#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ffv h ALA 8 N 0.00 -0.03 -0.41 -1.67 0.00 -1.98 -2.11 119.26 113.07 1ffv h ALA 8 Ca 0.00 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 1ffv h ALA 8 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1ffv h ALA 8 CO 0.00 -0.06 0.05 1.49 0.00 0.00 0.00 179.25 180.72 1ffv h GLU 9 N -0.93 0.63 -0.31 0.00 4.81 -2.01 -2.31 114.58 114.45 1ffv h GLU 9 Ca -0.00 -0.13 -0.18 0.00 -0.13 0.00 0.00 59.36 58.92 1ffv h GLU 9 Cb 0.75 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.03 1ffv h GLU 9 CO 0.00 0.62 -0.50 0.00 -0.73 0.00 0.00 179.01 178.41 1ffv h ALA 10 N 1.45 0.48 -0.38 2.92 0.00 -2.00 -2.28 119.26 119.45 1ffv h ALA 10 Ca 0.13 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1ffv h ALA 10 Cb 0.32 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1ffv h ALA 10 CO 0.01 0.66 -0.04 0.00 0.00 0.00 0.00 179.25 179.87 1ffv h ARG 11 N 0.68 0.63 -0.29 0.00 3.08 -1.12 -1.24 114.38 116.11 1ffv h ARG 11 Ca 0.03 -0.16 -0.16 0.00 0.07 0.00 0.00 59.98 59.75 1ffv h ARG 11 Cb 1.10 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 1ffv h ARG 11 CO 0.11 0.68 -0.44 1.49 -1.07 0.00 0.00 179.97 180.74 1ffv h GLU 12 N 0.59 0.81 -0.78 0.04 4.81 -1.40 -3.09 114.58 115.56 1ffv h GLU 12 Ca 0.12 -0.48 -0.04 0.00 -0.13 0.00 0.00 59.36 58.82 1ffv h GLU 12 Cb 0.44 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 1ffv h GLU 12 CO 0.02 1.12 0.34 1.25 -0.73 0.00 0.00 179.01 181.01 1ffv h LEU 13 N 0.58 1.04 -1.73 1.64 6.46 -1.14 -2.36 115.31 119.79 1ffv h LEU 13 Ca 0.03 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.65 1ffv h LEU 13 Cb 1.04 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 40.70 1ffv h LEU 13 CO 0.10 0.90 0.00 0.00 -0.62 0.00 0.00 178.44 178.82 1ffv h ALA 14 N 1.26 1.00 -0.04 1.25 0.00 -1.17 -2.66 119.26 118.89 1ffv h ALA 14 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 1ffv h ALA 14 Cb 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ffv h ALA 14 CO -0.03 0.00 -0.61 -0.07 0.00 0.00 0.00 179.25 178.54 1ffv h LEU 15 N 0.00 0.16 -1.60 0.00 3.38 -1.35 -3.45 115.31 112.46 1ffv h LEU 15 Ca 0.00 -0.09 -0.41 0.00 0.09 0.00 0.00 57.88 57.46 1ffv h LEU 15 Cb 0.36 -0.05 0.06 0.00 0.09 0.00 0.00 40.66 41.13 1ffv h LEU 15 CO 0.00 0.73 -0.80 0.00 0.09 0.00 0.00 178.44 178.46 1ffv n ALA 16 N -2.45 -1.87 -1.81 1.53 0.00 -1.01 -1.40 120.51 113.50 1ffv n ALA 16 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1ffv n ALA 16 Cb 0.62 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1ffv n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffv n GLY 17 N -1.55 1.56 3.60 0.00 0.00 -1.26 -4.54 105.19 102.99 1ffv n GLY 17 Ca -0.23 -1.44 -0.51 0.00 0.00 0.00 0.00 46.02 43.83 1ffv n GLY 17 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ffv n MET 18 N 0.00 1.24 0.00 1.61 2.81 -1.12 -2.16 117.12 119.50 1ffv n MET 18 Ca 0.00 0.45 0.00 0.00 -1.81 0.00 0.00 57.70 56.34 1ffv n MET 18 Cb 0.00 -2.10 0.00 0.00 -0.71 0.00 0.00 33.22 30.41 1ffv n MET 18 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ffv n GLY 19 N 2.59 2.47 3.76 3.03 0.00 0.54 -5.03 105.19 112.54 1ffv n GLY 19 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1ffv