0.00 179.25 180.59 3bk7 h ILE 225 N -0.14 0.94 0.65 0.00 1.08 -1.04 -2.40 117.51 116.59 3bk7 h ILE 225 Ca 0.00 -0.24 -0.02 0.00 -0.39 0.00 0.00 64.86 64.21 3bk7 h ILE 225 Cb 0.78 0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 34.69 3bk7 h ILE 225 CO 0.04 0.13 -0.46 0.00 -0.69 0.00 0.00 178.15 177.18 3bk7 h ALA 226 N 1.39 -1.12 -0.36 1.87 0.00 -1.10 -2.00 119.26 117.93 3bk7 h ALA 226 Ca 0.33 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 55.14 3bk7 h ALA 226 Cb 0.25 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3bk7 h ALA 226 CO -0.21 -1.15 0.33 0.00 0.00 0.00 0.00 179.25 178.22 3bk7 h ALA 227 N -0.88 2.13 -0.13 0.00 0.00 -1.08 -0.73 119.26 118.57 3bk7 h ALA 227 Ca -0.08 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.59 3bk7 h ALA 227 Cb 0.87 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.70 3bk7 h ALA 227 CO 0.04 -0.52 -0.82 0.00 0.00 0.00 0.00 179.25 177.96 3bk7 h ALA 228 N 1.67 0.27 0.00 0.00 0.00 -0.89 -3.08 119.26 117.24 3bk7 h ALA 228 Ca 0.17 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 3bk7 h ALA 228 Cb 0.84 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 3bk7 h ALA 228 CO -0.00 0.67 -0.01 -0.07 0.00 0.00 0.00 179.25 179.85 3bk7 h LEU 229 N 0.51 0.00 -0.10 0.00 3.38 -0.47 -2.84 115.31 115.78 3bk7 h LEU 229 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3bk7 h LEU 229 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.20 3bk7 h LEU 229 CO 0.17 0.01 0.00 -0.07 0.09 0.00 0.00 178.44 178.63 3bk7 h LEU 230 N 0.00 0.00 -9.86 1.67 3.38 -1.28 -3.45 115.31 105.77 3bk7 h LEU 230 Ca -0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 3bk7 h LEU 230 Cb 0.75 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.53 3bk7 h LEU 230 CO 0.00 0.00 0.48 -0.13 0.09 0.00 0.00 178.44 178.89 3bk7 s ARG 231 N -3.21 4.46 -0.72 1.13 1.81 -1.08 0.05 118.95 121.40 3bk7 s ARG 231 Ca 0.08 1.80 -0.15 0.00 -1.72 0.00 0.00 55.73 55.74 3bk7 s ARG 231 Cb 0.07 -3.01 0.19 0.00 -0.45 0.00 0.00 34.95 31.75 3bk7 s ARG 231 CO 0.63 0.05 0.67 0.21 -0.68 0.00 0.00 175.30 176.19 3bk7 s LYS 232 N -1.75 3.38 0.00 3.54 2.20 -1.26 -4.80 119.74 121.04 3bk7 s LYS 232 Ca 0.49 -2.18 0.00 0.00 -0.36 0.00 0.00 55.97 53.92 3bk7 s LYS 232 Cb -0.31 -4.38 0.00 0.00 -1.51 0.00 0.00 37.83 31.62 3bk7 s LYS 232 CO 0.40 -1.31 0.00 0.00 -0.36 0.00 0.00 175.35 174.08 3bk7 n ALA 233 N 4.47 0.00 0.00 3.13 0.00 -1.26 -5.06 120.51 121.79 3bk7 n ALA 233 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3bk7 n ALA 233 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 3bk7 n ALA 233 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3bk7 n HIS 234 N 0.00 0.00 -4.17 0.00 -0.00 -1.26 -5.03 115.22 104.76 3bk7 n HIS 234 Ca 0.00 0.00 -0.34 0.00 0.46 0.00 0.00 57.72 57.84 3bk7 n HIS 234 Cb 0.00 0.00 -0.12 0.00 -0.12 0.00 0.00 29.99 29.75 3bk7 n HIS 234 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 3bk7 s PHE 235 N -1.65 3.10 -0.10 1.57 0.08 -1.26 -1.99 117.98 117.72 3bk7 s PHE 235 Ca 0.00 -0.24 0.01 0.00 0.12 0.00 0.00 56.93 56.82 3bk7 s PHE 235 Cb 0.00 -2.04 0.02 0.00 -0.57 0.00 0.00 43.02 40.43 3bk7 s PHE 235 CO 0.00 -0.05 -0.10 0.71 -0.10 0.00 0.00 175.22 175.68 3bk7 s TYR 236 N 0.60 1.55 -0.26 0.36 2.02 -1.02 -1.11 117.35 119.50 3bk7 s TYR 236 Ca -0.00 -0.72 0.02 0.00 -0.37 0.00 0.00 57.07 56.00 3bk7 s TYR 236 Cb -0.14 -1.22 0.06 0.00 -0.40 0.00 0.00 41.96 40.26 3bk7 s TYR 236 CO 0.02 -0.45 -0.10 -0.06 -1.57 0.00 0.00 175.55 173.40 3bk7 s PHE 237 N 1.31 3.27 -0.34 2.71 0.08 0.27 -1.57 117.98 123.71 3bk7 s PHE 237 Ca -0.02 -2.27 -0.12 0.00 0.12 0.00 0.00 56.93 54.64 3bk7 s PHE 237 Cb -0.14 -1.95 -0.01 0.00 -0.57 0.00 0.00 43.02 40.35 3bk7 s PHE 237 CO -0.04 -0.87 0.22 -0.06 -0.10 0.00 0.00 175.22 174.37 3bk7 s PHE 238 N 1.12 3.22 -0.55 0.36 0.40 0.31 -0.87 117.98 121.97 3bk7 s PHE 238 Ca -0.08 -0.42 -0.17 0.00 -0.60 0.00 0.00 56.93 55.66 3bk7 s PHE 238 Cb -0.20 -2.46 0.11 0.00 0.51 0.00 0.00 43.02 40.99 3bk7 s PHE 238 CO -0.05 -0.44 0.56 0.34 0.70 0.00 0.00 175.22 176.33 3bk7 s ASP 239 N 1.67 6.18 -1.03 1.36 -1.08 -0.73 -1.37 116.67 121.68 3bk7 s ASP 239 Ca 0.05 -1.58 -0.04 0.00 -0.52 0.00 0.00 52.55 50.46 3bk7 s ASP 239 Cb -0.18 -2.24 0.00 0.00 -1.46 0.00 0.00 42.92 39.05 3bk7 s ASP 239 CO 0.09 -0.92 0.88 -0.62 0.52 0.00 0.00 175.17 175.12 3bk7 n GLU 240 N 5.62 -5.89 0.26 4.34 1.02 -0.91 -3.82 120.64 121.27 3bk7 n GLU 240 Ca -0.12 0.67 0.16 0.00 -0.02 0.00 0.00 57.16 57.85 3bk7 n GLU 240 Cb 0.41 -5.19 0.86 0.00 -0.02 0.00 0.00 31.44 27.51 3bk7 n GLU 240 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3bk7 h PRO 241 N -1.88 0.00 -0.44 3.49 0.13 -1.82 -2.74 132.00 128.75 3bk7 h PRO 241 Ca -0.46 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.60 3bk7 h PRO 241 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 3bk7 h PRO 241 CO 0.42 0.00 -0.01 1.03 -0.23 0.00 0.00 178.00 179.22 3bk7 h SER 242 N 0.00 0.68 -1.85 1.44 0.87 -1.91 -3.44 113.55 109.34 3bk7 h SER 242 Ca 0.00 -0.16 -0.65 0.00 -1.23 0.00 0.00 61.79 59.75 3bk7 h SER 242 Cb 0.14 -0.18 0.09 0.00 -0.44 0.00 0.00 62.40 62.01 3bk7 h SER 242 CO 0.00 0.76 0.07 -1.20 -0.53 0.00 0.00 176.83 175.93 3bk7 n SER 243 N -4.23 0.76 0.00 6.23 7.64 -1.04 -2.11 113.62 120.88 3bk7 n SER 243 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 3bk7 n SER 243 Cb 0.29 -1.17 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 3bk7 n SER 243 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3bk7 n TYR 244 N 0.86 0.00 -3.65 1.43 0.53 -1.26 -4.82 117.16 110.25 3bk7 n TYR 244 Ca 0.14 0.00 -0.37 0.00 -1.02 0.00 0.00 57.90 56.66 3bk7 n TYR 244 Cb 0.26 -0.74 -0.06 0.00 -1.03 0.00 0.00 39.34 37.77 3bk7 n TYR 244 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 3bk7 s LEU 245 N 0.00 4.42 0.78 7.72 1.43 -0.90 -3.52 118.68 128.61 3bk7 s LEU 245 Ca 0.00 0.75 -0.10 0.00 -1.03 0.00 0.00 54.13 53.75 3bk7 s LEU 245 Cb 0.00 -2.51 0.09 0.00 0.03 0.00 0.00 46.19 43.80 3bk7 s LEU 245 CO 0.00 0.32 1.12 1.51 0.23 0.00 0.00 176.35 179.52 3bk7 s ASP 246 N -1.25 4.41 0.30 2.29 1.47 -1.26 -4.67 116.67 117.96 3bk7 s ASP 246 Ca 0.23 0.48 0.01 0.00 1.18 0.00 0.00 52.55 54.45 3bk7 s ASP 246 Cb -0.15 -0.96 0.73 0.00 -0.34 0.00 0.00 42.92 42.20 3bk7 s ASP 246 CO 0.12 -1.90 1.55 0.00 0.68 0.00 0.00 175.17 175.61 3bk7 n ILE 247 N -3.18 -0.41 0.14 2.11 0.13 -1.26 -1.38 119.36 115.50 3bk7 n ILE 247 Ca 0.10 2.18 -0.11 0.00 -1.10 0.00 0.00 62.75 63.82 3bk7 n ILE 247 Cb 0.60 -3.17 -0.06 0.00 -0.84 0.00 0.00 39.64 36.17 3bk7 n ILE 247 CO 0.00 0.00 0.00 -0.09 2.80 0.00 0.00 176.55 179.26 3bk7 h ARG 248 N 0.00 -0.41 -0.14 9.51 9.65 -1.91 -3.25 114.38 127.83 3bk7 h ARG 248 Ca 0.59 0.03 0.05 0.00 -1.10 0.00 0.00 59.98 59.55 3bk7 h ARG 248 Cb 1.20 0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 29.81 3bk7 h ARG 248 CO -0.93 -0.11 -0.23 1.96 2.80 0.00 0.00 179.97 183.46 3bk7 h GLN 249 N -0.98 -0.28 -0.93 0.20 4.20 -1.79 -1.81 115.11 113.72 3bk7 h GLN 249 Ca -0.04 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.73 3bk7 h GLN 249 Cb 0.50 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.29 3bk7 h GLN 249 CO 0.07 -0.19 0.61 0.07 -0.67 0.00 0.00 178.83 178.72 3bk7 h ARG 250 N -0.29 1.11 -0.18 1.46 0.11 -1.38 -1.27 114.38 113.94 3bk7 h ARG 250 Ca 0.10 -0.07 -0.15 0.00 0.10 0.00 0.00 59.98 59.97 3bk7 h ARG 250 Cb 0.45 -0.25 -0.01 0.00 1.11 0.00 0.00 29.97 31.27 3bk7 h ARG 250 CO -0.31 0.74 -0.51 -0.07 0.10 0.00 0.00 179.97 179.92 3bk7 h LEU 251 N 1.15 0.54 -0.79 0.08 3.38 -1.53 -3.04 115.31 115.10 3bk7 h LEU 251 Ca 0.38 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 3bk7 h LEU 251 Cb 0.06 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3bk7 h LEU 251 CO -0.12 0.96 -0.58 0.11 0.09 0.00 0.00 178.44 178.90 3bk7 h LYS 252 N 0.39 0.08 -0.10 1.13 1.57 -0.74 -3.21 116.57 115.70 3bk7 h LYS 252 Ca 0.02 -0.06 -0.20 0.00 -1.87 0.00 0.00 60.65 58.54 3bk7 h LYS 252 Cb 1.03 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.35 3bk7 h LYS 252 CO 0.09 0.64 -0.77 0.28 -0.57 0.00 0.00 179.45 179.12 3bk7 h VAL 253 N 0.06 1.34 -0.66 0.50 2.07 -1.22 -2.73 116.25 115.62 3bk7 h VAL 253 Ca -0.00 -2.11 0.09 0.00 0.82 0.00 0.00 66.70 65.50 3bk7 h VAL 253 Cb 1.04 2.10 -0.07 0.00 -1.52 0.00 0.00 31.29 32.84 3bk7 h VAL 253 CO 0.08 0.65 0.30 0.00 0.02 0.00 0.00 177.57 178.62 3bk7 h ALA 254 N 0.78 0.89 -0.75 1.67 0.00 -1.53 0.46 119.26 120.77 3bk7 h ALA 254 Ca -0.04 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3bk7 h ALA 254 Cb 1.37 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 3bk7 h ALA 254 CO 0.14 -0.11 0.49 -0.09 0.00 0.00 0.00 179.25 179.69 3bk7 h ARG 255 N 0.52 0.97 -0.23 0.00 2.43 -1.58 0.39 114.38 116.89 3bk7 h ARG 255 Ca 0.33 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.41 3bk7 h ARG 255 Cb 0.36 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3bk7 h ARG 255 CO -0.28 0.64 0.02 0.28 -1.51 0.00 0.00 179.97 179.13 3bk7 h VAL 256 N 1.00 1.24 0.08 0.20 2.07 -0.68 -3.05 116.25 117.11 3bk7 h VAL 256 Ca 0.28 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 3bk7 h VAL 256 Cb -0.11 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3bk7 h VAL 256 CO -0.06 0.25 -0.04 0.40 0.02 0.00 0.00 177.57 178.14 3bk7 h ILE 257 N 0.17 1.09 -0.94 4.57 2.04 0.18 -3.15 117.51 121.47 3bk7 h ILE 257 Ca 0.07 -0.61 0.25 0.00 1.00 0.00 0.00 64.86 65.57 3bk7 h ILE 257 Cb 0.35 1.49 -0.06 0.00 -0.74 0.00 0.00 36.82 37.86 3bk7 h ILE 257 CO 0.01 0.15 0.65 -0.09 0.00 0.00 0.00 178.15 178.87 3bk7 h ARG 258 N -0.38 0.19 0.00 2.37 2.43 -0.28 0.16 114.38 118.86 3bk7 h ARG 258 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3bk7 h ARG 258 Cb 0.32 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 3bk7 h ARG 258 CO 0.02 0.12 0.00 0.54 -1.51 0.00 0.00 179.97 179.14 3bk7 n ARG 259 N -4.40 0.16 0.12 0.20 1.74 -1.15 -1.10 116.66 112.23 3bk7 n ARG 259 Ca 0.20 0.59 0.01 0.00 -0.77 0.00 0.00 57.85 57.88 3bk7 n ARG 259 Cb 0.89 -1.95 0.33 0.00 -1.02 0.00 0.00 32.46 30.70 3bk7 n ARG 259 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3bk7 h LEU 260 N 0.00 0.19 -0.98 0.55 3.38 -0.84 -1.92 115.31 115.69 3bk7 h LEU 260 Ca 0.00 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3bk7 h LEU 260 Cb 0.09 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3bk7 h LEU 260 CO 0.00 0.47 0.29 0.00 0.09 0.00 0.00 178.44 179.29 3bk7 h ALA 261 N 1.55 1.19 0.06 1.53 0.00 -1.26 -1.98 119.26 120.35 3bk7 h ALA 261 Ca 0.03 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.79 3bk7 h ALA 261 Cb 0.58 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3bk7 h ALA 261 CO 0.04 0.59 -0.25 -0.91 0.00 0.00 0.00 179.25 178.72 3bk7 h ASN 262 N 1.01 -0.74 0.00 0.00 2.35 -1.44 0.11 115.58 116.87 3bk7 h ASN 262 Ca 0.24 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 3bk7 h ASN 262 Cb 0.17 0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.83 3bk7 h ASN 262 CO -0.02 -0.33 0.00 -0.62 -1.65 0.00 0.00 177.43 174.81 3bk7 n GLU 263 N -5.37 0.00 -1.04 0.81 1.02 -1.05 -4.71 120.64 110.30 3bk7 n GLU 263 Ca -0.06 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3bk7 n GLU 263 Cb 0.28 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 3bk7 n GLU 263 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3bk7 n GLY 264 N -1.03 0.64 3.93 0.62 0.00 0.37 -5.05 105.19 104.66 3bk7 n GLY 264 Ca 0.00 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 44.99 3bk7 n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bk7 s LYS 265 N -2.19 3.49 -0.29 1.61 1.02 -0.77 -3.53 119.74 119.08 3bk7 s LYS 265 Ca 0.00 -0.41 -0.22 0.00 0.02 0.00 0.00 55.97 55.36 3bk7 s LYS 265 Cb 0.00 -2.91 -0.01 0.00 -0.52 0.00 0.00 37.83 34.40 3bk7 s LYS 265 CO 0.00 0.47 0.72 0.00 -0.92 0.00 0.00 175.35 175.63 3bk7 s ALA 266 N -1.76 3.55 -0.02 5.17 0.00 -0.84 -2.17 121.76 125.69 3bk7 s ALA 266 Ca 0.37 -0.47 0.03 0.00 0.00 0.00 0.00 51.96 51.89 3bk7 s ALA 266 Cb -0.11 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 3bk7 s ALA 266 CO 0.28 -1.09 -0.09 0.08 0.00 0.00 0.00 175.76 174.95 3bk7 s VAL 267 N 2.78 3.50 -0.04 0.00 1.01 0.74 -2.43 120.40 125.96 3bk7 s VAL 267 Ca 0.30 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3bk7 s VAL 267 Cb -0.15 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 33.77 3bk7 s VAL 267 CO 0.11 0.46 -0.06 -0.22 0.00 0.00 0.00 175.10 175.39 3bk7 s LEU 268 N -1.19 1.45 -0.01 3.92 2.96 -0.61 -0.62 118.68 124.58 3bk7 s LEU 268 Ca 0.15 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 3bk7 s LEU 268 Cb -0.11 -0.52 0.02 0.00 0.50 0.00 0.00 46.19 46.08 3bk7 s LEU 268 CO 0.05 -0.02 0.02 0.54 -1.32 0.00 0.00 176.35 175.61 3bk7 s VAL 269 N 0.77 -0.01 -0.17 1.68 0.11 -0.74 -0.53 120.40 121.52 3bk7 s VAL 269 Ca -0.12 0.14 -0.10 0.00 -2.93 0.00 0.00 61.98 58.97 3bk7 s VAL 269 Cb -0.14 -0.08 -0.05 0.00 -1.53 0.00 0.00 36.38 34.58 3bk7 s VAL 269 CO 0.01 0.07 0.17 -0.69 -3.33 0.00 0.00 175.10 171.33 3bk7 s VAL 270 N 0.75 5.40 -0.00 2.04 1.01 -0.47 -0.11 120.40 129.02 3bk7 s VAL 270 Ca -0.06 0.27 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 3bk7 s VAL 270 Cb -0.09 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.80 3bk7 s VAL 270 CO -0.02 0.48 0.12 -1.61 0.00 0.00 0.00 175.10 174.07 3bk7 s GLU 271 N 0.01 0.42 0.00 2.72 0.41 -0.85 -2.14 118.70 119.27 3bk7 s GLU 271 Ca 0.11 -0.33 0.07 0.00 -0.41 0.00 0.00 54.97 54.41 3bk7 s GLU 271 Cb -0.12 0.18 0.02 0.00 -1.78 0.00 0.00 34.13 32.43 3bk7 s GLU 271 CO 0.01 -0.10 0.59 0.72 -0.49 0.00 0.00 175.26 175.99 3bk7 n HIS 272 N 1.69 0.00 -3.48 1.61 8.25 -1.26 -4.59 115.22 117.44 3bk7 n HIS 272 Ca -0.21 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.82 3bk7 n HIS 272 Cb 0.56 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.61 3bk7 n HIS 272 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3bk7 s ASP 273 N -0.93 6.03 0.30 0.41 -1.08 -1.26 -4.32 116.67 115.81 3bk7 s ASP 273 Ca 0.07 -2.35 0.04 0.00 -0.52 0.00 0.00 52.55 49.80 3bk7 s ASP 273 Cb 0.06 -2.07 0.77 0.00 -1.46 0.00 0.00 42.92 40.21 3bk7 s ASP 273 CO 0.15 -0.61 1.67 -0.07 0.52 0.00 0.00 175.17 176.83 3bk7 h LEU 274 N 8.00 0.22 -0.74 -1.34 3.38 -1.98 0.31 115.31 123.16 3bk7 h LEU 274 Ca -0.08 0.18 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3bk7 h LEU 274 Cb 1.04 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 3bk7 h LEU 274 CO 0.82 -0.08 0.19 0.00 0.09 0.00 0.00 178.44 179.46 3bk7 h ALA 275 N 1.76 0.97 -0.20 1.53 0.00 -1.93 0.22 119.26 121.61 3bk7 h ALA 275 Ca 0.58 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 3bk7 h ALA 275 Cb 1.16 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3bk7 h ALA 275 CO -0.59 0.67 -0.39 0.28 0.00 0.00 0.00 179.25 179.22 3bk7 h VAL 276 N 1.09 1.30 -0.06 0.00 2.07 -0.96 -2.36 116.25 117.34 3bk7 h VAL 276 Ca 0.23 -1.52 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 3bk7 h VAL 276 Cb 0.35 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 3bk7 h VAL 276 CO -0.00 0.47 -0.03 0.25 0.02 0.00 0.00 177.57 178.28 3bk7 h LEU 277 N 0.37 0.12 -0.02 2.57 5.85 -0.26 -2.13 115.31 121.82 3bk7 h LEU 277 Ca 0.04 -0.41 0.02 0.00 0.84 0.00 0.00 57.88 58.37 3bk7 h LEU 277 Cb 0.85 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 3bk7 h LEU 277 CO 0.07 0.51 -0.12 -0.78 -0.34 0.00 0.00 178.44 177.78 3bk7 h ASP 278 N -0.26 -0.35 -0.38 1.25 1.82 -0.92 0.21 116.42 117.79 3bk7 h ASP 278 Ca 0.01 0.05 0.01 0.00 -0.39 0.00 0.00 57.03 56.72 3bk7 h ASP 278 Cb 0.46 0.15 -0.02 0.00 0.68 0.00 0.00 39.33 40.60 3bk7 h ASP 278 CO 0.01 -0.17 0.24 0.22 -1.61 0.00 0.00 179.24 177.93 3bk7 h TYR 279 N -0.20 0.46 0.35 0.28 -0.00 -1.48 -3.29 116.97 113.09 3bk7 h TYR 279 Ca 0.05 0.01 -0.02 0.00 -0.00 0.00 0.00 58.73 58.77 3bk7 h TYR 279 Cb 0.26 -0.15 0.00 0.00 -0.00 0.00 0.00 36.73 36.84 3bk7 h TYR 279 CO -0.19 0.28 -0.17 -0.07 -0.00 0.00 0.00 178.16 178.02 3bk7 h LEU 280 N 0.50 -0.39 -9.78 2.82 3.38 -1.03 -3.46 115.31 107.35 3bk7 h LEU 280 Ca 0.14 0.01 -0.56 0.00 0.09 0.00 0.00 57.88 57.56 3bk7 h LEU 280 Cb -0.03 0.10 0.11 0.00 0.09 0.00 0.00 40.66 40.93 3bk7 h LEU 280 CO -0.05 -0.24 0.52 -1.20 0.09 0.00 0.00 178.44 177.57 3bk7 n SER 281 N -3.50 2.79 -0.08 -0.43 7.64 0.72 -4.74 113.62 116.03 3bk7 n SER 281 Ca -0.06 1.18 -0.09 0.00 1.01 0.00 0.00 58.87 60.92 3bk7 n SER 281 Cb 0.18 -1.50 -0.09 0.00 -1.01 0.00 0.00 64.21 61.79 3bk7 n SER 281 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3bk7 n ASP 282 N 0.60 2.15 -4.34 6.43 8.00 0.17 -4.80 116.55 124.75 3bk7 n ASP 282 Ca 0.05 -0.04 -0.18 0.00 0.71 0.00 0.00 54.79 55.33 3bk7 n ASP 282 Cb 0.37 0.32 -0.10 0.00 -0.02 0.00 0.00 41.12 41.69 3bk7 n ASP 282 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3bk7 s VAL 283 N -2.33 1.51 -0.07 2.53 1.01 -1.09 -3.70 120.40 118.26 3bk7 s VAL 283 Ca -0.14 -2.14 -0.14 0.00 0.00 0.00 0.00 61.98 59.56 3bk7 s VAL 283 Cb 0.05 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.36 3bk7 s VAL 283 CO 0.48 -0.55 0.34 -0.63 0.00 0.00 0.00 175.10 174.74 3bk7 s ILE 284 N -3.11 0.03 0.02 2.22 1.01 -0.09 -0.63 121.20 120.65 3bk7 s ILE 284 Ca 0.23 -0.24 0.07 0.00 0.00 0.00 0.00 60.65 60.72 3bk7 s ILE 284 Cb 0.01 -0.57 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 3bk7 s ILE 284 CO 0.06 -0.13 -0.22 -1.00 0.00 0.00 0.00 174.94 173.66 3bk7 s HIS 285 N -0.60 1.91 -0.00 3.97 3.76 -0.59 -0.49 115.29 123.25 3bk7 s HIS 285 Ca -0.07 -0.37 0.03 0.00 -0.15 0.00 0.00 55.06 54.49 3bk7 s HIS 285 Cb -0.04 -1.18 -0.03 0.00 1.11 0.00 0.00 32.58 32.44 3bk7 s HIS 285 CO 0.03 0.05 -0.05 0.08 -0.85 0.00 0.00 174.74 173.99 3bk7 s VAL 286 N -0.68 3.78 -0.16 -0.90 1.01 -1.26 -1.46 120.40 120.74 3bk7 s VAL 286 Ca 0.08 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.36 3bk7 s VAL 286 Cb -0.09 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.66 3bk7 s VAL 286 CO 0.01 0.40 -0.19 -0.69 0.00 0.00 0.00 175.10 174.62 3bk7 s VAL 287 N -1.01 1.93 0.19 2.92 1.01 -0.49 -1.14 120.40 123.82 3bk7 s VAL 287 Ca 0.18 -0.88 0.10 0.00 0.00 0.00 0.00 61.98 61.37 3bk7 s VAL 287 Cb -0.11 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 3bk7 s VAL 287 CO 0.08 0.52 -0.20 -0.72 0.00 0.00 0.00 175.10 174.79 3bk7 s TYR 288 N 1.13 2.00 0.00 5.22 1.13 -0.69 -4.43 117.35 121.71 3bk7 s TYR 288 Ca -0.00 -0.43 0.00 0.00 -1.41 0.00 0.00 57.07 55.23 3bk7 s TYR 288 Cb -0.14 -0.97 0.00 0.00 -1.10 0.00 0.00 41.96 39.75 3bk7 s TYR 288 CO -0.08 0.44 0.00 0.41 -2.51 0.00 0.00 175.55 173.81 3bk7 n GLY 289 N 0.06 1.20 3.68 5.49 0.00 -1.26 -1.42 105.19 112.94 3bk7 n GLY 289 Ca -0.11 -1.95 -0.40 0.00 0.00 0.00 0.00 46.02 43.57 3bk7 n GLY 289 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3bk7 s GLU 290 N -1.08 4.28 0.13 1.61 2.12 -1.20 -4.96 118.70 119.60 3bk7 s GLU 290 Ca 0.00 0.62 -0.35 0.00 0.36 0.00 0.00 54.97 55.61 3bk7 s GLU 290 Cb 0.00 -3.52 -0.16 0.00 0.26 0.00 0.00 34.13 30.70 3bk7 s GLU 290 CO 0.00 -0.10 1.22 -2.30 -0.54 0.00 0.00 175.26 173.54 3bk7 n PRO 291 N 4.52 1.07 0.00 4.30 -0.02 -1.26 -1.51 135.00 142.11 3bk7 n PRO 291 Ca -0.03 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3bk7 n PRO 291 Cb 0.50 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 3bk7 n PRO 291 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3bk7 n GLY 292 N 2.20 2.74 0.20 -1.23 0.00 0.18 -4.79 105.19 104.49 3bk7 n GLY 292 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 3bk7 n GLY 292 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3bk7 n VAL 293 N -1.99 0.51 -3.55 1.61 0.31 -0.57 -4.21 118.33 110.44 3bk7 n VAL 293 Ca 0.00 0.33 -0.12 0.00 -0.01 0.00 0.00 64.34 64.55 3bk7 n VAL 293 Cb 0.00 -1.69 -0.04 0.00 -0.91 0.00 0.00 33.84 31.20 3bk7 n VAL 293 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 3bk7 s TYR 294 N -1.61 -0.38 0.00 3.52 1.13 -1.00 -1.65 117.35 117.36 3bk7 s TYR 294 Ca -0.08 0.20 -0.01 0.00 -1.41 0.00 0.00 57.07 55.76 3bk7 s TYR 294 Cb 0.01 0.38 -0.01 0.00 -1.10 0.00 0.00 41.96 41.25 3bk7 s TYR 294 CO 0.12 -0.73 0.02 0.20 -2.51 0.00 0.00 175.55 172.65 3bk7 s GLY 295 N -2.55 0.08 -0.06 5.49 0.00 -0.84 -3.21 107.32 106.22 3bk7 s GLY 295 Ca 0.00 -0.17 0.02 0.00 0.00 0.00 0.00 44.72 44.56 3bk7 s GLY 295 CO -0.09 -0.22 -0.10 -0.42 0.00 0.00 0.00 173.10 172.27 3bk7 s ILE 296 N -0.66 0.97 -0.02 0.90 1.01 -0.51 -0.22 121.20 122.68 3bk7 s ILE 296 Ca -0.07 -0.37 -0.24 0.00 0.00 0.00 0.00 60.65 59.97 3bk7 s ILE 296 Cb -0.05 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3bk7 s ILE 296 CO -0.00 0.32 0.72 -0.36 0.00 0.00 0.00 174.94 175.62 3bk7 s PHE 297 N 0.84 3.65 0.84 3.97 0.08 -0.87 -1.71 117.98 124.78 3bk7 s PHE 297 Ca -0.12 1.34 -0.11 0.00 0.12 0.00 0.00 56.93 58.16 3bk7 s PHE 297 Cb -0.15 -2.80 0.13 0.00 -0.57 0.00 0.00 43.02 39.63 3bk7 s PHE 297 CO 0.02 0.18 1.18 -1.54 -0.10 0.00 0.00 175.22 174.96 3bk7 s SER 298 N 0.39 3.95 0.72 1.36 1.04 -0.29 -4.81 113.70 116.05 3bk7 s SER 298 Ca 0.38 0.32 -0.13 0.00 0.48 0.00 0.00 55.95 57.01 3bk7 s SER 298 Cb -0.19 -0.64 0.03 0.00 0.10 0.00 0.00 66.02 65.32 3bk7 s SER 298 CO 0.20 -2.19 1.10 -0.54 0.98 0.00 0.00 173.24 172.79 3bk7 s LYS 299 N -5.58 2.52 0.42 4.02 1.02 -1.26 -4.72 119.74 116.16 3bk7 s LYS 299 Ca 0.67 1.27 -0.26 0.00 0.02 0.00 0.00 55.97 57.67 3bk7 s LYS 299 Cb -0.07 -1.92 -0.09 0.00 -0.52 0.00 0.00 37.83 35.23 3bk7 s LYS 299 CO 0.49 -1.45 1.37 -1.25 -0.92 0.00 0.00 175.35 173.58 3bk7 s PRO 300 N -4.54 3.86 0.20 -1.68 0.04 -1.26 -4.74 135.00 126.87 3bk7 s PRO 300 Ca 0.64 2.29 0.06 0.00 0.04 0.00 0.00 61.00 64.03 3bk7 s PRO 300 Cb -0.19 -2.73 -0.05 0.00 0.04 0.00 0.00 34.50 31.58 3bk7 s PRO 300 CO 0.49 -0.63 -0.09 0.15 0.04 0.00 0.00 177.00 176.96 3bk7 s LYS 301 N -2.32 1.25 0.05 4.56 1.02 0.35 -4.94 119.74 119.72 3bk7 s LYS 301 Ca 0.58 -1.57 -0.30 0.00 0.02 0.00 0.00 55.97 54.70 3bk7 s LYS 301 Cb -0.41 -0.85 -0.05 0.00 -0.52 0.00 0.00 37.83 36.00 3bk7 s LYS 301 CO 0.53 0.08 1.10 0.20 -0.92 0.00 0.00 175.35 176.33 3bk7 s GLY 302 N -3.27 2.66 0.14 -3.33 0.00 -1.26 -0.92 107.32 101.34 3bk7 s GLY 302 Ca 0.22 0.72 -0.13 0.00 0.00 0.00 0.00 44.72 45.52 3bk7 s GLY 302 CO 0.05 1.85 0.99 2.41 0.00 0.00 0.00 173.10 178.40 3bk7 n THR 303 N 3.73 -0.36 0.02 0.90 -1.04 -1.24 -0.24 114.28 116.05 3bk7 n THR 303 Ca 0.07 1.50 -0.01 0.00 -2.04 0.00 0.00 64.05 63.57 3bk7 n THR 303 Cb 0.48 -1.95 -0.01 0.00 -1.82 0.00 0.00 70.33 67.03 3bk7 n THR 303 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 3bk7 h ARG 304 N 0.00 -0.07 -0.15 -2.82 2.43 -1.92 -1.08 114.38 110.77 3bk7 h ARG 304 Ca 0.19 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.42 3bk7 h ARG 304 Cb 0.35 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.85 3bk7 h ARG 304 CO -0.62 -0.05 -0.36 -0.91 -1.51 0.00 0.00 179.97 176.53 3bk7 h ASN 305 N -0.07 -1.11 -0.74 -3.80 4.21 -1.77 -2.32 115.58 109.98 3bk7 h ASN 305 Ca -0.01 0.16 0.17 0.00 1.21 0.00 0.00 56.30 57.83 3bk7 h ASN 305 Cb 0.06 0.47 -0.13 0.00 -1.12 0.00 0.00 38.32 37.60 3bk7 h ASN 305 CO 0.00 -0.38 0.01 1.23 -1.29 0.00 0.00 177.43 177.00 3bk7 h GLY 306 N -0.42 0.83 1.96 2.83 0.00 -0.63 -0.81 103.07 106.82 3bk7 h GLY 306 Ca 0.10 0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.43 3bk7 h GLY 306 CO -0.38 -0.27 -0.41 -2.22 0.00 0.00 0.00 176.54 173.25 3bk7 h ILE 307 N 0.11 1.30 -0.06 2.60 2.04 -0.76 -2.20 117.51 120.54 3bk7 h ILE 307 Ca 0.40 -1.44 -0.10 0.00 1.00 0.00 0.00 64.86 64.73 3bk7 h ILE 307 Cb 0.70 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 3bk7 h ILE 307 CO -0.64 0.41 -0.33 0.78 0.00 0.00 0.00 178.15 178.37 3bk7 h ASN 308 N 0.04 0.40 -0.06 1.72 2.35 -0.67 -2.58 115.58 116.78 3bk7 h ASN 308 Ca 0.00 -0.66 -0.01 0.00 -0.55 0.00 0.00 56.30 55.09 3bk7 h ASN 308 Cb 0.75 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 3bk7 h ASN 308 CO 0.06 1.00 0.03 -0.33 -1.65 0.00 0.00 177.43 176.53 3bk7 h GLU 309 N -0.17 0.12 -0.14 0.81 5.08 -1.25 -1.54 114.58 117.49 3bk7 h GLU 309 Ca -0.02 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3bk7 h GLU 309 Cb 0.99 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 3bk7 h GLU 309 CO 0.07 0.11 0.06 0.35 -1.00 0.00 0.00 179.01 178.60 3bk7 h PHE 310 N 0.12 0.21 -0.55 4.33 3.57 -1.23 -1.47 116.94 121.92 3bk7 h PHE 310 Ca 0.03 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.55 3bk7 h PHE 310 Cb 0.04 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 3bk7 h PHE 310 CO 0.00 0.27 0.37 -0.07 -2.23 0.00 0.00 178.31 176.65 3bk7 h LEU 311 N 0.08 0.53 -0.75 0.59 3.38 -0.91 -2.01 115.31 116.23 3bk7 h LEU 311 Ca 0.05 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 3bk7 h LEU 311 Cb 0.15 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3bk7 h LEU 311 CO -0.00 0.37 -0.38 1.56 0.09 0.00 0.00 178.44 180.07 3bk7 h GLN 312 N 0.62 0.00 -0.39 1.13 4.20 -0.89 -2.40 115.11 117.38 3bk7 h GLN 312 Ca 0.22 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 3bk7 h GLN 312 Cb 0.12 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 3bk7 h GLN 312 CO -0.06 0.38 -0.07 0.41 -0.67 0.00 0.00 178.83 178.83 3bk7 n GLY 313 N 0.45 0.27 3.02 3.46 0.00 -0.60 -4.33 105.19 107.46 3bk7 n GLY 313 Ca 0.00 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.14 3bk7 n GLY 313 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3bk7 s TYR 314 N -2.15 -0.70 -0.58 1.61 6.14 -1.12 -1.65 117.35 118.92 3bk7 s TYR 314 Ca 0.00 1.00 -0.19 0.00 0.64 0.00 0.00 57.07 58.52 3bk7 s TYR 314 Cb -0.00 0.05 0.10 0.00 0.42 0.00 0.00 41.96 42.53 3bk7 s TYR 314 CO 0.00 -0.58 0.67 -0.51 0.64 0.00 0.00 175.55 175.78 3bk7 s LEU 315 N 2.52 5.41 0.09 6.97 1.43 -0.19 -4.68 118.68 130.22 3bk7 s LEU 315 Ca 0.06 -1.40 -0.21 0.00 -1.03 0.00 0.00 54.13 51.55 3bk7 s LEU 315 Cb -0.14 -2.31 -0.07 0.00 0.03 0.00 0.00 46.19 43.70 3bk7 s LEU 315 CO -0.13 -1.06 1.35 0.11 0.23 0.00 0.00 176.35 176.85 3bk7 h LYS 316 N 9.14 -0.23 0.14 1.70 1.57 -1.94 1.23 116.57 128.18 3bk7 h LYS 316 Ca -0.29 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.52 3bk7 h LYS 316 Cb 1.09 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.41 3bk7 h LYS 316 CO 1.08 -0.15 -0.43 -0.44 -0.57 0.00 0.00 179.45 178.94 3bk7 h ASP 317 N -0.24 -1.26 -0.17 0.86 3.32 -1.99 -0.33 116.42 116.61 3bk7 h ASP 317 Ca 0.05 0.14 0.01 0.00 0.02 0.00 0.00 57.03 57.24 3bk7 h ASP 317 Cb 0.38 0.47 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 3bk7 h ASP 317 CO -0.40 -0.50 0.12 -0.33 -1.72 0.00 0.00 179.24 176.40 3bk7 h GLU 318 N -0.68 0.21 -4.62 3.56 3.07 -1.96 -3.47 114.58 110.69 3bk7 h GLU 318 Ca 0.02 -0.01 -0.13 0.00 -0.50 0.00 0.00 59.36 58.74 3bk7 h GLU 318 Cb 0.69 -0.05 0.10 0.00 -0.84 0.00 0.00 28.75 28.66 3bk7 h GLU 318 CO -0.24 0.14 -0.43 -1.71 -1.40 0.00 0.00 179.01 175.37 3bk7 n ASN 319 N -4.51 -5.28 -3.98 1.42 2.85 0.42 -5.05 115.26 101.12 3bk7 n ASN 319 Ca -0.00 -0.37 -0.09 0.00 -0.11 0.00 0.00 54.58 54.01 3bk7 n ASN 319 Cb 0.09 -3.70 -0.11 0.00 1.24 0.00 0.00 39.78 37.31 3bk7 n ASN 319 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3bk7 s VAL 320 N -3.20 0.12 -0.32 3.44 1.01 -1.07 -4.98 120.40 115.41 3bk7 s VAL 320 Ca 0.23 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 61.22 3bk7 s VAL 320 Cb -0.03 -0.47 0.09 0.00 0.00 0.00 0.00 36.38 35.97 3bk7 s VAL 320 CO 0.49 -0.56 0.05 -0.60 0.00 0.00 0.00 175.10 174.49 3bk7 s ARG 321 N -1.83 1.26 0.00 2.72 3.52 -1.26 -1.03 118.95 122.34 3bk7 s ARG 321 Ca -0.12 -1.51 0.19 0.00 -0.13 0.00 0.00 55.73 54.16 3bk7 s ARG 321 Cb -0.07 -2.74 0.60 0.00 -1.56 0.00 0.00 34.95 31.18 3bk7 s ARG 321 CO -0.02 -0.91 1.46 1.97 -0.81 0.00 0.00 175.30 176.99 3bk7 n PHE 322 N 4.49 0.35 -3.49 5.12 1.16 -0.66 -4.77 117.46 119.66 3bk7 n PHE 322 Ca -0.00 -0.17 -0.04 0.00 -1.87 0.00 0.00 57.45 55.36 3bk7 n PHE 322 Cb 0.42 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.23 3bk7 n PHE 322 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 3bk7 s ARG 323 N -1.65 0.45 0.24 3.97 3.52 -1.23 -5.00 118.95 119.25 3bk7 s ARG 323 Ca 0.32 1.05 -0.11 0.00 -0.13 0.00 0.00 55.73 56.86 3bk7 s ARG 323 Cb 0.18 0.37 0.35 0.00 -1.56 0.00 0.00 34.95 34.28 3bk7 s ARG 323 CO 0.25 -0.39 1.60 -1.00 -0.81 0.00 0.00 175.30 174.95 3bk7 h PRO 324 N 8.09 0.01 -6.09 5.12 0.13 -1.89 -3.41 132.00 133.95 3bk7 h PRO 324 Ca -0.19 -0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.38 3bk7 h PRO 324 Cb 1.13 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 3bk7 h PRO 324 CO 0.17 0.00 -0.51 1.52 -0.23 0.00 0.00 178.00 178.96 3bk7 s TYR 325 N -6.23 3.36 0.60 1.56 1.13 -1.26 -5.11 117.35 111.39 3bk7 s TYR 325 Ca -0.14 0.08 0.05 0.00 -1.41 0.00 0.00 57.07 55.65 3bk7 s TYR 325 Cb 0.23 -1.62 0.11 0.00 -1.10 0.00 0.00 41.96 39.57 3bk7 s TYR 325 CO 0.75 0.53 0.83 0.39 -2.51 0.00 0.00 175.55 175.54 3bk7 n GLU 326 N -0.32 0.30 -3.51 -3.49 1.02 -1.26 -4.75 120.64 108.62 3bk7 n GLU 326 Ca -0.07 -2.71 -0.28 0.00 -0.02 0.00 0.00 57.16 54.08 3bk7 n GLU 326 Cb 0.54 -0.41 -0.14 0.00 -0.02 0.00 0.00 31.44 31.40 3bk7 n GLU 326 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3bk7 s ILE 327 N -2.57 -0.08 -0.09 -3.67 1.01 -0.90 -5.02 121.20 109.87 3bk7 s ILE 327 Ca 0.59 -0.86 -0.00 0.00 0.00 0.00 0.00 60.65 60.37 3bk7 s ILE 327 Cb -0.04 -0.99 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 3bk7 s ILE 327 CO 0.38 -0.74 -0.05 0.00 0.00 0.00 0.00 174.94 174.53 3bk7 s ARG 328 N 1.98 2.97 0.17 2.79 1.70 -1.26 -4.66 118.95 122.64 3bk7 s ARG 328 Ca 0.10 -0.52 -0.20 0.00 -0.47 0.00 0.00 55.73 54.64 3bk7 s ARG 328 Cb -0.17 -2.68 -0.08 0.00 -0.57 0.00 0.00 34.95 31.45 3bk7 s ARG 328 CO -0.31 0.59 0.68 -0.06 -1.08 0.00 0.00 175.30 175.12 3bk7 s PHE 329 N -0.59 3.74 -0.32 5.89 0.40 -1.23 -5.01 117.98 120.86 3bk7 s PHE 329 Ca 0.09 1.38 -0.29 0.00 -0.60 0.00 0.00 56.93 57.51 3bk7 s PHE 329 Cb -0.12 -2.60 0.01 0.00 0.51 0.00 0.00 43.02 40.82 3bk7 s PHE 329 CO 0.02 0.44 1.27 0.99 0.70 0.00 0.00 175.22 178.64 3bk7 s THR 330 N -1.34 4.17 0.01 0.64 2.01 -1.26 -4.68 115.64 115.19 3bk7 s THR 330 Ca 0.38 1.32 -0.01 0.00 0.31 0.00 0.00 61.69 63.68 3bk7 s THR 330 Cb -0.19 -4.21 -0.00 0.00 0.01 0.00 0.00 72.50 68.11 3bk7 s THR 330 CO 0.21 -0.52 0.60 1.17 -0.69 0.00 0.00 174.62 175.40 3bk7 n LYS 331 N 7.33 -0.02 0.00 4.92 4.81 -1.26 -4.87 118.16 129.07 3bk7 n LYS 331 Ca 0.14 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 3bk7 n LYS 331 Cb 0.47 -0.90 0.00 0.00 0.02 0.00 0.00 35.03 34.61 3bk7 n LYS 331 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3bk7 n LEU 332 N -2.71 0.00 0.00 3.14 7.94 -1.26 -4.88 117.00 119.23 3bk7 n LEU 332 Ca 0.00 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.03 3bk7 n LEU 332 Cb 0.01 0.00 0.61 0.00 0.53 0.00 0.00 43.42 44.57 3bk7 n LEU 332 CO -0.01 0.00 0.92 -1.54 -1.11 0.00 0.00 177.39 175.65 3bk7 n SER 333 N 0.00 0.00 0.08 1.96 3.41 -1.26 -2.22 113.62 115.59 3bk7 n SER 333 Ca 0.00 0.11 0.10 0.00 -0.26 0.00 0.00 58.87 58.82 3bk7 n SER 333 Cb 0.00 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 63.56 3bk7 n SER 333 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3bk7 n GLU 334 N -1.36 0.61 -0.74 4.33 1.02 -1.26 -4.96 120.64 118.29 3bk7 n GLU 334 Ca 0.10 0.10 -0.32 0.00 -0.02 0.00 0.00 57.16 57.02 3bk7 n GLU 334 Cb 0.23 -1.79 0.14 0.00 -0.02 0.00 0.00 31.44 30.01 3bk7 n GLU 334 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3bk7 n ARG 335 N -2.65 -0.50 -4.33 3.49 5.12 -0.94 -5.00 116.66 111.84 3bk7 n ARG 335 Ca -0.02 -0.10 -0.34 0.00 -1.93 0.00 0.00 57.85 55.47 3bk7 n ARG 335 Cb 0.58 -2.03 -0.12 0.00 -1.16 0.00 0.00 32.46 29.73 3bk7 n ARG 335 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3bk7 s VAL 336 N -2.47 3.91 -0.40 1.55 1.01 -1.26 -5.05 120.40 117.70 3bk7 s VAL 336 Ca 0.60 -0.34 -0.28 0.00 0.00 0.00 0.00 61.98 61.96 3bk7 s VAL 336 Cb -0.21 -2.73 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 3bk7 s VAL 336 CO 0.64 0.48 1.56 -1.81 0.00 0.00 0.00 175.10 175.98 3bk7 s ASP 337 N 0.49 6.13 -0.02 3.32 1.11 -1.26 -4.98 116.67 121.45 3bk7 s ASP 337 Ca -0.03 0.94 0.00 0.00 0.18 0.00 0.00 52.55 53.64 3bk7 s ASP 337 Cb -0.14 -2.54 0.03 0.00 1.07 0.00 0.00 42.92 41.34 3bk7 s ASP 337 CO 0.03 -1.59 0.03 0.54 1.18 0.00 0.00 175.17 175.36 3bk7 s VAL 338 N 6.12 -0.02 -0.72 -1.27 0.11 -1.26 -5.09 120.40 118.27 3bk7 s VAL 338 Ca 0.67 0.20 -0.19 0.00 -2.93 0.00 0.00 61.98 59.73 3bk7 s VAL 338 Cb -0.16 -0.11 0.12 0.00 -1.53 0.00 0.00 36.38 34.70 3bk7 s VAL 338 CO 0.32 0.10 0.87 -1.61 -3.33 0.00 0.00 175.10 171.45 3bk7 s GLU 339 N 1.06 3.27 0.62 1.54 0.41 -1.26 -5.04 118.70 119.30 3bk7 s GLU 339 Ca -0.09 -1.50 -0.12 0.00 -0.41 0.00 0.00 54.97 52.85 3bk7 s GLU 339 Cb -0.13 -4.45 -0.04 0.00 -1.78 0.00 0.00 34.13 27.73 3bk7 s GLU 339 CO -0.03 -1.62 1.03 1.03 -0.49 0.00 0.00 175.26 175.18 3bk7 s ARG 340 N 2.61 3.52 0.39 1.61 0.52 -1.26 -5.07 118.95 121.27 3bk7 s ARG 340 Ca 0.20 0.82 0.01 0.00 -0.52 0.00 0.00 55.73 56.24 3bk7 s ARG 340 Cb -0.16 -2.07 -0.02 0.00 0.52 0.00 0.00 34.95 33.22 3bk7 s ARG 340 CO 0.01 -0.63 0.59 -1.21 0.02 0.00 0.00 175.30 174.08 3bk7 s GLU 341 N -5.00 3.27 0.01 3.54 2.02 -1.26 -4.93 118.70 116.35 3bk7 s GLU 341 Ca 0.56 -0.46 -0.28 0.00 0.02 0.00 0.00 54.97 54.81 3bk7 s GLU 341 Cb -0.12 -2.63 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 3bk7 s GLU 341 CO 0.51 -0.04 0.90 0.99 0.02 0.00 0.00 175.26 177.64 3bk7 s THR 342 N -2.41 4.84 -0.16 3.63 2.01 -1.26 -0.70 115.64 121.58 3bk7 s THR 342 Ca 0.44 1.90 -0.18 0.00 0.31 0.00 0.00 61.69 64.15 3bk7 s THR 342 Cb -0.10 -4.24 -0.15 0.00 0.01 0.00 0.00 72.50 68.02 3bk7 s THR 342 CO 0.36 0.22 0.25 0.25 -0.69 0.00 0.00 174.62 175.02 3bk7 h LEU 343 N 6.50 0.00 -8.24 4.42 5.85 -0.81 -3.43 115.31 119.59 3bk7 h LEU 343 Ca -0.42 -0.47 -0.07 0.00 0.84 0.00 0.00 57.88 57.77 3bk7 h LEU 343 Cb 1.21 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 42.16 3bk7 h LEU 343 CO 0.74 1.09 -0.10 0.54 -0.34 0.00 0.00 178.44 180.37 3bk7 s VAL 344 N -2.19 0.00 0.02 1.05 0.11 -1.14 -5.00 120.40 113.25 3bk7 s VAL 344 Ca -0.20 -1.39 0.01 0.00 -2.93 0.00 0.00 61.98 57.47 3bk7 s VAL 344 Cb 0.02 -2.26 -0.02 0.00 -1.53 0.00 0.00 36.38 32.60 3bk7 s VAL 344 CO 0.47 0.00 -0.04 -0.70 -3.33 0.00 0.00 175.10 171.50 3bk7 s GLU 345 N -3.88 0.35 -0.07 1.54 2.12 -1.26 -1.73 118.70 115.77 3bk7 s GLU 345 Ca 0.22 -0.60 0.02 0.00 0.36 0.00 0.00 54.97 54.98 3bk7 s GLU 345 Cb -0.01 -0.00 0.01 0.00 0.26 0.00 0.00 34.13 34.39 3bk7 s GLU 345 CO 0.10 -0.02 -0.13 1.52 -0.54 0.00 0.00 175.26 176.19 3bk7 s TYR 346 N -1.33 1.54 1.00 5.30 -0.85 -0.50 -4.98 117.35 117.53 3bk7 s TYR 346 Ca -0.13 -0.58 -0.16 0.00 -0.52 0.00 0.00 57.07 55.68 3bk7 s TYR 346 Cb -0.09 -1.12 0.20 0.00 0.38 0.00 0.00 41.96 41.33 3bk7 s TYR 346 CO -0.01 -0.29 1.23 -1.25 -1.52 0.00 0.00 175.55 173.71 3bk7 s PRO 347 N 0.64 0.39 0.23 -3.49 0.04 -1.26 -1.51 135.00 130.04 3bk7 s PRO 347 Ca -0.15 -0.17 -0.32 0.00 0.04 0.00 0.00 61.00 60.41 3bk7 s PRO 347 Cb -0.16 -1.79 -0.13 0.00 0.04 0.00 0.00 34.50 32.46 3bk7 s PRO 347 CO 0.04 -2.62 1.56 -2.13 0.04 0.00 0.00 177.00 173.89 3bk7 n ARG 348 N -3.97 2.39 -4.45 4.56 0.63 -1.26 -4.55 116.66 110.02 3bk7 n ARG 348 Ca 0.13 0.86 -0.25 0.00 -0.92 0.00 0.00 57.85 57.67 3bk7 n ARG 348 Cb 0.60 -2.61 -0.11 0.00 0.45 0.00 0.00 32.46 30.79 3bk7 n ARG 348 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3bk7 s LEU 349 N 0.28 2.54 -0.17 6.15 1.43 -0.44 -4.21 118.68 124.26 3bk7 s LEU 349 Ca 0.70 -0.97 -0.06 0.00 -1.03 0.00 0.00 54.13 52.77 3bk7 s LEU 349 Cb -0.58 -1.09 0.08 0.00 0.03 0.00 0.00 46.19 44.62 3bk7 s LEU 349 CO 0.44 0.05 0.36 -0.69 0.23 0.00 0.00 176.35 176.74 3bk7 s VAL 350 N -2.26 -0.49 -0.18 -1.59 1.01 -0.20 0.30 120.40 116.99 3bk7 s VAL 350 Ca 0.26 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.44 3bk7 s VAL 350 Cb -0.06 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.75 3bk7 s VAL 350 CO 0.13 0.08 -0.13 -0.75 0.00 0.00 0.00 175.10 174.43 3bk7 s LYS 351 N 2.38 3.22 -0.22 2.72 2.47 -0.67 0.50 119.74 130.14 3bk7 s LYS 351 Ca -0.02 -0.73 0.01 0.00 -1.56 0.00 0.00 55.97 53.68 3bk7 s LYS 351 Cb -0.12 -2.72 0.05 0.00 -1.46 0.00 0.00 37.83 33.58 3bk7 s LYS 351 CO -0.11 -0.09 -0.10 0.34 0.16 0.00 0.00 175.35 175.55 3bk7 s ASP 352 N 1.09 3.77 0.00 1.43 3.68 -1.26 -0.97 116.67 124.41 3bk7 s ASP 352 Ca 0.00 -1.07 0.28 0.00 2.13 0.00 0.00 52.55 53.89 3bk7 s ASP 352 Cb -0.14 -1.34 1.12 0.00 -1.45 0.00 0.00 42.92 41.10 3bk7 s ASP 352 CO -0.04 -0.16 1.78 -1.22 0.13 0.00 0.00 175.17 175.66 3bk7 n TYR 353 N 4.60 0.00 0.00 -5.34 0.53 -0.22 -4.92 117.16 111.81 3bk7 n TYR 353 Ca -0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.73 3bk7 n TYR 353 Cb 0.45 -0.09 0.00 0.00 -1.03 0.00 0.00 39.34 38.67 3bk7 n TYR 353 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3bk7 n GLY 354 N 1.23 2.74 0.05 2.72 0.00 -1.26 -4.57 105.19 106.09 3bk7 n GLY 354 Ca 0.16 -0.67 0.10 0.00 0.00 0.00 0.00 46.02 45.62 3bk7 n GLY 354 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3bk7 n SER 355 N 1.93 1.08 -3.68 1.61 3.41 -1.26 -4.92 113.62 111.79 3bk7 n SER 355 Ca 0.00 -1.01 -0.10 0.00 -0.26 0.00 0.00 58.87 57.51 3bk7 n SER 355 Cb 0.00 0.89 -0.10 0.00 -0.26 0.00 0.00 64.21 64.74 3bk7 n SER 355 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3bk7 s PHE 356 N -2.94 -0.69 -0.08 7.33 5.36 -1.26 -4.69 117.98 121.00 3bk7 s PHE 356 Ca 0.09 1.44 0.03 0.00 -0.96 0.00 0.00 56.93 57.54 3bk7 s PHE 356 Cb 0.16 0.33 -0.01 0.00 -0.34 0.00 0.00 43.02 43.16 3bk7 s PHE 356 CO 0.83 -0.38 -0.19 0.21 -1.46 0.00 0.00 175.22 174.22 3bk7 s LYS 357 N 1.53 2.86 -0.01 10.12 2.20 -0.63 -1.05 119.74 134.75 3bk7 s LYS 357 Ca -0.09 -0.79 0.08 0.00 -0.36 0.00 0.00 55.97 54.81 3bk7 s LYS 357 Cb -0.08 -2.37 -0.02 0.00 -1.51 0.00 0.00 37.83 33.85 3bk7 s LYS 357 CO -0.14 0.36 -0.25 -1.17 -0.36 0.00 0.00 175.35 173.79 3bk7 s LEU 358 N -0.07 2.06 -0.03 5.43 2.96 -0.15 -1.37 118.68 127.51 3bk7 s LEU 358 Ca -0.04 -0.47 0.05 0.00 -0.22 0.00 0.00 54.13 53.44 3bk7 s LEU 358 Cb -0.14 -1.29 -0.01 0.00 0.50 0.00 0.00 46.19 45.25 3bk7 s LEU 358 CO 0.04 0.30 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.59 3bk7 s GLU 359 N -0.67 1.62 -0.20 1.98 2.02 -0.73 -1.67 118.70 121.05 3bk7 s GLU 359 Ca 0.10 -0.61 -0.02 0.00 0.02 0.00 0.00 54.97 54.47 3bk7 s GLU 359 Cb -0.10 -1.46 0.00 0.00 0.10 0.00 0.00 34.13 32.67 3bk7 s GLU 359 CO -0.01 0.29 -0.11 0.08 0.02 0.00 0.00 175.26 175.54 3bk7 s VAL 360 N -0.13 2.88 0.42 2.63 1.01 0.15 -2.23 120.40 125.13 3bk7 s VAL 360 Ca 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.06 3bk7 s VAL 360 Cb -0.10 -2.27 -0.08 0.00 0.00 0.00 0.00 36.38 33.93 3bk7 s VAL 360 CO 0.01 0.47 1.24 -1.61 0.00 0.00 0.00 175.10 175.21 3bk7 s GLU 361 N 1.30 3.91 0.44 2.72 0.41 -0.99 -1.32 118.70 125.16 3bk7 s GLU 361 Ca 0.04 1.99 -0.24 0.00 -0.41 0.00 0.00 54.97 56.34 3bk7 s GLU 361 Cb -0.14 -2.64 -0.09 0.00 -1.78 0.00 0.00 34.13 29.48 3bk7 s GLU 361 CO -0.06 -0.49 1.19 -2.30 -0.49 0.00 0.00 175.26 173.11 3bk7 n PRO 362 N -0.07 1.69 -3.53 0.39 -0.02 -1.26 -4.75 135.00 127.45 3bk7 n PRO 362 Ca 0.05 0.60 -0.11 0.00 -2.02 0.00 0.00 63.50 62.02 3bk7 n PRO 362 Cb 0.45 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.62 3bk7 n PRO 362 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3bk7 s GLY 363 N -0.66 -0.44 -0.03 -1.23 0.00 -0.57 -4.72 107.32 99.67 3bk7 s GLY 363 Ca 0.63 0.22 0.01 0.00 0.00 0.00 0.00 44.72 45.58 3bk7 s GLY 363 CO 0.56 -0.06 -0.03 1.85 0.00 0.00 0.00 173.10 175.42 3bk7 s GLU 364 N -3.78 2.76 -0.15 2.90 2.12 -1.26 -1.41 118.70 119.88 3bk7 s GLU 364 Ca 0.02 -0.58 0.00 0.00 0.36 0.00 0.00 54.97 54.77 3bk7 s GLU 364 Cb 0.00 -2.63 -0.01 0.00 0.26 0.00 0.00 34.13 31.75 3bk7 s GLU 364 CO -0.12 0.64 -0.15 0.42 -0.54 0.00 0.00 175.26 175.52 3bk7 s ILE 365 N -0.95 2.79 0.05 -3.70 -1.09 -0.71 -4.89 121.20 112.71 3bk7 s ILE 365 Ca 0.16 -0.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.85 3bk7 s ILE 365 Cb -0.11 -2.17 -0.04 0.00 -1.58 0.00 0.00 42.46 38.55 3bk7 s ILE 365 CO 0.06 0.52 0.16 -0.13 -1.23 0.00 0.00 174.94 174.31 3bk7 s ARG 366 N 0.66 3.25 0.00 2.79 0.52 -1.26 -0.15 118.95 124.76 3bk7 s ARG 366 Ca -0.08 -0.50 -0.30 0.00 -0.52 0.00 0.00 55.73 54.33 3bk7 s ARG 366 Cb -0.16 -2.94 -0.05 0.00 0.52 0.00 0.00 34.95 32.32 3bk7 s ARG 366 CO 0.02 0.61 1.32 0.21 0.02 0.00 0.00 175.30 177.48 3bk7 s LYS 367 N -2.35 4.32 0.00 3.54 2.20 0.12 -3.17 119.74 124.41 3bk7 s LYS 367 Ca 0.31 1.87 0.00 0.00 -0.36 0.00 0.00 55.97 57.79 3bk7 s LYS 367 Cb -0.13 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.68 3bk7 s LYS 367 CO 0.24 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 175.16 3bk7 n GLY 368 N 3.50 0.73 3.94 5.54 0.00 -1.26 -4.61 105.19 113.04 3bk7 n GLY 368 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 3bk7 n GLY 368 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3bk7 s GLU 369 N -0.45 2.34 -0.11 1.61 -1.05 -1.19 -4.83 118.70 115.03 3bk7 s GLU 369 Ca 0.00 -1.78 -0.02 0.00 -0.15 0.00 0.00 54.97 53.01 3bk7 s GLU 369 Cb 0.00 -2.35 0.04 0.00 -0.44 0.00 0.00 34.13 31.38 3bk7 s GLU 369 CO 0.00 -0.60 0.04 0.08 0.95 0.00 0.00 175.26 175.73 3bk7 s VAL 370 N -2.67 0.20 -0.18 1.83 1.01 -1.26 -2.01 120.40 117.32 3bk7 s VAL 370 Ca 0.46 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 62.39 3bk7 s VAL 370 Cb -0.04 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 3bk7 s VAL 370 CO 0.28 0.05 0.03 -0.63 0.00 0.00 0.00 175.10 174.84 3bk7 s ILE 371 N 2.03 4.51 -0.14 2.22 1.01 -0.62 0.43 121.20 130.64 3bk7 s ILE 371 Ca 0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 60.65 60.47 3bk7 s ILE 371 Cb -0.14 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.27 3bk7 s ILE 371 CO -0.06 0.46 0.14 -0.83 0.00 0.00 0.00 174.94 174.65 3bk7 s GLY 372 N 0.43 2.13 -0.15 6.18 0.00 -0.64 -0.87 107.32 114.40 3bk7 s GLY 372 Ca 0.01 -0.65 -0.04 0.00 0.00 0.00 0.00 44.72 44.04 3bk7 s GLY 372 CO 0.01 -0.25 -0.01 -0.42 0.00 0.00 0.00 173.10 172.43 3bk7 s ILE 373 N -0.69 4.15 0.03 0.90 1.09 0.15 -1.03 121.20 125.81 3bk7 s ILE 373 Ca 0.13 -0.27 0.01 0.00 -1.10 0.00 0.00 60.65 59.43 3bk7 s ILE 373 Cb -0.12 -2.81 -0.02 0.00 -1.06 0.00 0.00 42.46 38.45 3bk7 s ILE 373 CO 0.03 0.51 -0.06 0.68 -0.10 0.00 0.00 174.94 176.00 3bk7 s VAL 374 N 0.10 0.39 0.00 2.92 -7.23 -0.69 -2.11 120.40 113.79 3bk7 s VAL 374 Ca 0.01 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 3bk7 s VAL 374 Cb -0.13 -0.47 0.00 0.00 0.56 0.00 0.00 36.38 36.34 3bk7 s VAL 374 CO 0.02 -0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.05 3bk7 n GLY 375 N 1.65 2.76 3.73 2.32 0.00 -1.26 -1.55 105.19 112.85 3bk7 n GLY 375 Ca -0.22 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 3bk7 n GLY 375 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3bk7 s PRO 376 N -2.00 2.32 0.65 1.61 0.04 -1.26 -4.65 135.00 131.70 3bk7 s PRO 376 Ca 0.00 1.70 -0.15 0.00 0.04 0.00 0.00 61.00 62.60 3bk7 s PRO 376 Cb 0.00 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 3bk7 s PRO 376 CO 0.00 -1.69 1.09 -0.80 0.04 0.00 0.00 177.00 175.64 3bk7 s ASN 377 N -2.09 5.31 0.00 6.66 0.01 -1.26 -3.30 114.94 120.28 3bk7 s ASN 377 Ca 0.73 1.90 0.00 0.00 -0.71 0.00 0.00 52.86 54.78 3bk7 s ASN 377 Cb -0.28 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 38.84 3bk7 s ASN 377 CO 0.44 -1.49 0.00 0.61 -1.51 0.00 0.00 177.10 175.15 3bk7 n GLY 378 N -0.82 0.45 0.00 0.66 0.00 -1.26 -4.63 105.19 99.58 3bk7 n GLY 378 Ca 0.10 -0.79 0.07 0.00 0.00 0.00 0.00 46.02 45.39 3bk7 n GLY 378 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3bk7 n ILE 379 N -2.94 0.00 0.00 -0.61 0.13 -1.21 0.62 119.36 115.35 3bk7 n ILE 379 Ca 0.00 -0.24 0.00 0.00 -1.10 0.00 0.00 62.75 61.41 3bk7 n ILE 379 Cb 0.00 0.63 0.00 0.00 -0.84 0.00 0.00 39.64 39.43 3bk7 n ILE 379 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3bk7 n GLY 380 N 1.49 1.44 0.16 4.50 0.00 -1.26 -4.15 105.19 107.36 3bk7 n GLY 380 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 3bk7 n GLY 380 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bk7 h LYS 381 N 0.87 -0.30 -0.58 1.61 1.57 -1.95 -1.39 116.57 116.40 3bk7 h LYS 381 Ca 0.00 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 3bk7 h LYS 381 Cb 0.00 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 3bk7 h LYS 381 CO 0.00 -0.06 0.22 1.15 -0.57 0.00 0.00 179.45 180.19 3bk7 h THR 382 N -0.50 1.23 -0.48 -0.16 2.02 -1.99 -1.99 112.91 111.03 3bk7 h THR 382 Ca -0.03 -0.73 0.09 0.00 0.77 0.00 0.00 66.41 66.51 3bk7 h THR 382 Cb 0.38 0.61 -0.07 0.00 -1.74 0.00 0.00 68.15 67.32 3bk7 h THR 382 CO 0.05 0.28 0.04 0.74 0.37 0.00 0.00 175.52 177.00 3bk7 h THR 383 N 0.81 0.67 0.25 3.16 2.02 -1.97 0.38 112.91 118.23 3bk7 h THR 383 Ca 0.19 -0.06 0.01 0.00 0.77 0.00 0.00 66.41 67.32 3bk7 h THR 383 Cb 0.22 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 3bk7 h THR 383 CO -0.01 0.03 -0.46 0.15 0.37 0.00 0.00 175.52 175.60 3bk7 h PHE 384 N 0.16 -1.28 -0.62 3.16 3.57 -0.84 -2.56 116.94 118.52 3bk7 h PHE 384 Ca 0.24 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.88 3bk7 h PHE 384 Cb 0.35 0.53 -0.08 0.00 2.79 0.00 0.00 35.95 39.53 3bk7 h PHE 384 CO -0.27 -0.57 0.17 0.28 -2.23 0.00 0.00 178.31 175.69 3bk7 h VAL 385 N -0.78 0.67 0.00 1.41 2.07 -0.62 0.32 116.25 119.32 3bk7 h VAL 385 Ca -0.01 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 3bk7 h VAL 385 Cb 0.75 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 3bk7 h VAL 385 CO -0.19 0.06 -0.00 0.11 0.02 0.00 0.00 177.57 177.57 3bk7 h LYS 386 N 0.31 0.00 0.12 1.57 1.57 -0.64 0.58 116.57 120.08 3bk7 h LYS 386 Ca 0.33 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.83 3bk7 h LYS 386 Cb 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 3bk7 h LYS 386 CO -0.38 0.00 -1.26 0.52 -0.57 0.00 0.00 179.45 177.76 3bk7 h MET 387 N 0.00 0.24 0.00 3.15 2.86 -0.54 0.32 114.93 120.96 3bk7 h MET 387 Ca -0.00 -0.42 -0.10 0.00 -2.06 0.00 0.00 59.70 57.12 3bk7 h MET 387 Cb 0.09 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 3bk7 h MET 387 CO 0.00 1.18 -0.47 -0.07 1.06 0.00 0.00 176.91 178.61 3bk7 h LEU 388 N 0.07 0.00 0.00 1.22 4.07 -0.98 -2.62 115.31 117.06 3bk7 h LEU 388 Ca -0.14 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.76 3bk7 h LEU 388 Cb 1.96 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.69 3bk7 h LEU 388 CO 0.19 0.47 -0.34 0.00 -1.08 0.00 0.00 178.44 177.69 3bk7 h ALA 389 N 1.53 0.80 0.00 1.53 0.00 -0.95 -3.47 119.26 118.69 3bk7 h ALA 389 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3bk7 h ALA 389 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3bk7 h ALA 389 CO 0.06 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.09 3bk7 n GLY 390 N 1.18 0.79 0.21 0.00 0.00 -0.59 -4.89 105.19 101.90 3bk7 n GLY 390 Ca 0.02 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.14 3bk7 n GLY 390 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3bk7 n VAL 391 N -2.13 0.08 -3.69 1.61 0.24 -0.07 -4.68 118.33 109.70 3bk7 n VAL 391 Ca 0.00 -0.13 -0.18 0.00 -2.04 0.00 0.00 64.34 61.99 3bk7 n VAL 391 Cb 0.00 -0.03 -0.17 0.00 -1.47 0.00 0.00 33.84 32.17 3bk7 n VAL 391 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3bk7 s GLU 392 N -1.92 -0.02 0.06 7.34 2.56 -0.23 -4.96 118.70 121.54 3bk7 s GLU 392 Ca 0.30 0.43 -0.29 0.00 0.00 0.00 0.00 54.97 55.41 3bk7 s GLU 392 Cb 0.15 -0.36 -0.05 0.00 2.00 0.00 0.00 34.13 35.86 3bk7 s GLU 392 CO 0.23 -0.29 0.93 -2.00 -0.56 0.00 0.00 175.26 173.57 3bk7 s GLU 393 N 2.03 4.62 0.61 4.30 2.12 -1.26 -4.30 118.70 126.82 3bk7 s GLU 393 Ca 0.02 1.37 -0.16 0.00 0.36 0.00 0.00 54.97 56.56 3bk7 s GLU 393 Cb -0.12 -3.40 -0.03 0.00 0.26 0.00 0.00 34.13 30.84 3bk7 s GLU 393 CO -0.04 0.14 1.08 -2.14 -0.54 0.00 0.00 175.26 173.76 3bk7 s PRO 394 N 0.31 3.13 0.03 4.30 0.02 -1.26 -4.97 135.00 136.56 3bk7 s PRO 394 Ca 0.47 1.31 -0.12 0.00 0.02 0.00 0.00 61.00 62.68 3bk7 s PRO 394 Cb -0.22 -2.00 -0.34 0.00 0.02 0.00 0.00 34.50 31.96 3bk7 s PRO 394 CO 0.28 -0.98 0.98 1.15 -0.33 0.00 0.00 177.00 178.11 3bk7 h THR 395 N 0.36 1.28 -3.69 0.99 2.02 -0.32 -3.47 112.91 110.09 3bk7 h THR 395 Ca -0.47 -2.76 -0.14 0.00 0.77 0.00 0.00 66.41 63.81 3bk7 h THR 395 Cb 1.23 2.98 -0.20 0.00 -1.74 0.00 0.00 68.15 70.43 3bk7 h THR 395 CO 0.56 0.83 -0.54 -1.61 0.37 0.00 0.00 175.52 175.14 3bk7 s GLU 396 N -2.61 0.50 0.11 6.66 2.02 -0.24 -4.99 118.70 120.15 3bk7 s GLU 396 Ca -0.09 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 54.34 3bk7 s GLU 396 Cb 0.05 0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.48 3bk7 s GLU 396 CO 0.92 -0.12 0.00 0.41 0.02 0.00 0.00 175.26 176.50 3bk7 n GLY 397 N 1.22 -2.63 3.45 -1.39 0.00 -1.26 -1.04 105.19 103.54 3bk7 n GLY 397 Ca -0.22 -1.97 0.01 0.00 0.00 0.00 0.00 46.02 43.85 3bk7 n GLY 397 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3bk7 s LYS 398 N -0.39 0.23 -0.86 1.61 2.20 -1.26 -4.87 119.74 116.40 3bk7 s LYS 398 Ca 0.00 0.50 -0.04 0.00 -0.36 0.00 0.00 55.97 56.07 3bk7 s LYS 398 Cb 0.00 0.22 0.22 0.00 -1.51 0.00 0.00 37.83 36.76 3bk7 s LYS 398 CO 0.00 -0.07 0.76 0.14 -0.36 0.00 0.00 175.35 175.82 3bk7 s VAL 399 N 1.91 4.57 -0.68 4.02 -7.23 -1.26 -4.68 120.40 117.07 3bk7 s VAL 399 Ca -0.04 -3.50 -0.12 0.00 -1.81 0.00 0.00 61.98 56.51 3bk7 s VAL 399 Cb -0.04 -3.84 0.17 0.00 0.56 0.00 0.00 36.38 33.23 3bk7 s VAL 399 CO -0.16 -1.05 0.59 -1.61 -0.31 0.00 0.00 175.10 172.56 3bk7 s GLU 400 N -0.94 3.11 0.21 4.82 2.02 -1.26 -5.00 118.70 121.66 3bk7 s GLU 400 Ca 0.25 -2.21 0.09 0.00 0.02 0.00 0.00 54.97 53.12 3bk7 s GLU 400 Cb -0.11 -4.20 -0.04 0.00 0.10 0.00 0.00 34.13 29.88 3bk7 s GLU 400 CO -0.10 -1.26 -0.09 -1.58 0.02 0.00 0.00 175.26 172.25 3bk7 s TRP 401 N 0.61 2.60 -0.89 1.61 0.51 -1.26 -5.06 118.94 117.07 3bk7 s TRP 401 Ca 0.13 -0.24 -0.00 0.00 -2.12 0.00 0.00 56.10 53.87 3bk7 s TRP 401 Cb -0.19 -1.23 0.27 0.00 -0.81 0.00 0.00 33.47 31.51 3bk7 s TRP 401 CO -0.04 0.55 1.06 -0.25 -0.51 0.00 0.00 176.95 177.76 3bk7 n ASP 402 N -0.23 4.97 -4.05 2.95 10.43 -1.26 -5.01 116.55 124.36 3bk7 n ASP 402 Ca -0.09 -3.35 -0.07 0.00 2.57 0.00 0.00 54.79 53.84 3bk7 n ASP 402 Cb 0.57 -1.01 -0.10 0.00 1.84 0.00 0.00 41.12 42.42 3bk7 n ASP 402 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3bk7 s LEU 403 N -2.34 2.34 0.02 0.64 1.43 -1.26 -5.13 118.68 114.38 3bk7 s LEU 403 Ca 0.33 -0.90 -0.09 0.00 -1.03 0.00 0.00 54.13 52.45 3bk7 s LEU 403 Cb 0.05 0.28 -0.05 0.00 0.03 0.00 0.00 46.19 46.50 3bk7 s LEU 403 CO 0.01 -0.58 0.33 0.42 0.23 0.00 0.00 176.35 176.76 3bk7 s THR 404 N -3.60 5.19 0.01 5.49 -4.23 -1.26 -4.97 115.64 112.27 3bk7 s THR 404 Ca 0.04 0.40 0.07 0.00 -1.18 0.00 0.00 61.69 61.02 3bk7 s THR 404 Cb 0.05 -3.61 -0.02 0.00 1.34 0.00 0.00 72.50 70.27 3bk7 s THR 404 CO -0.09 0.40 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.48 3bk7 s VAL 405 N -1.27 1.73 -0.23 2.29 1.01 -1.26 -1.53 120.40 121.14 3bk7 s VAL 405 Ca 0.28 -1.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 3bk7 s VAL 405 Cb -0.14 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.78 3bk7 s VAL 405 CO 0.15 0.40 -0.04 0.00 0.00 0.00 0.00 175.10 175.61 3bk7 s ALA 406 N -0.61 2.79 -0.22 5.51 0.00 -0.65 -4.97 121.76 123.59 3bk7 s ALA 406 Ca 0.08 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 50.78 3bk7 s ALA 406 Cb -0.09 -1.72 0.05 0.00 0.00 0.00 0.00 23.12 21.36 3bk7 s ALA 406 CO 0.00 -0.58 -0.13 -0.47 0.00 0.00 0.00 175.76 174.58 3bk7 s TYR 407 N 1.43 2.93 -0.60 0.00 6.04 -1.26 0.92 117.35 126.82 3bk7 s TYR 407 Ca 0.04 -1.97 -0.16 0.00 0.04 0.00 0.00 57.07 55.02 3bk7 s TYR 407 Cb -0.15 -1.86 0.14 0.00 -1.04 0.00 0.00 41.96 39.05 3bk7 s TYR 407 CO -0.04 -0.83 0.57 0.21 -1.54 0.00 0.00 175.55 173.92 3bk7 s LYS 408 N 1.22 3.11 0.77 4.97 2.36 0.36 -4.97 119.74 127.56 3bk7 s LYS 408 Ca -0.03 -1.83 -0.15 0.00 -2.55 0.00 0.00 55.97 51.41 3bk7 s LYS 408 Cb -0.17 -4.33 0.05 0.00 -1.05 0.00 0.00 37.83 32.33 3bk7 s LYS 408 CO -0.08 -1.34 1.11 -0.35 1.55 0.00 0.00 175.35 176.24 3bk7 n PRO 409 N 5.09 0.38 0.06 4.03 -0.04 -1.26 -1.06 135.00 142.20 3bk7 n PRO 409 Ca -0.08 0.20 -0.11 0.00 -0.04 0.00 0.00 63.50 63.46 3bk7 n PRO 409 Cb 0.42 -2.36 -0.08 0.00 -0.04 0.00 0.00 33.50 31.43 3bk7 n PRO 409 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 3bk7 h GLN 410 N -0.56 -0.22 -4.05 0.54 4.15 -1.92 -3.40 115.11 109.64 3bk7 h GLN 410 Ca -0.47 0.02 -0.76 0.00 0.77 0.00 0.00 58.65 58.21 3bk7 h GLN 410 Cb 1.31 0.05 -0.26 0.00 0.21 0.00 0.00 27.48 28.79 3bk7 h GLN 410 CO 0.47 0.20 -0.19 0.71 -1.93 0.00 0.00 178.83 178.08 3bk7 s TYR 411 N -3.63 3.41 -0.27 3.99 1.51 -1.26 -4.97 117.35 116.12 3bk7 s TYR 411 Ca -0.13 -1.63 -0.09 0.00 -1.01 0.00 0.00 57.07 54.21 3bk7 s TYR 411 Cb 0.01 -3.72 -0.03 0.00 -0.11 0.00 0.00 41.96 38.11 3bk7 s TYR 411 CO 0.50 -1.00 0.13 -1.50 -1.11 0.00 0.00 175.55 172.57 3bk7 s ILE 412 N 1.16 4.79 -0.68 2.71 2.07 -1.26 -5.02 121.20 124.96 3bk7 s ILE 412 Ca 0.07 -0.06 -0.05 0.00 -1.41 0.00 0.00 60.65 59.20 3bk7 s ILE 412 Cb -0.24 -3.29 0.18 0.00 0.13 0.00 0.00 42.46 39.23 3bk7 s ILE 412 CO -0.01 0.26 0.52 -0.75 -1.91 0.00 0.00 174.94 173.06 3bk7 s LYS 413 N 1.68 2.83 -0.36 3.50 2.20 -1.26 -5.04 119.74 123.28 3bk7 s LYS 413 Ca 0.06 -2.54 -0.40 0.00 -0.36 0.00 0.00 55.97 52.73 3bk7 s LYS 413 Cb -0.16 -3.90 -0.15 0.00 -1.51 0.00 0.00 37.83 32.11 3bk7 s LYS 413 CO 0.07 -1.20 1.94 0.00 -0.36 0.00 0.00 175.35 175.80 3bk7 n ALA 414 N 3.55 0.16 -3.37 3.13 0.00 -1.26 -4.91 120.51 117.81 3bk7 n ALA 414 Ca 0.10 0.23 -0.25 0.00 0.00 0.00 0.00 53.44 53.51 3bk7 n ALA 414 Cb 0.40 -2.26 -0.10 0.00 0.00 0.00 0.00 19.45 17.49 3bk7 n ALA 414 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3bk7 s GLU 415 N 4.77 0.79 -0.27 0.00 2.56 -1.26 -4.71 118.70 120.58 3bk7 s GLU 415 Ca 1.07 -1.70 -0.06 0.00 0.00 0.00 0.00 54.97 54.28 3bk7 s GLU 415 Cb -1.13 -1.22 0.14 0.00 2.00 0.00 0.00 34.13 33.92 3bk7 s GLU 415 CO 0.63 -1.32 0.55 -0.47 -0.56 0.00 0.00 175.26 174.09 3bk7 s TYR 416 N 0.53 -1.24 -0.96 5.30 5.04 -1.26 -5.10 117.35 119.66 3bk7 s TYR 416 Ca 0.27 1.78 -0.24 0.00 -2.44 0.00 0.00 57.07 56.44 3bk7 s TYR 416 Cb -0.06 0.53 0.03 0.00 0.35 0.00 0.00 41.96 42.81 3bk7 s TYR 416 CO -0.11 -0.70 1.53 -2.00 -1.34 0.00 0.00 175.55 172.93 3bk7 s GLU 417 N 2.78 3.34 -0.07 4.97 2.56 -1.26 -4.03 118.70 126.99 3bk7 s GLU 417 Ca 0.06 -0.83 -0.27 0.00 0.00 0.00 0.00 54.97 53.93 3bk7 s GLU 417 Cb -0.13 -5.15 0.09 0.00 2.00 0.00 0.00 34.13 30.93 3bk7 s GLU 417 CO -0.18 -2.43 1.21 0.41 -0.56 0.00 0.00 175.26 173.71 3bk7 n GLY 418 N 6.69 0.16 3.97 -1.50 0.00 -1.26 -5.05 105.19 108.20 3bk7 n GLY 418 Ca 0.31 -1.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.12 3bk7 n GLY 418 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3bk7 s THR 419 N -2.01 4.37 0.14 2.61 -4.23 -1.26 -0.17 115.64 115.08 3bk7 s THR 419 Ca 0.29 -0.83 -0.18 0.00 -1.18 0.00 0.00 61.69 59.79 3bk7 s THR 419 Cb -0.00 -3.55 -0.03 0.00 1.34 0.00 0.00 72.50 70.26 3bk7 s THR 419 CO -0.02 -0.27 1.78 0.58 -0.54 0.00 0.00 174.62 176.16 3bk7 h VAL 420 N 0.81 1.04 -0.82 2.29 2.07 -1.23 -1.79 116.25 118.62 3bk7 h VAL 420 Ca -0.47 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 66.96 3bk7 h VAL 420 Cb 1.25 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.63 3bk7 h VAL 420 CO 0.56 0.06 0.54 0.22 0.02 0.00 0.00 177.57 178.97 3bk7 h TYR 421 N 0.35 0.98 0.71 1.57 5.03 -1.76 -0.72 116.97 123.12 3bk7 h TYR 421 Ca 0.11 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.41 3bk7 h TYR 421 Cb -0.01 -0.33 0.00 0.00 1.55 0.00 0.00 36.73 37.95 3bk7 h TYR 421 CO -0.07 0.57 -0.38 1.49 -1.32 0.00 0.00 178.16 178.45 3bk7 h GLU 422 N 1.01 -0.96 -0.44 1.82 4.81 -1.69 0.32 114.58 119.45 3bk7 h GLU 422 Ca 0.33 0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.69 3bk7 h GLU 422 Cb 0.04 0.22 -0.06 0.00 0.63 0.00 0.00 28.75 29.58 3bk7 h GLU 422 CO -0.10 -0.64 0.07 1.25 -0.73 0.00 0.00 179.01 178.86 3bk7 h LEU 423 N -1.00 -0.04 -0.09 1.64 5.85 -0.82 -2.22 115.31 118.63 3bk7 h LEU 423 Ca -0.09 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 3bk7 h LEU 423 Cb 0.79 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.94 3bk7 h LEU 423 CO 0.13 0.01 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.98 3bk7 h LEU 424 N 0.19 0.34 -1.59 2.25 3.38 -1.11 -3.15 115.31 115.62 3bk7 h LEU 424 Ca 0.21 -0.57 0.14 0.00 0.09 0.00 0.00 57.88 57.76 3bk7 h LEU 424 Cb 0.28 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 3bk7 h LEU 424 CO -0.30 0.84 0.48 0.77 0.09 0.00 0.00 178.44 180.32 3bk7 h SER 425 N -0.15 0.38 0.51 -0.43 4.64 -0.84 0.37 113.55 118.04 3bk7 h SER 425 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3bk7 h SER 425 Cb 0.79 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 3bk7 h SER 425 CO 0.04 0.21 0.00 0.29 -0.87 0.00 0.00 176.83 176.50 3bk7 n LYS 426 N -4.47 0.22 -0.11 4.77 5.02 -0.84 -2.19 118.16 120.55 3bk7 n LYS 426 Ca 0.13 0.10 -0.21 0.00 -2.02 0.00 0.00 58.31 56.31 3bk7 n LYS 426 Cb 0.50 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.92 3bk7 n LYS 426 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3bk7 n ILE 427 N -1.35 1.51 -2.77 -0.18 5.41 0.13 -4.91 119.36 117.19 3bk7 n ILE 427 Ca 0.09 -0.10 -0.04 0.00 1.00 0.00 0.00 62.75 63.70 3bk7 n ILE 427 Cb 0.20 -2.06 0.01 0.00 -0.71 0.00 0.00 39.64 37.08 3bk7 n ILE 427 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3bk7 s ASP 428 N -6.85 -1.36 0.35 4.38 -1.08 -0.93 -5.02 116.67 106.17 3bk7 s ASP 428 Ca -0.31 -1.58 0.12 0.00 -0.52 0.00 0.00 52.55 50.26 3bk7 s ASP 428 Cb 0.08 1.78 0.93 0.00 -1.46 0.00 0.00 42.92 44.25 3bk7 s ASP 428 CO 0.49 -0.05 1.79 0.28 0.52 0.00 0.00 175.17 178.20 3bk7 h SER 429 N 5.02 0.60 0.19 -0.34 0.02 -1.66 -2.18 113.55 115.22 3bk7 h SER 429 Ca 0.05 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3bk7 h SER 429 Cb 1.12 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 3bk7 h SER 429 CO 0.00 0.18 -0.12 0.77 -1.14 0.00 0.00 176.83 176.53 3bk7 h SER 430 N 0.57 -0.29 -0.95 3.07 4.64 -1.95 -2.66 113.55 115.98 3bk7 h SER 430 Ca 0.57 0.02 0.17 0.00 -0.47 0.00 0.00 61.79 62.07 3bk7 h SER 430 Cb 1.16 0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 63.25 3bk7 h SER 430 CO -0.32 -0.19 0.60 0.11 -0.87 0.00 0.00 176.83 176.16 3bk7 h LYS 431 N -0.30 0.69 -0.07 4.77 1.57 -1.80 0.31 116.57 121.74 3bk7 h LYS 431 Ca -0.02 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3bk7 h LYS 431 Cb 0.25 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 3bk7 h LYS 431 CO 0.02 0.45 0.08 -0.07 -0.57 0.00 0.00 179.45 179.37 3bk7 h LEU 432 N 0.71 0.00 -0.54 2.94 3.38 -1.34 0.82 115.31 121.27 3bk7 h LEU 432 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.47 3bk7 h LEU 432 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 3bk7 h LEU 432 CO -0.27 0.00 -0.53 0.59 0.09 0.00 0.00 178.44 178.33 3bk7 n ASN 433 N -3.80 1.37 -4.73 -0.43 4.13 0.10 -4.77 115.26 107.12 3bk7 n ASN 433 Ca -0.01 -1.09 -0.42 0.00 1.68 0.00 0.00 54.58 54.74 3bk7 n ASN 433 Cb 0.18 0.46 -0.03 0.00 -1.54 0.00 0.00 39.78 38.86 3bk7 n ASN 433 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3bk7 s SER 434 N -2.65 6.77 0.49 6.41 0.15 0.28 -4.89 113.70 120.26 3bk7 s SER 434 Ca 0.17 2.50 0.27 0.00 0.70 0.00 0.00 55.95 59.60 3bk7 s SER 434 Cb 0.18 -2.61 1.21 0.00 -1.71 0.00 0.00 66.02 63.09 3bk7 s SER 434 CO 0.63 -0.64 1.95 -1.13 1.20 0.00 0.00 173.24 175.26 3bk7 h ASN 435 N 5.60 0.00 0.03 5.45 -1.24 -1.93 -2.02 115.58 121.47 3bk7 h ASN 435 Ca -0.45 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 56.43 3bk7 h ASN 435 Cb 1.21 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.28 3bk7 h ASN 435 CO 0.80 0.15 -0.56 0.15 -1.29 0.00 0.00 177.43 176.68 3bk7 h PHE 436 N 0.00 0.50 0.00 0.67 3.57 -1.91 -2.70 116.94 117.06 3bk7 h PHE 436 Ca -0.00 -0.30 -0.12 0.00 3.53 0.00 0.00 57.97 61.09 3bk7 h PHE 436 Cb 0.56 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 3bk7 h PHE 436 CO 0.00 1.14 -0.56 1.88 -2.23 0.00 0.00 178.31 178.54 3bk7 h TYR 437 N -0.29 0.00 -0.00 0.41 0.05 -1.76 -0.25 116.97 115.13 3bk7 h TYR 437 Ca -0.08 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.50 3bk7 h TYR 437 Cb 1.32 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.05 3bk7 h TYR 437 CO 0.17 0.56 -0.87 0.87 -1.05 0.00 0.00 178.16 177.84 3bk7 h LYS 438 N 0.00 0.23 0.08 4.88 1.57 -1.47 0.21 116.57 122.06 3bk7 h LYS 438 Ca -0.01 -0.24 -0.25 0.00 -1.87 0.00 0.00 60.65 58.28 3bk7 h LYS 438 Cb 1.03 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 3bk7 h LYS 438 CO 0.07 0.96 -1.15 1.15 -0.57 0.00 0.00 179.45 179.91 3bk7 h THR 439 N 0.13 1.58 0.00 -0.16 2.02 -1.34 0.39 112.91 115.53 3bk7 h THR 439 Ca -0.05 -3.18 -0.03 0.00 0.77 0.00 0.00 66.41 63.92 3bk7 h THR 439 Cb 1.49 2.90 -0.01 0.00 -1.74 0.00 0.00 68.15 70.80 3bk7 h THR 439 CO 0.13 0.92 -1.84 -0.62 0.37 0.00 0.00 175.52 174.49 3bk7 n GLU 440 N -3.47 0.62 0.00 6.66 -0.58 -0.12 -4.56 120.64 119.19 3bk7 n GLU 440 Ca -0.05 -0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.54 3bk7 n GLU 440 Cb 0.99 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.44 3bk7 n GLU 440 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3bk7 n LEU 441 N -2.16 0.00 -0.05 -4.62 0.00 -0.45 -4.41 117.00 105.30 3bk7 n LEU 441 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 56.01 55.85 3bk7 n LEU 441 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 43.42 43.89 3bk7 n LEU 441 CO 0.37 -0.46 0.60 -0.07 0.00 0.00 0.00 177.39 177.83 3bk7 h LEU 442 N 0.00 -1.25 -0.05 -1.96 3.38 -1.15 -2.37 115.31 111.92 3bk7 h LEU 442 Ca 0.00 0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 3bk7 h LEU 442 Cb 0.00 0.53 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3bk7 h LEU 442 CO 0.00 -0.38 -0.10 0.11 0.09 0.00 0.00 178.44 178.16 3bk7 h LYS 443 N -0.39 0.15 -0.95 1.13 1.57 -1.14 -1.40 116.57 115.55 3bk7 h LYS 443 Ca 0.11 -0.10 0.18 0.00 -1.87 0.00 0.00 60.65 58.97 3bk7 h LYS 443 Cb 0.59 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.83 3bk7 h LYS 443 CO -0.46 0.68 0.60 -1.35 -0.57 0.00 0.00 179.45 178.35 3bk7 h PRO 444 N -0.35 0.63 0.00 3.15 0.11 -1.73 -1.02 132.00 132.78 3bk7 h PRO 444 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3bk7 h PRO 444 Cb 0.68 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.64 3bk7 h PRO 444 CO 0.02 0.42 -0.57 1.28 -0.21 0.00 0.00 178.00 178.94 3bk7 n LEU 445 N -4.61 0.55 -1.34 2.35 4.32 -0.90 -4.88 117.00 112.49 3bk7 n LEU 445 Ca 0.20 0.08 -0.04 0.00 -0.02 0.00 0.00 56.01 56.23 3bk7 n LEU 445 Cb 0.57 -0.22 0.02 0.00 -1.62 0.00 0.00 43.42 42.17 3bk7 n LEU 445 CO 0.27 0.06 0.03 0.61 -1.22 0.00 0.00 177.39 177.14 3bk7 n GLY 446 N 1.44 0.42 0.22 -0.72 0.00 -0.39 -4.95 105.19 101.21 3bk7 n GLY 446 Ca 0.05 -0.41 0.12 0.00 0.00 0.00 0.00 46.02 45.77 3bk7 n GLY 446 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3bk7 n ILE 447 N -2.04 0.00 0.03 -0.61 -0.00 -0.56 -3.99 119.36 112.19 3bk7 n ILE 447 Ca -0.04 -0.11 -0.19 0.00 -0.00 0.00 0.00 62.75 62.41 3bk7 n ILE 447 Cb 0.53 0.64 -0.14 0.00 -0.00 0.00 0.00 39.64 40.67 3bk7 n ILE 447 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 3bk7 h ILE 448 N 1.07 1.52 0.00 1.39 1.08 -1.92 -2.41 117.51 118.25 3bk7 h ILE 448 Ca 0.00 -2.45 0.00 0.00 -0.39 0.00 0.00 64.86 62.02 3bk7 h ILE 448 Cb 0.56 3.13 0.00 0.00 -3.07 0.00 0.00 36.82 37.44 3bk7 h ILE 448 CO 0.00 0.69 0.00 0.47 -0.69 0.00 0.00 178.15 178.62 3bk7 n ASP 449 N -4.18 0.00 0.00 1.72 8.00 -1.26 -2.00 116.55 118.84 3bk7 n ASP 449 Ca -0.13 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.71 3bk7 n ASP 449 Cb 0.77 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 3bk7 n ASP 449 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3bk7 n LEU 450 N -0.77 0.00 -0.29 0.64 4.77 -1.16 -4.81 117.00 115.38 3bk7 n LEU 450 Ca 0.06 -0.42 0.08 0.00 -0.03 0.00 0.00 56.01 55.70 3bk7 n LEU 450 Cb 0.03 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.32 3bk7 n LEU 450 CO 0.05 0.00 0.81 1.88 -1.33 0.00 0.00 177.39 178.79 3bk7 h TYR 451 N 0.00 -0.08 0.00 -1.77 0.05 -0.88 -1.80 116.97 112.49 3bk7 h TYR 451 Ca 0.00 0.06 -0.09 0.00 0.05 0.00 0.00 58.73 58.75 3bk7 h TYR 451 Cb 0.00 0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 3bk7 h TYR 451 CO 0.00 -0.31 -0.42 0.38 -1.05 0.00 0.00 178.16 176.76 3bk7 h ASP 452 N 0.07 0.00 -4.17 3.88 2.03 -1.87 -2.69 116.42 113.67 3bk7 h ASP 452 Ca 0.48 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 56.25 3bk7 h ASP 452 Cb 0.88 0.00 0.14 0.00 -0.83 0.00 0.00 39.33 39.52 3bk7 h ASP 452 CO -0.77 0.42 0.39 -0.13 -1.03 0.00 0.00 179.24 178.13 3bk7 s ARG 453 N -4.03 2.41 0.20 4.15 1.81 -0.68 -4.81 118.95 118.00 3bk7 s ARG 453 Ca -0.02 1.66 -0.21 0.00 -1.72 0.00 0.00 55.73 55.44 3bk7 s ARG 453 Cb 0.14 -1.88 -0.08 0.00 -0.45 0.00 0.00 34.95 32.68 3bk7 s ARG 453 CO 0.73 -1.61 0.72 -0.80 -0.68 0.00 0.00 175.30 173.66 3bk7 s ASN 454 N -2.14 7.12 0.18 0.23 0.01 -1.26 -2.18 114.94 116.89 3bk7 s ASN 454 Ca 0.72 1.44 -0.13 0.00 -0.71 0.00 0.00 52.86 54.18 3bk7 s ASN 454 Cb -0.27 -2.43 0.14 0.00 0.41 0.00 0.00 41.25 39.10 3bk7 s ASN 454 CO 0.43 0.09 1.76 0.58 -1.51 0.00 0.00 177.10 178.45 3bk7 h VAL 455 N 2.93 0.89 0.00 1.60 2.07 -0.77 -0.70 116.25 122.27 3bk7 h VAL 455 Ca -0.48 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 3bk7 h VAL 455 Cb 1.20 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3bk7 h VAL 455 CO 0.65 0.07 -0.07 -0.33 0.02 0.00 0.00 177.57 177.91 3bk7 h GLU 456 N 0.39 0.00 -0.69 1.57 5.08 -1.80 -2.55 114.58 116.58 3bk7 h GLU 456 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3bk7 h GLU 456 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3bk7 h GLU 456 CO -0.20 0.07 0.00 -0.25 -1.00 0.00 0.00 179.01 177.63 3bk7 n ASP 457 N -3.64 3.72 -4.90 1.42 8.00 -0.28 -4.94 116.55 115.93 3bk7 n ASP 457 Ca -0.02 -2.48 -0.29 0.00 0.71 0.00 0.00 54.79 52.70 3bk7 n ASP 457 Cb 0.18 -0.57 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 3bk7 n ASP 457 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3bk7 s LEU 458 N -1.60 4.08 0.51 0.64 2.96 -0.96 -4.85 118.68 119.46 3bk7 s LEU 458 Ca 0.34 0.75 -0.01 0.00 -0.22 0.00 0.00 54.13 54.98 3bk7 s LEU 458 Cb 0.24 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.39 3bk7 s LEU 458 CO 0.12 -0.17 0.76 -0.94 -1.32 0.00 0.00 176.35 174.80 3bk7 s SER 459 N -3.00 5.61 0.23 3.68 1.04 -1.26 -4.79 113.70 115.22 3bk7 s SER 459 Ca 0.44 0.33 -0.13 0.00 0.48 0.00 0.00 55.95 57.07 3bk7 s SER 459 Cb -0.11 -1.41 0.29 0.00 0.10 0.00 0.00 66.02 64.89 3bk7 s SER 459 CO 0.28 -0.92 1.59 1.23 0.98 0.00 0.00 173.24 176.40 3bk7 h GLY 460 N 0.15 0.40 1.30 7.32 0.00 -1.99 0.23 103.07 110.50 3bk7 h GLY 460 Ca -0.45 0.32 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 3bk7 h GLY 460 CO 0.57 -0.28 -0.23 -1.33 0.00 0.00 0.00 176.54 175.27 3bk7 h GLY 461 N -0.03 0.86 0.61 4.60 0.00 -1.87 -2.11 103.07 105.13 3bk7 h GLY 461 Ca 0.35 -0.75 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 3bk7 h GLY 461 CO -0.82 0.68 -0.15 0.83 0.00 0.00 0.00 176.54 177.08 3bk7 h GLU 462 N 0.69 -0.40 -1.03 4.80 5.08 -1.59 -2.67 114.58 119.46 3bk7 h GLU 462 Ca 0.09 0.03 0.26 0.00 -1.00 0.00 0.00 59.36 58.74 3bk7 h GLU 462 Cb 0.75 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.98 3bk7 h GLU 462 CO 0.06 -0.07 0.63 1.25 -1.00 0.00 0.00 179.01 179.87 3bk7 h LEU 463 N -0.81 0.58 0.04 1.33 5.85 -0.62 0.27 115.31 121.94 3bk7 h LEU 463 Ca -0.04 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3bk7 h LEU 463 Cb 0.52 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.58 3bk7 h LEU 463 CO 0.07 0.07 -0.02 -0.61 -0.34 0.00 0.00 178.44 177.61 3bk7 h GLN 464 N 0.49 -0.05 -0.71 1.25 5.75 -1.28 -0.46 115.11 120.10 3bk7 h GLN 464 Ca 0.64 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 59.12 3bk7 h GLN 464 Cb 1.39 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.92 3bk7 h GLN 464 CO -0.42 -0.02 0.33 0.00 -2.65 0.00 0.00 178.83 176.07 3bk7 h ARG 465 N -0.07 1.01 -0.20 1.69 3.08 -0.19 -0.75 114.38 118.94 3bk7 h ARG 465 Ca -0.01 -0.14 -0.19 0.00 0.07 0.00 0.00 59.98 59.71 3bk7 h ARG 465 Cb 0.05 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.92 3bk7 h ARG 465 CO 0.01 0.79 -0.64 0.28 -1.07 0.00 0.00 179.97 179.34 3bk7 h VAL 466 N 1.01 1.30 0.42 2.04 2.07 -0.91 -0.91 116.25 121.26 3bk7 h VAL 466 Ca 0.24 -1.86 -0.02 0.00 0.82 0.00 0.00 66.70 65.88 3bk7 h VAL 466 Cb 0.12 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3bk7 h VAL 466 CO -0.03 0.59 -0.20 0.00 0.02 0.00 0.00 177.57 177.95 3bk7 h ALA 467 N 0.74 -0.57 -0.54 1.67 0.00 -0.85 0.46 119.26 120.17 3bk7 h ALA 467 Ca -0.01 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.85 3bk7 h ALA 467 Cb 1.23 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 19.16 3bk7 h ALA 467 CO 0.13 -0.75 -0.00 0.82 0.00 0.00 0.00 179.25 179.44 3bk7 h ILE 468 N -0.70 0.57 -0.54 0.00 2.04 -1.14 0.27 117.51 118.01 3bk7 h ILE 468 Ca -0.06 -0.04 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 3bk7 h ILE 468 Cb 0.51 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3bk7 h ILE 468 CO 0.10 0.02 0.11 0.00 0.00 0.00 0.00 178.15 178.38 3bk7 h ALA 469 N 1.48 1.19 0.23 1.87 0.00 -0.96 -1.41 119.26 121.67 3bk7 h ALA 469 Ca 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3bk7 h ALA 469 Cb 0.42 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3bk7 h ALA 469 CO -0.45 0.55 -0.11 0.00 0.00 0.00 0.00 179.25 179.23 3bk7 h ALA 470 N 1.32 -0.31 -0.32 0.00 0.00 0.21 -2.26 119.26 117.91 3bk7 h ALA 470 Ca 0.17 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.03 3bk7 h ALA 470 Cb 0.32 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 3bk7 h ALA 470 CO 0.00 -0.61 -0.08 1.15 0.00 0.00 0.00 179.25 179.71 3bk7 h THR 471 N -0.45 0.68 0.00 0.00 2.02 -0.39 -2.32 112.91 112.45 3bk7 h THR 471 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3bk7 h THR 471 Cb 0.34 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 3bk7 h THR 471 CO 0.05 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.12 3bk7 n LEU 472 N -5.26 0.00 -0.66 2.58 4.77 -0.55 -2.48 117.00 115.40 3bk7 n LEU 472 Ca 0.00 0.39 0.13 0.00 -0.03 0.00 0.00 56.01 56.50 3bk7 n LEU 472 Cb 0.18 -0.39 0.38 0.00 -2.33 0.00 0.00 43.42 41.26 3bk7 n LEU 472 CO 0.19 -0.15 0.78 0.18 -1.33 0.00 0.00 177.39 177.06 3bk7 n LEU 473 N -1.39 2.03 -4.94 2.23 4.77 -0.86 -4.92 117.00 113.92 3bk7 n LEU 473 Ca 0.07 -0.73 -0.24 0.00 -0.03 0.00 0.00 56.01 55.08 3bk7 n LEU 473 Cb 0.18 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 3bk7 n LEU 473 CO 0.16 0.36 0.07 -0.13 -1.33 0.00 0.00 177.39 176.52 3bk7 s ARG 474 N -1.92 3.49 -0.42 3.23 0.52 -1.04 -4.72 118.95 118.09 3bk7 s ARG 474 Ca 0.35 -0.44 -0.09 0.00 -0.52 0.00 0.00 55.73 55.02 3bk7 s ARG 474 Cb 0.20 -2.78 0.08 0.00 0.52 0.00 0.00 34.95 32.97 3bk7 s ARG 474 CO 0.31 0.30 0.27 0.34 0.02 0.00 0.00 175.30 176.55 3bk7 s ASP 475 N -3.73 5.67 0.34 0.23 2.15 -1.26 -5.05 116.67 115.01 3bk7 s ASP 475 Ca 0.38 -1.51 0.03 0.00 0.43 0.00 0.00 52.55 51.88 3bk7 s ASP 475 Cb -0.10 -2.00 -0.04 0.00 -0.30 0.00 0.00 42.92 40.48 3bk7 s ASP 475 CO 0.32 -0.55 0.12 0.00 -0.17 0.00 0.00 175.17 174.89 3bk7 s ALA 476 N 1.43 2.34 0.01 3.66 0.00 -1.26 -4.96 121.76 122.98 3bk7 s ALA 476 Ca 0.03 -1.67 0.05 0.00 0.00 0.00 0.00 51.96 50.37 3bk7 s ALA 476 Cb -0.23 0.89 -0.24 0.00 0.00 0.00 0.00 23.12 23.54 3bk7 s ALA 476 CO 0.02 -0.40 0.87 -0.44 0.00 0.00 0.00 175.76 175.82 3bk7 h ASP 477 N 2.07 0.15 -3.89 0.00 3.32 -1.65 -3.47 116.42 112.96 3bk7 h ASP 477 Ca -0.36 -0.23 -0.20 0.00 0.02 0.00 0.00 57.03 56.26 3bk7 h ASP 477 Cb 1.26 -0.05 -0.26 0.00 0.22 0.00 0.00 39.33 40.49 3bk7 h ASP 477 CO 0.59 1.19 -0.62 -0.51 -1.72 0.00 0.00 179.24 178.18 3bk7 s ILE 478 N -2.63 0.01 -0.11 0.35 2.07 -1.14 -3.47 121.20 116.28 3bk7 s ILE 478 Ca -0.06 -0.08 0.02 0.00 -1.41 0.00 0.00 60.65 59.12 3bk7 s ILE 478 Cb 0.08 -0.15 -0.01 0.00 0.13 0.00 0.00 42.46 42.51 3bk7 s ILE 478 CO 0.83 -0.05 -0.16 -0.31 -1.91 0.00 0.00 174.94 173.34 3bk7 s TYR 479 N -0.11 2.72 -0.23 3.50 1.51 -0.38 -1.64 117.35 122.72 3bk7 s TYR 479 Ca -0.02 -0.64 0.01 0.00 -1.01 0.00 0.00 57.07 55.41 3bk7 s TYR 479 Cb -0.01 -1.77 0.03 0.00 -0.11 0.00 0.00 41.96 40.10 3bk7 s TYR 479 CO 0.00 -0.18 -0.13 -0.51 -1.11 0.00 0.00 175.55 173.62 3bk7 s LEU 480 N 0.13 2.88 -0.25 -1.29 1.43 0.26 -0.97 118.68 120.87 3bk7 s LEU 480 Ca -0.08 -0.95 0.01 0.00 -1.03 0.00 0.00 54.13 52.08 3bk7 s LEU 480 Cb -0.15 -1.56 0.05 0.00 0.03 0.00 0.00 46.19 44.55 3bk7 s LEU 480 CO 0.05 -0.10 -0.10 -0.76 0.23 0.00 0.00 176.35 175.67 3bk7 s LEU 481 N 1.24 3.27 -0.57 1.79 1.43 -0.95 0.13 118.68 125.03 3bk7 s LEU 481 Ca -0.01 -1.19 -0.19 0.00 -1.03 0.00 0.00 54.13 51.72 3bk7 s LEU 481 Cb -0.16 -1.58 0.10 0.00 0.03 0.00 0.00 46.19 44.58 3bk7 s LEU 481 CO -0.08 -0.16 0.67 -0.62 0.23 0.00 0.00 176.35 176.39 3bk7 s ASP 482 N 1.19 6.19 -0.58 2.29 -1.08 -0.22 -1.94 116.67 122.51 3bk7 s ASP 482 Ca -0.05 -1.39 -0.10 0.00 -0.52 0.00 0.00 52.55 50.49 3bk7 s ASP 482 Cb -0.18 -2.29 0.01 0.00 -1.46 0.00 0.00 42.92 39.00 3bk7 s ASP 482 CO -0.06 -1.06 0.64 -0.62 0.52 0.00 0.00 175.17 174.60 3bk7 n GLU 483 N 6.20 -1.88 -0.02 4.34 1.02 -0.70 -3.62 120.64 125.98 3bk7 n GLU 483 Ca -0.10 1.76 -0.12 0.00 -0.02 0.00 0.00 57.16 58.68 3bk7 n GLU 483 Cb 0.43 -5.32 0.01 0.00 -0.02 0.00 0.00 31.44 26.53 3bk7 n GLU 483 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3bk7 h PRO 484 N 1.26 0.66 0.00 3.49 0.11 -1.83 -3.31 132.00 132.37 3bk7 h PRO 484 Ca -0.07 -0.45 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3bk7 h PRO 484 Cb 1.05 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3bk7 h PRO 484 CO 0.25 1.07 0.00 0.66 -0.21 0.00 0.00 178.00 179.77 3bk7 h SER 485 N 0.49 0.00 -2.56 -2.05 4.64 -1.93 -3.44 113.55 108.70 3bk7 h SER 485 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 3bk7 h SER 485 Cb 1.19 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.31 3bk7 h SER 485 CO 0.12 0.00 1.10 0.00 -0.87 0.00 0.00 176.83 177.18 3bk7 s ALA 486 N -3.57 3.75 0.00 5.18 0.00 -1.25 -2.01 121.76 123.87 3bk7 s ALA 486 Ca -0.02 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3bk7 s ALA 486 Cb 0.07 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.44 3bk7 s ALA 486 CO 0.25 -1.21 0.00 0.66 0.00 0.00 0.00 175.76 175.47 3bk7 n TYR 487 N 5.65 0.00 -3.81 0.00 4.01 -1.26 -4.80 117.16 116.95 3bk7 n TYR 487 Ca 0.17 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.56 3bk7 n TYR 487 Cb 0.38 -0.18 -0.07 0.00 -0.31 0.00 0.00 39.34 39.17 3bk7 n TYR 487 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3bk7 s LEU 488 N 0.00 4.27 1.06 7.72 1.43 -0.85 -4.23 118.68 128.09 3bk7 s LEU 488 Ca 0.00 0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 53.27 3bk7 s LEU 488 Cb 0.00 -2.07 0.22 0.00 0.03 0.00 0.00 46.19 44.37 3bk7 s LEU 488 CO 0.00 0.29 1.15 1.51 0.23 0.00 0.00 176.35 179.53 3bk7 s ASP 489 N -0.28 2.19 0.18 2.29 1.47 -1.26 -4.76 116.67 116.50 3bk7 s ASP 489 Ca 0.11 0.73 -0.14 0.00 1.18 0.00 0.00 52.55 54.43 3bk7 s ASP 489 Cb -0.11 -1.08 0.17 0.00 -0.34 0.00 0.00 42.92 41.56 3bk7 s ASP 489 CO 0.01 -3.35 1.70 1.62 0.68 0.00 0.00 175.17 175.82 3bk7 h VAL 490 N -2.05 0.67 -0.75 2.11 3.04 -1.82 -2.55 116.25 114.90 3bk7 h VAL 490 Ca -0.48 -0.05 -0.02 0.00 -1.01 0.00 0.00 66.70 65.14 3bk7 h VAL 490 Cb 1.30 0.50 -0.04 0.00 -2.01 0.00 0.00 31.29 31.04 3bk7 h VAL 490 CO 0.45 0.03 0.38 -0.08 -1.01 0.00 0.00 177.57 177.34 3bk7 h GLU 491 N 0.15 1.06 -0.11 4.17 4.57 -1.92 -2.78 114.58 119.71 3bk7 h GLU 491 Ca 0.24 -0.13 -0.12 0.00 -1.18 0.00 0.00 59.36 58.17 3bk7 h GLU 491 Cb 0.34 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 3bk7 h GLU 491 CO -0.37 0.80 -0.44 1.96 -1.18 0.00 0.00 179.01 179.78 3bk7 h GLN 492 N 1.06 0.27 -0.45 1.92 4.20 -1.82 -2.10 115.11 118.19 3bk7 h GLN 492 Ca 0.26 -0.14 -0.08 0.00 0.06 0.00 0.00 58.65 58.76 3bk7 h GLN 492 Cb 0.07 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3bk7 h GLN 492 CO -0.04 0.67 -0.03 0.00 -0.67 0.00 0.00 178.83 178.76 3bk7 h ARG 493 N 0.22 0.81 -0.20 1.46 3.08 -1.22 -1.91 114.38 116.62 3bk7 h ARG 493 Ca 0.02 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 3bk7 h ARG 493 Cb 0.87 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 3bk7 h ARG 493 CO 0.07 0.88 0.08 -0.07 -1.07 0.00 0.00 179.97 179.87 3bk7 h LEU 494 N 0.65 0.27 -1.22 3.04 3.38 -1.35 -1.15 115.31 118.93 3bk7 h LEU 494 Ca 0.12 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.97 3bk7 h LEU 494 Cb 0.54 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 3bk7 h LEU 494 CO 0.03 0.35 0.54 0.00 0.09 0.00 0.00 178.44 179.44 3bk7 h ALA 495 N 0.93 1.48 0.00 1.53 0.00 -1.27 -1.29 119.26 120.64 3bk7 h ALA 495 Ca 0.07 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 3bk7 h ALA 495 Cb 0.16 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3bk7 h ALA 495 CO -0.01 0.45 -0.61 0.28 0.00 0.00 0.00 179.25 179.37 3bk7 h VAL 496 N 1.04 1.44 -0.11 0.00 2.07 -1.12 -1.03 116.25 118.53 3bk7 h VAL 496 Ca 0.32 -2.10 -0.06 0.00 0.82 0.00 0.00 66.70 65.67 3bk7 h VAL 496 Cb -0.01 2.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 3bk7 h VAL 496 CO -0.09 0.60 -0.17 0.28 0.02 0.00 0.00 177.57 178.21 3bk7 h SER 497 N 0.00 0.35 -0.40 0.57 0.02 -0.29 -0.86 113.55 112.95 3bk7 h SER 497 Ca -0.01 -0.53 -0.06 0.00 -0.84 0.00 0.00 61.79 60.35 3bk7 h SER 497 Cb 1.08 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.50 3bk7 h SER 497 CO 0.08 0.81 0.05 -0.09 -1.14 0.00 0.00 176.83 176.54 3bk7 h ARG 498 N -0.11 0.76 0.55 3.45 2.43 -1.26 -1.93 114.38 118.26 3bk7 h ARG 498 Ca 0.01 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 58.97 3bk7 h ARG 498 Cb 0.74 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.19 3bk7 h ARG 498 CO 0.04 0.74 -0.26 0.00 -1.51 0.00 0.00 179.97 178.98 3bk7 h ALA 499 N 1.33 -0.73 -0.98 2.80 0.00 -1.08 0.40 119.26 120.99 3bk7 h ALA 499 Ca 0.15 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 55.02 3bk7 h ALA 499 Cb 0.38 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 18.35 3bk7 h ALA 499 CO 0.01 -0.74 0.60 0.82 0.00 0.00 0.00 179.25 179.94 3bk7 h ILE 500 N -1.07 0.81 -0.05 0.00 2.04 -1.16 0.17 117.51 118.25 3bk7 h ILE 500 Ca -0.07 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 3bk7 h ILE 500 Cb 0.63 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 3bk7 h ILE 500 CO 0.12 0.16 -0.10 -0.09 0.00 0.00 0.00 178.15 178.24 3bk7 h ARG 501 N 0.85 0.16 0.22 2.37 9.65 -1.34 -2.75 114.38 123.54 3bk7 h ARG 501 Ca 0.53 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 59.30 3bk7 h ARG 501 Cb 0.68 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.28 3bk7 h ARG 501 CO -0.33 0.68 -0.11 0.45 2.80 0.00 0.00 179.97 183.47 3bk7 h HIS 502 N -0.35 -0.28 -0.73 2.20 3.86 -0.25 -1.38 115.15 118.22 3bk7 h HIS 502 Ca 0.00 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3bk7 h HIS 502 Cb 0.68 0.09 -0.04 0.00 1.06 0.00 0.00 27.41 29.20 3bk7 h HIS 502 CO 0.12 -0.05 0.45 -0.07 0.86 0.00 0.00 177.93 179.23 3bk7 h LEU 503 N -0.46 0.87 -0.52 2.43 4.07 -0.81 0.32 115.31 121.21 3bk7 h LEU 503 Ca -0.03 -0.05 -0.04 0.00 0.08 0.00 0.00 57.88 57.84 3bk7 h LEU 503 Cb 0.35 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 3bk7 h LEU 503 CO 0.05 0.66 0.18 0.24 -1.08 0.00 0.00 178.44 178.49 3bk7 h MET 504 N 0.99 0.80 -0.11 1.13 2.86 -1.50 -2.31 114.93 116.79 3bk7 h MET 504 Ca 0.26 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3bk7 h MET 504 Cb -0.06 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 3bk7 h MET 504 CO -0.05 0.73 0.06 1.49 1.06 0.00 0.00 176.91 180.20 3bk7 h GLU 505 N 0.71 0.16 0.81 1.72 4.81 -0.79 -0.57 114.58 121.44 3bk7 h GLU 505 Ca 0.17 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.34 3bk7 h GLU 505 Cb 0.25 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.60 3bk7 h GLU 505 CO -0.01 0.21 -0.39 -0.22 -0.73 0.00 0.00 179.01 177.87 3bk7 h LYS 506 N 0.07 -1.05 -0.41 1.92 1.63 -0.28 -3.03 116.57 115.43 3bk7 h LYS 506 Ca 0.04 0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 3bk7 h LYS 506 Cb 0.10 0.24 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 3bk7 h LYS 506 CO -0.01 -0.70 0.00 0.27 -3.45 0.00 0.00 179.45 175.56 3bk7 n ASN 507 N -5.16 0.65 -3.78 4.20 0.23 -0.88 -4.92 115.26 105.59 3bk7 n ASN 507 Ca -0.14 -2.02 -0.32 0.00 -0.53 0.00 0.00 54.58 51.57 3bk7 n ASN 507 Cb 0.43 -0.22 0.03 0.00 -2.08 0.00 0.00 39.78 37.94 3bk7 n ASN 507 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3bk7 n GLU 508 N -0.21 -1.54 -4.51 -3.83 1.02 -0.48 -5.00 120.64 106.10 3bk7 n GLU 508 Ca 0.02 0.40 -0.26 0.00 -0.02 0.00 0.00 57.16 57.29 3bk7 n GLU 508 Cb 0.14 -4.02 -0.10 0.00 -0.02 0.00 0.00 31.44 27.44 3bk7 n GLU 508 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3bk7 s LYS 509 N -6.26 1.93 0.03 3.49 -0.14 -0.34 -4.54 119.74 113.90 3bk7 s LYS 509 Ca 0.38 -1.96 -0.01 0.00 -1.36 0.00 0.00 55.97 53.03 3bk7 s LYS 509 Cb -0.15 -1.74 -0.04 0.00 -1.68 0.00 0.00 37.83 34.23 3bk7 s LYS 509 CO 0.88 0.06 0.16 0.99 -0.76 0.00 0.00 175.35 176.68 3bk7 s THR 510 N -2.63 5.17 0.02 2.17 2.01 -1.23 -4.04 115.64 117.11 3bk7 s THR 510 Ca 0.34 -0.36 -0.13 0.00 0.31 0.00 0.00 61.69 61.85 3bk7 s THR 510 Cb 0.05 -3.45 0.02 0.00 0.01 0.00 0.00 72.50 69.12 3bk7 s THR 510 CO 0.18 0.24 0.27 0.00 -0.69 0.00 0.00 174.62 174.63 3bk7 s ALA 511 N -1.37 -0.63 -0.11 7.40 0.00 -0.85 -1.25 121.76 124.95 3bk7 s ALA 511 Ca 0.29 0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.33 3bk7 s ALA 511 Cb -0.13 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.22 3bk7 s ALA 511 CO 0.21 -0.33 -0.16 -0.51 0.00 0.00 0.00 175.76 174.97 3bk7 s LEU 512 N -1.75 1.75 -0.15 0.00 1.02 -0.14 -1.58 118.68 117.83 3bk7 s LEU 512 Ca -0.09 -0.43 0.00 0.00 0.02 0.00 0.00 54.13 53.63 3bk7 s LEU 512 Cb -0.03 -1.10 0.03 0.00 0.02 0.00 0.00 46.19 45.11 3bk7 s LEU 512 CO -0.00 0.03 -0.12 -0.69 0.02 0.00 0.00 176.35 175.58 3bk7 s VAL 513 N 0.93 1.49 -0.06 -1.59 1.01 -0.05 -2.23 120.40 119.91 3bk7 s VAL 513 Ca -0.08 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 61.03 3bk7 s VAL 513 Cb -0.15 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 3bk7 s VAL 513 CO -0.01 0.39 0.71 -0.69 0.00 0.00 0.00 175.10 175.50 3bk7 s VAL 514 N 1.51 5.02 0.01 2.92 1.01 -0.82 -0.67 120.40 129.39 3bk7 s VAL 514 Ca 0.04 1.46 -0.17 0.00 0.00 0.00 0.00 61.98 63.31 3bk7 s VAL 514 Cb -0.13 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.23 3bk7 s VAL 514 CO -0.10 0.26 0.37 -1.61 0.00 0.00 0.00 175.10 174.02 3bk7 s GLU 515 N 0.73 0.80 0.00 2.72 0.41 -0.89 -1.73 118.70 120.74 3bk7 s GLU 515 Ca 0.38 -0.27 0.07 0.00 -0.41 0.00 0.00 54.97 54.74 3bk7 s GLU 515 Cb -0.18 0.36 0.00 0.00 -1.78 0.00 0.00 34.13 32.53 3bk7 s GLU 515 CO 0.19 -0.25 0.54 0.72 -0.49 0.00 0.00 175.26 175.96 3bk7 n HIS 516 N 0.89 0.00 -3.38 1.61 8.25 -1.26 -4.62 115.22 116.70 3bk7 n HIS 516 Ca -0.20 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.83 3bk7 n HIS 516 Cb 0.58 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.60 3bk7 n HIS 516 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3bk7 s ASP 517 N -1.07 6.16 0.29 0.41 -1.08 -1.26 -4.26 116.67 115.85 3bk7 s ASP 517 Ca 0.06 -0.80 0.02 0.00 -0.52 0.00 0.00 52.55 51.31 3bk7 s ASP 517 Cb 0.06 -2.19 0.59 0.00 -1.46 0.00 0.00 42.92 39.91 3bk7 s ASP 517 CO 0.17 -0.53 1.82 0.58 0.52 0.00 0.00 175.17 177.74 3bk7 h VAL 518 N 5.69 0.87 -0.05 1.11 2.07 -1.97 -2.23 116.25 121.74 3bk7 h VAL 518 Ca -0.27 -0.32 -0.14 0.00 0.82 0.00 0.00 66.70 66.79 3bk7 h VAL 518 Cb 1.11 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3bk7 h VAL 518 CO 0.77 0.17 -0.62 -0.07 0.02 0.00 0.00 177.57 177.84 3bk7 h LEU 519 N 0.94 0.19 -0.15 2.57 4.07 -1.97 -1.59 115.31 119.36 3bk7 h LEU 519 Ca 0.51 -0.11 -0.06 0.00 0.08 0.00 0.00 57.88 58.30 3bk7 h LEU 519 Cb 0.57 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.26 3bk7 h LEU 519 CO -0.29 0.76 -0.14 -0.03 -1.08 0.00 0.00 178.44 177.66 3bk7 h MET 520 N 0.12 0.36 -0.53 1.13 4.05 -1.85 -0.26 114.93 117.95 3bk7 h MET 520 Ca -0.01 -0.19 0.04 0.00 -0.28 0.00 0.00 59.70 59.27 3bk7 h MET 520 Cb 1.12 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.88 3bk7 h MET 520 CO 0.09 0.73 0.28 0.82 0.23 0.00 0.00 176.91 179.07 3bk7 h ILE 521 N -0.00 0.98 -0.36 1.77 2.04 -1.37 -0.32 117.51 120.25 3bk7 h ILE 521 Ca 0.03 -0.19 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 3bk7 h ILE 521 Cb 0.66 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 3bk7 h ILE 521 CO 0.04 0.10 -0.14 -0.78 0.00 0.00 0.00 178.15 177.37 3bk7 h ASP 522 N 0.55 0.63 0.14 1.72 3.58 -1.19 -1.43 116.42 120.43 3bk7 h ASP 522 Ca 0.23 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 3bk7 h ASP 522 Cb 0.11 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.99 3bk7 h ASP 522 CO -0.14 0.79 -0.07 0.22 -2.88 0.00 0.00 179.24 177.16 3bk7 h TYR 523 N 0.58 -0.18 0.00 0.28 3.20 -0.28 -3.35 116.97 117.23 3bk7 h TYR 523 Ca 0.10 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3bk7 h TYR 523 Cb 0.57 0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.90 3bk7 h TYR 523 CO 0.02 0.24 -0.29 -0.39 -1.64 0.00 0.00 178.16 176.11 3bk7 h VAL 524 N -0.68 0.00 -3.96 1.81 -1.51 -1.12 -3.48 116.25 107.31 3bk7 h VAL 524 Ca -0.02 -0.92 -0.46 0.00 -1.23 0.00 0.00 66.70 64.06 3bk7 h VAL 524 Cb 0.50 1.77 -0.01 0.00 -2.13 0.00 0.00 31.29 31.42 3bk7 h VAL 524 CO 0.03 0.00 0.36 -0.44 -1.23 0.00 0.00 177.57 176.29 3bk7 s SER 525 N -5.73 7.05 -0.08 4.19 0.01 -0.54 -4.67 113.70 113.94 3bk7 s SER 525 Ca 0.05 1.83 0.02 0.00 1.31 0.00 0.00 55.95 59.17 3bk7 s SER 525 Cb 0.07 -2.57 -0.06 0.00 0.21 0.00 0.00 66.02 63.67 3bk7 s SER 525 CO 0.70 -0.28 -0.05 0.47 0.41 0.00 0.00 173.24 174.49 3bk7 n ASP 526 N -0.01 3.35 -3.67 2.44 8.00 0.17 -4.95 116.55 121.87 3bk7 n ASP 526 Ca 0.04 -0.03 -0.16 0.00 0.71 0.00 0.00 54.79 55.36 3bk7 n ASP 526 Cb 0.51 0.09 -0.08 0.00 -0.02 0.00 0.00 41.12 41.62 3bk7 n ASP 526 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3bk7 s ARG 527 N -2.17 1.57 0.03 -1.24 0.52 -0.97 -4.43 118.95 112.27 3bk7 s ARG 527 Ca -0.09 -1.80 0.00 0.00 -0.52 0.00 0.00 55.73 53.32 3bk7 s ARG 527 Cb 0.03 0.33 -0.02 0.00 0.52 0.00 0.00 34.95 35.80 3bk7 s ARG 527 CO 0.22 -0.58 -0.04 -1.17 0.02 0.00 0.00 175.30 173.75 3bk7 s LEU 528 N -3.26 2.28 -0.17 2.53 2.96 -0.42 -1.63 118.68 120.98 3bk7 s LEU 528 Ca 0.38 -0.58 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3bk7 s LEU 528 Cb 0.03 0.07 0.04 0.00 0.50 0.00 0.00 46.19 46.84 3bk7 s LEU 528 CO 0.20 -0.33 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.23 3bk7 s ILE 529 N -1.82 1.04 -0.10 6.68 1.01 -0.20 -0.77 121.20 127.04 3bk7 s ILE 529 Ca -0.12 -0.62 -0.06 0.00 0.00 0.00 0.00 60.65 59.86 3bk7 s ILE 529 Cb -0.07 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.11 3bk7 s ILE 529 CO -0.02 0.09 0.12 -0.69 0.00 0.00 0.00 174.94 174.44 3bk7 s VAL 530 N 1.66 5.32 -0.01 2.92 1.01 -1.26 -1.70 120.40 128.34 3bk7 s VAL 530 Ca 0.00 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.13 3bk7 s VAL 530 Cb -0.15 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 3bk7 s VAL 530 CO -0.08 0.59 -0.10 -0.36 0.00 0.00 0.00 175.10 175.15 3bk7 s PHE 531 N -1.04 2.80 0.30 5.22 0.40 -0.59 -0.79 117.98 124.29 3bk7 s PHE 531 Ca 0.16 -0.09 0.06 0.00 -0.60 0.00 0.00 56.93 56.46 3bk7 s PHE 531 Cb -0.12 -1.60 -0.02 0.00 0.51 0.00 0.00 43.02 41.79 3bk7 s PHE 531 CO 0.05 0.31 0.20 0.39 0.70 0.00 0.00 175.22 176.88 3bk7 n GLU 532 N 1.77 0.43 0.00 0.44 1.02 -1.05 -4.60 120.64 118.65 3bk7 n GLU 532 Ca -0.16 -2.86 0.00 0.00 -0.02 0.00 0.00 57.16 54.12 3bk7 n GLU 532 Cb 0.52 2.10 0.00 0.00 -0.02 0.00 0.00 31.44 34.05 3bk7 n GLU 532 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3bk7 n GLY 533 N -0.49 0.34 3.04 0.62 0.00 -1.26 -1.52 105.19 105.93 3bk7 n GLY 533 Ca 0.03 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.74 3bk7 n GLY 533 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3bk7 s GLU 534 N -0.31 1.84 0.09 1.61 2.02 0.12 -4.99 118.70 119.09 3bk7 s GLU 534 Ca 0.00 -1.63 -0.36 0.00 0.02 0.00 0.00 54.97 53.01 3bk7 s GLU 534 Cb 0.00 -3.06 -0.18 0.00 0.10 0.00 0.00 34.13 30.99 3bk7 s GLU 534 CO 0.00 -0.76 1.06 -2.30 0.02 0.00 0.00 175.26 173.27 3bk7 n PRO 535 N 4.34 0.52 -0.05 0.39 -0.02 -1.26 0.18 135.00 139.10 3bk7 n PRO 535 Ca -0.05 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 3bk7 n PRO 535 Cb 0.42 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 3bk7 n PRO 535 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3bk7 n GLY 536 N 1.89 2.81 0.81 -1.23 0.00 0.20 -4.78 105.19 104.89 3bk7 n GLY 536 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3bk7 n GLY 536 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bk7 n ARG 537 N -2.00 0.00 -3.94 1.61 1.74 0.13 -4.71 116.66 109.48 3bk7 n ARG 537 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 3bk7 n ARG 537 Cb 0.00 -0.06 -0.11 0.00 -1.02 0.00 0.00 32.46 31.27 3bk7 n ARG 537 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 3bk7 s HIS 538 N -0.93 0.18 0.00 -1.55 -3.43 -0.63 -1.61 115.29 107.33 3bk7 s HIS 538 Ca 0.00 -0.38 -0.04 0.00 -0.80 0.00 0.00 55.06 53.84 3bk7 s HIS 538 Cb 0.00 -0.14 -0.01 0.00 -1.43 0.00 0.00 32.58 31.00 3bk7 s HIS 538 CO 0.00 -0.19 0.06 0.20 -2.00 0.00 0.00 174.74 172.81 3bk7 s GLY 539 N -1.29 0.10 -0.16 -1.38 0.00 -0.47 0.13 107.32 104.25 3bk7 s GLY 539 Ca -0.14 -0.25 -0.02 0.00 0.00 0.00 0.00 44.72 44.31 3bk7 s GLY 539 CO -0.00 -0.34 0.01 -1.60 0.00 0.00 0.00 173.10 171.16 3bk7 s ARG 540 N -1.18 0.83 -0.29 2.90 3.52 -0.58 -1.78 118.95 122.38 3bk7 s ARG 540 Ca -0.13 -0.33 -0.26 0.00 -0.13 0.00 0.00 55.73 54.89 3bk7 s ARG 540 Cb -0.07 -1.83 0.00 0.00 -1.56 0.00 0.00 34.95 31.49 3bk7 s ARG 540 CO 0.00 -0.52 0.89 0.00 -0.81 0.00 0.00 175.30 174.87 3bk7 s ALA 541 N 1.83 3.57 1.19 6.12 0.00 -0.95 -2.52 121.76 131.00 3bk7 s ALA 541 Ca 0.01 -0.21 -0.17 0.00 0.00 0.00 0.00 51.96 51.58 3bk7 s ALA 541 Cb -0.16 -3.41 0.28 0.00 0.00 0.00 0.00 23.12 19.83 3bk7 s ALA 541 CO -0.07 -1.19 1.06 -0.51 0.00 0.00 0.00 175.76 175.05 3bk7 s LEU 542 N 3.12 0.58 0.54 0.00 1.43 0.03 -2.35 118.68 122.03 3bk7 s LEU 542 Ca 0.37 0.90 -0.08 0.00 -1.03 0.00 0.00 54.13 54.29 3bk7 s LEU 542 Cb -0.14 -2.70 -0.04 0.00 0.03 0.00 0.00 46.19 43.33 3bk7 s LEU 542 CO 0.11 -4.14 0.90 -2.84 0.23 0.00 0.00 176.35 170.61 3bk7 s PRO 543 N -5.12 3.59 0.03 1.29 0.02 -1.26 -4.61 135.00 128.94 3bk7 s PRO 543 Ca 0.69 0.47 -0.35 0.00 0.02 0.00 0.00 61.00 61.83 3bk7 s PRO 543 Cb -0.14 -2.24 -0.14 0.00 0.02 0.00 0.00 34.50 32.00 3bk7 s PRO 543 CO 0.58 -0.35 1.65 -2.30 -0.33 0.00 0.00 177.00 176.25 3bk7 n PRO 544 N -2.39 1.92 -4.28 5.54 -0.02 -1.26 -4.75 135.00 129.75 3bk7 n PRO 544 Ca 0.03 0.70 -0.15 0.00 -2.02 0.00 0.00 63.50 62.06 3bk7 n PRO 544 Cb 0.55 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.46 3bk7 n PRO 544 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bk7 s MET 545 N 2.10 1.27 0.77 -0.52 0.23 0.05 -4.94 119.30 118.25 3bk7 s MET 545 Ca 0.86 -1.66 -0.15 0.00 -1.03 0.00 0.00 55.69 53.72 3bk7 s MET 545 Cb -0.76 -0.25 0.05 0.00 -1.53 0.00 0.00 34.83 32.35 3bk7 s MET 545 CO 0.46 -0.22 1.19 0.41 -2.03 0.00 0.00 175.02 174.82 3bk7 n GLY 546 N -0.36 0.04 0.23 3.16 0.00 -1.26 -1.30 105.19 105.69 3bk7 n GLY 546 Ca -0.03 -0.40 -0.00 0.00 0.00 0.00 0.00 46.02 45.59 3bk7 n GLY 546 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3bk7 h MET 547 N -0.53 0.31 0.14 1.61 2.86 -1.91 0.30 114.93 117.70 3bk7 h MET 547 Ca -0.47 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.14 3bk7 h MET 547 Cb 1.31 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.90 3bk7 h MET 547 CO 0.47 0.20 -0.07 -0.09 1.06 0.00 0.00 176.91 178.49 3bk7 h ARG 548 N 0.32 -0.18 -0.23 1.72 2.43 -1.91 0.23 114.38 116.76 3bk7 h ARG 548 Ca 0.30 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.46 3bk7 h ARG 548 Cb 0.41 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3bk7 h ARG 548 CO -0.35 0.05 0.02 1.49 -1.51 0.00 0.00 179.97 179.67 3bk7 h GLU 549 N -0.39 0.34 0.37 0.20 4.81 -1.85 -1.29 114.58 116.77 3bk7 h GLU 549 Ca -0.02 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 3bk7 h GLU 549 Cb 0.31 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3bk7 h GLU 549 CO 0.03 0.35 -0.18 0.78 -0.73 0.00 0.00 179.01 179.26 3bk7 h GLY 550 N 0.60 -0.52 1.48 1.92 0.00 -0.14 -2.63 103.07 103.78 3bk7 h GLY 550 Ca 0.08 0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.66 3bk7 h GLY 550 CO 0.00 -0.19 0.20 -0.33 0.00 0.00 0.00 176.54 176.22 3bk7 h MET 551 N -1.12 0.00 -0.20 4.80 2.86 -0.52 0.74 114.93 121.50 3bk7 h MET 551 Ca -0.05 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 3bk7 h MET 551 Cb 0.38 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 3bk7 h MET 551 CO 0.08 0.00 -0.07 -0.91 1.06 0.00 0.00 176.91 177.07 3bk7 h ASN 552 N 0.00 0.41 -0.59 1.22 -0.26 -1.28 -0.67 115.58 114.41 3bk7 h ASN 552 Ca 0.10 -0.39 -0.09 0.00 -0.56 0.00 0.00 56.30 55.36 3bk7 h ASN 552 Cb 0.50 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.63 3bk7 h ASN 552 CO -0.00 0.71 0.01 -0.09 -1.06 0.00 0.00 177.43 177.00 3bk7 h ARG 553 N 0.12 1.04 0.02 0.81 9.65 -0.51 -3.03 114.38 122.47 3bk7 h ARG 553 Ca 0.05 -0.32 -0.08 0.00 -1.10 0.00 0.00 59.98 58.53 3bk7 h ARG 553 Cb 0.54 -0.10 0.01 0.00 -1.39 0.00 0.00 29.97 29.03 3bk7 h ARG 553 CO 0.02 1.01 -0.32 0.35 2.80 0.00 0.00 179.97 183.84 3bk7 h PHE 554 N 0.93 0.29 -0.29 2.20 3.04 -1.27 -3.35 116.94 118.48 3bk7 h PHE 554 Ca 0.17 -0.17 0.03 0.00 3.98 0.00 0.00 57.97 61.98 3bk7 h PHE 554 Cb 0.54 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.00 3bk7 h PHE 554 CO 0.04 1.01 0.20 -0.07 -2.02 0.00 0.00 178.31 177.46 3bk7 h LEU 555 N -0.52 0.25 -1.03 0.59 3.38 -1.19 -1.56 115.31 115.23 3bk7 h LEU 555 Ca -0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3bk7 h LEU 555 Cb 1.11 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3bk7 h LEU 555 CO 0.06 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.77 3bk7 h ALA 556 N 1.83 1.00 -0.01 1.53 0.00 -1.67 0.21 119.26 122.16 3bk7 h ALA 556 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3bk7 h ALA 556 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3bk7 h ALA 556 CO -0.02 0.00 -0.08 0.45 0.00 0.00 0.00 179.25 179.59 3bk7 n SER 557 N -2.31 0.99 0.00 0.00 2.88 -0.59 -3.95 113.62 110.64 3bk7 n SER 557 Ca 0.01 -1.10 0.00 0.00 -1.33 0.00 0.00 58.87 56.44 3bk7 n SER 557 Cb 0.17 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 3bk7 n SER 557 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 3bk7 n VAL 558 N -0.40 0.00 -2.04 2.46 0.31 -0.36 -5.07 118.33 113.23 3bk7 n VAL 558 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 3bk7 n VAL 558 Cb 0.31 -0.67 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 3bk7 n VAL 558 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3bk7 n GLY 559 N 2.37 0.74 3.09 2.92 0.00 0.60 -4.95 105.19 109.97 3bk7 n GLY 559 Ca 0.00 -0.53 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 3bk7 n GLY 559 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bk7 s ILE 560 N -2.85 1.05 0.17 -0.61 -1.09 -1.23 -5.04 121.20 111.60 3bk7 s ILE 560 Ca 0.00 -0.56 0.08 0.00 -2.23 0.00 0.00 60.65 57.94 3bk7 s ILE 560 Cb 0.00 -0.88 -0.04 0.00 -1.58 0.00 0.00 42.46 39.96 3bk7 s ILE 560 CO 0.00 0.30 -0.09 0.42 -1.23 0.00 0.00 174.94 174.34 3bk7 s THR 561 N -0.27 3.25 -0.02 2.92 -4.23 -1.26 -4.79 115.64 111.24 3bk7 s THR 561 Ca 0.04 -1.57 0.02 0.00 -1.18 0.00 0.00 61.69 59.01 3bk7 s THR 561 Cb -0.06 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.19 3bk7 s THR 561 CO -0.00 -0.07 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.57 3bk7 s PHE 562 N -1.60 0.85 0.00 3.99 0.40 0.25 -1.57 117.98 120.29 3bk7 s PHE 562 Ca 0.24 -0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.38 3bk7 s PHE 562 Cb -0.09 -0.59 0.00 0.00 0.51 0.00 0.00 43.02 42.85 3bk7 s PHE 562 CO 0.15 -0.07 0.00 -2.13 0.70 0.00 0.00 175.22 173.87 3bk7 n ARG 563 N 3.15 3.15 -3.78 0.44 0.63 0.17 -2.61 116.66 117.82 3bk7 n ARG 563 Ca -0.17 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.50 3bk7 n ARG 563 Cb 0.55 0.00 -0.17 0.00 0.45 0.00 0.00 32.46 33.30 3bk7 n ARG 563 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 3bk7 s ARG 564 N 1.70 0.83 -0.20 -0.14 6.06 -1.26 -2.18 118.95 123.75 3bk7 s ARG 564 Ca 0.00 -0.31 -0.29 0.00 -2.50 0.00 0.00 55.73 52.63 3bk7 s ARG 564 Cb 0.00 -1.80 -0.06 0.00 0.06 0.00 0.00 34.95 33.15 3bk7 s ARG 564 CO 0.00 -0.51 2.20 -3.47 -2.50 0.00 0.00 175.30 171.02 3bk7 n ASP 565 N 5.03 3.25 -0.39 -2.12 -0.08 -0.83 -4.79 116.55 116.61 3bk7 n ASP 565 Ca -0.09 0.29 0.32 0.00 -1.51 0.00 0.00 54.79 53.80 3bk7 n ASP 565 Cb 0.48 -1.53 0.62 0.00 2.34 0.00 0.00 41.12 43.03 3bk7 n ASP 565 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3bk7 h PRO 566 N 14.37 0.18 0.00 -0.67 0.11 -1.97 0.19 132.00 144.22 3bk7 h PRO 566 Ca -0.41 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.62 3bk7 h PRO 566 Cb 1.25 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3bk7 h PRO 566 CO 0.96 0.12 -0.84 -0.25 -0.21 0.00 0.00 178.00 177.78 3bk7 n ASP 567 N -4.55 1.85 0.14 -2.05 8.00 -1.26 -4.57 116.55 114.10 3bk7 n ASP 567 Ca 0.31 0.53 -0.01 0.00 0.71 0.00 0.00 54.79 56.34 3bk7 n ASP 567 Cb 1.23 -0.86 0.21 0.00 -0.02 0.00 0.00 41.12 41.67 3bk7 n ASP 567 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3bk7 h SER 568 N -1.00 0.04 0.00 -2.24 4.64 -1.94 -3.47 113.55 109.57 3bk7 h SER 568 Ca -0.10 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3bk7 h SER 568 Cb 0.79 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3bk7 h SER 568 CO -0.06 0.59 0.00 0.61 -0.87 0.00 0.00 176.83 177.10 3bk7 n GLY 569 N 0.08 0.80 3.87 -0.77 0.00 0.68 -3.58 105.19 106.27 3bk7 n GLY 569 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3bk7 n GLY 569 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3bk7 s ARG 570 N -0.04 3.72 -0.06 1.61 1.70 -1.26 -4.74 118.95 119.87 3bk7 s ARG 570 Ca 0.00 0.72 -0.30 0.00 -0.47 0.00 0.00 55.73 55.68 3bk7 s ARG 570 Cb 0.00 -2.16 -0.04 0.00 -0.57 0.00 0.00 34.95 32.18 3bk7 s ARG 570 CO 0.00 -0.38 1.32 -1.25 -1.08 0.00 0.00 175.30 173.91 3bk7 s PRO 571 N -4.64 4.29 -0.24 3.89 0.04 -1.26 -1.96 135.00 135.11 3bk7 s PRO 571 Ca 0.55 1.81 -0.10 0.00 0.04 0.00 0.00 61.00 63.30 3bk7 s PRO 571 Cb -0.10 -3.64 -0.05 0.00 0.04 0.00 0.00 34.50 30.75 3bk7 s PRO 571 CO 0.43 -0.58 0.14 0.50 0.04 0.00 0.00 177.00 177.54 3bk7 s ARG 572 N 2.70 3.99 0.28 4.56 6.06 -0.93 -4.90 118.95 130.71 3bk7 s ARG 572 Ca 0.60 -0.31 -0.22 0.00 -2.50 0.00 0.00 55.73 53.29 3bk7 s ARG 572 Cb -0.27 -3.50 -0.09 0.00 0.06 0.00 0.00 34.95 31.15 3bk7 s ARG 572 CO 0.22 0.01 0.82 0.00 -2.50 0.00 0.00 175.30 173.86 3bk7 s ALA 573 N 1.18 3.30 -0.19 6.12 0.00 -1.26 0.43 121.76 131.34 3bk7 s ALA 573 Ca 0.07 0.31 -0.09 0.00 0.00 0.00 0.00 51.96 52.24 3bk7 s ALA 573 Cb -0.14 -2.98 -0.05 0.00 0.00 0.00 0.00 23.12 19.96 3bk7 s ALA 573 CO 0.05 0.26 0.11 -0.80 0.00 0.00 0.00 175.76 175.38 3bk7 s ASN 574 N -1.72 6.05 0.36 0.00 0.02 -0.61 -4.81 114.94 114.24 3bk7 s ASN 574 Ca 0.48 0.20 -0.27 0.00 -1.02 0.00 0.00 52.86 52.25 3bk7 s ASN 574 Cb -0.16 -2.05 -0.09 0.00 0.02 0.00 0.00 41.25 38.97 3bk7 s ASN 574 CO 0.21 0.19 1.18 -0.54 0.02 0.00 0.00 177.10 178.16 3bk7 s LYS 575 N 0.30 4.23 -0.04 -0.60 3.01 -1.26 -4.56 119.74 120.82 3bk7 s LYS 575 Ca 0.07 1.89 -0.39 0.00 -1.01 0.00 0.00 55.97 56.53 3bk7 s LYS 575 Cb -0.11 -2.85 -0.18 0.00 -1.01 0.00 0.00 37.83 33.68 3bk7 s LYS 575 CO -0.01 -0.18 1.35 -1.91 0.51 0.00 0.00 175.35 175.11 3bk7 n GLU 576 N 0.42 0.76 -3.07 1.68 2.13 -1.26 -2.06 120.64 119.24 3bk7 n GLU 576 Ca 0.02 0.27 -0.15 0.00 0.66 0.00 0.00 57.16 57.97 3bk7 n GLU 576 Cb 0.45 -1.87 0.04 0.00 0.27 0.00 0.00 31.44 30.33 3bk7 n GLU 576 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3bk7 n GLY 577 N 2.63 0.01 3.98 8.31 0.00 -1.26 -5.04 105.19 113.82 3bk7 n GLY 577 Ca 0.21 -0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 3bk7 n GLY 577 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bk7 s SER 578 N -3.11 6.00 0.15 1.61 1.04 -0.87 -4.95 113.70 113.57 3bk7 s SER 578 Ca 0.32 -0.06 -0.17 0.00 0.48 0.00 0.00 55.95 56.52 3bk7 s SER 578 Cb -0.14 -1.38 0.06 0.00 0.10 0.00 0.00 66.02 64.66 3bk7 s SER 578 CO 0.40 -0.43 1.72 0.58 0.98 0.00 0.00 173.24 176.49 3bk7 h VAL 579 N 0.84 0.80 -0.41 5.02 2.07 -1.96 -0.85 116.25 121.77 3bk7 h VAL 579 Ca -0.47 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 3bk7 h VAL 579 Cb 1.25 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 3bk7 h VAL 579 CO 0.55 0.03 0.10 0.11 0.02 0.00 0.00 177.57 178.37 3bk7 h LYS 580 N 0.14 0.65 -0.91 1.57 1.79 -1.95 -1.41 116.57 116.46 3bk7 h LYS 580 Ca 0.16 -0.16 0.13 0.00 -2.18 0.00 0.00 60.65 58.60 3bk7 h LYS 580 Cb 0.19 -0.09 -0.07 0.00 -1.58 0.00 0.00 32.23 30.69 3bk7 h LYS 580 CO -0.23 0.67 0.58 0.22 -1.08 0.00 0.00 179.45 179.61 3bk7 h ASP 581 N 0.52 0.72 0.06 0.86 3.58 -1.74 -0.10 116.42 120.32 3bk7 h ASP 581 Ca 0.13 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.61 3bk7 h ASP 581 Cb 0.31 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.25 3bk7 h ASP 581 CO 0.00 0.38 -0.03 0.03 -2.88 0.00 0.00 179.24 176.74 3bk7 h ARG 582 N 0.77 -0.08 0.15 0.28 3.08 -0.74 -2.56 114.38 115.29 3bk7 h ARG 582 Ca 0.45 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.51 3bk7 h ARG 582 Cb 0.62 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 3bk7 h ARG 582 CO -0.21 0.43 -0.13 0.93 -1.07 0.00 0.00 179.97 179.92 3bk7 h GLU 583 N -0.63 -0.29 -0.83 0.04 5.08 -0.92 -0.47 114.58 116.56 3bk7 h GLU 583 Ca -0.01 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.46 3bk7 h GLU 583 Cb 0.54 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.78 3bk7 h GLU 583 CO 0.01 -0.19 0.49 1.96 -1.00 0.00 0.00 179.01 180.28 3bk7 h GLN 584 N -0.30 0.80 -0.21 2.33 4.20 -1.12 -2.01 115.11 118.80 3bk7 h GLN 584 Ca -0.00 -0.05 -0.17 0.00 0.06 0.00 0.00 58.65 58.49 3bk7 h GLN 584 Cb 0.28 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 3bk7 h GLN 584 CO -0.02 0.53 -0.55 0.87 -0.67 0.00 0.00 178.83 178.99 3bk7 h LYS 585 N 0.83 0.64 -0.07 1.46 1.57 -1.23 0.51 116.57 120.28 3bk7 h LYS 585 Ca 0.40 -0.40 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 3bk7 h LYS 585 Cb 0.34 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 3bk7 h LYS 585 CO -0.24 1.02 0.09 0.00 -0.57 0.00 0.00 179.45 179.75 3bk7 h ALA 586 N 0.90 1.60 -0.38 3.86 0.00 -0.34 0.24 119.26 125.13 3bk7 h ALA 586 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3bk7 h ALA 586 Cb 1.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3bk7 h ALA 586 CO 0.11 -0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.77 3bk7 n ARG 587 N -3.76 2.49 -2.40 0.00 1.74 -1.02 -4.96 116.66 108.74 3bk7 n ARG 587 Ca -0.01 -2.07 -0.20 0.00 -0.77 0.00 0.00 57.85 54.79 3bk7 n ARG 587 Cb 0.18 -1.35 -0.01 0.00 -1.02 0.00 0.00 32.46 30.27 3bk7 n ARG 587 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3bk7 n GLY 588 N 0.86 -0.50 3.19 -0.13 0.00 0.84 -4.94 105.19 104.50 3bk7 n GLY 588 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3bk7 n GLY 588 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3bk7 s GLU 589 N -5.05 2.80 0.22 1.61 2.02 0.18 -4.89 118.70 115.59 3bk7 s GLU 589 Ca 0.00 -2.29 0.23 0.00 0.02 0.00 0.00 54.97 52.93 3bk7 s GLU 589 Cb 0.00 -3.96 0.19 0.00 0.10 0.00 0.00 34.13 30.46 3bk7 s GLU 589 CO 0.00 -1.21 1.25 1.88 0.02 0.00 0.00 175.26 177.20 3bk7 h TYR 590 N 7.63 0.00 -3.47 1.61 -1.99 -1.89 -3.39 116.97 115.46 3bk7 h TYR 590 Ca -0.04 0.00 -0.25 0.00 2.00 0.00 0.00 58.73 60.44 3bk7 h TYR 590 Cb 1.01 0.00 -0.31 0.00 2.00 0.00 0.00 36.73 39.43 3bk7 h TYR 590 CO 0.77 0.00 -0.67 -0.47 -0.00 0.00 0.00 178.16 177.80 3bk7 s TYR 591 N -3.27 -0.06 -0.05 4.88 5.04 -1.26 0.84 117.35 123.48 3bk7 s TYR 591 Ca 0.03 0.24 0.01 0.00 -2.44 0.00 0.00 57.07 54.90 3bk7 s TYR 591 Cb 0.10 -0.10 -0.03 0.00 0.35 0.00 0.00 41.96 42.28 3bk7 s TYR 591 CO 0.74 -0.09 -0.04 0.71 -1.34 0.00 0.00 175.55 175.53 3bk7 s TYR 592 N 0.72 3.01 0.00 4.97 4.12 -1.07 -4.93 117.35 124.17 3bk7 s TYR 592 Ca -0.06 0.07 0.00 0.00 0.02 0.00 0.00 57.07 57.10 3bk7 s TYR 592 Cb -0.08 -1.71 0.00 0.00 -1.52 0.00 0.00 41.96 38.65 3bk7 s TYR 592 CO -0.03 0.40 0.00 0.00 0.02 0.00 0.00 175.55 175.94