n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffv s ALA 20 N -2.42 3.31 -0.53 4.61 0.00 -0.92 -4.56 121.76 121.26 1ffv s ALA 20 Ca 0.00 0.60 -0.03 0.00 0.00 0.00 0.00 51.96 52.52 1ffv s ALA 20 Cb 0.00 -3.20 0.13 0.00 0.00 0.00 0.00 23.12 20.04 1ffv s ALA 20 CO 0.00 0.20 2.60 0.43 0.00 0.00 0.00 175.76 178.99 1ffv n SER 21 N 1.30 6.70 -4.76 0.00 7.64 -1.26 -4.33 113.62 118.90 1ffv n SER 21 Ca -0.01 -3.34 -0.37 0.00 1.01 0.00 0.00 58.87 56.16 1ffv n SER 21 Cb 0.48 -1.19 0.02 0.00 -1.01 0.00 0.00 64.21 62.50 1ffv n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ffv s ARG 22 N -2.21 3.39 0.80 1.43 1.70 -1.26 -4.84 118.95 117.95 1ffv s ARG 22 Ca 0.57 1.96 -0.11 0.00 -0.47 0.00 0.00 55.73 57.67 1ffv s ARG 22 Cb 0.39 -2.27 0.07 0.00 -0.57 0.00 0.00 34.95 32.58 1ffv s ARG 22 CO -0.26 -0.90 1.11 -0.51 -1.08 0.00 0.00 175.30 173.67 1ffv s LEU 23 N -3.39 3.04 0.28 -1.89 1.43 -1.26 -4.93 118.68 111.95 1ffv s LEU 23 Ca 0.69 1.97 -0.29 0.00 -1.03 0.00 0.00 54.13 55.46 1ffv s LEU 23 Cb -0.33 -4.54 -0.10 0.00 0.03 0.00 0.00 46.19 41.25 1ffv s LEU 23 CO 0.39 -2.29 1.13 -0.13 0.23 0.00 0.00 176.35 175.68 1ffv s ARG 24 N -4.70 4.60 0.26 1.70 0.52 -1.26 -4.95 118.95 115.13 1ffv s ARG 24 Ca 0.64 1.85 0.14 0.00 -0.52 0.00 0.00 55.73 57.84 1ffv s ARG 24 Cb -0.20 -3.18 0.12 0.00 0.52 0.00 0.00 34.95 32.21 1ffv s ARG 24 CO 0.54 0.15 1.46 0.87 0.02 0.00 0.00 175.30 178.35 1ffv h LYS 25 N 3.84 0.00 -0.40 3.54 1.57 -1.94 -3.31 116.57 119.88 1ffv h LYS 25 Ca -0.47 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.18 1ffv h LYS 25 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1ffv h LYS 25 CO 0.67 0.58 -0.26 0.93 -0.57 0.00 0.00 179.45 180.80 1ffv h GLU 26 N 0.00 0.83 -0.82 3.15 3.07 -1.92 -3.36 114.58 115.53 1ffv h GLU 26 Ca -0.01 -0.36 0.16 0.00 -0.50 0.00 0.00 59.36 58.65 1ffv h GLU 26 Cb 1.38 -0.02 -0.15 0.00 -0.84 0.00 0.00 28.75 29.11 1ffv h GLU 26 CO 0.08 1.00 -0.21 -0.44 -1.40 0.00 0.00 179.01 178.03 1ffv h ASP 27 N 0.71 -0.77 -1.00 1.42 5.19 -1.99 -3.10 116.42 116.89 1ffv h ASP 27 Ca 0.09 0.25 0.16 0.00 -0.62 0.00 0.00 57.03 56.91 1ffv h ASP 27 Cb 0.80 0.51 -0.17 0.00 0.18 0.00 0.00 39.33 40.65 1ffv h ASP 27 CO 0.07 -0.27 -0.36 0.00 -3.12 0.00 0.00 179.24 175.55 1ffv h ALA 28 N 1.81 0.26 -0.31 3.45 0.00 -1.82 0.78 119.26 123.42 1ffv h ALA 28 Ca 0.39 0.30 -0.13 0.00 0.00 0.00 0.00 54.91 55.47 1ffv h ALA 28 Cb 0.60 0.96 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1ffv h ALA 28 CO -0.84 -0.58 -0.33 0.07 0.00 0.00 0.00 179.25 177.57 1ffv h ARG 29 N -0.00 0.78 -0.57 0.00 0.11 -1.84 -3.22 114.38 109.64 1ffv h ARG 29 Ca 0.37 -0.42 -0.09 0.00 0.10 0.00 0.00 59.98 59.95 1ffv h ARG 29 Cb 0.62 0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.70 1ffv h ARG 29 CO -1.00 1.05 0.01 0.74 0.10 0.00 0.00 179.97 180.87 1ffv h PHE 30 N 0.55 1.04 0.00 4.08 0.04 -1.21 0.36 116.94 121.79 1ffv h PHE 30 Ca 0.05 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1ffv h PHE 30 Cb 0.91 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 38.78 1ffv h PHE 30 CO 0.07 0.92 0.00 0.44 -0.60 0.00 0.00 178.31 179.14 1ffv n ILE 31 N -4.19 0.22 -0.32 -0.55 -5.35 0.12 -2.70 119.36 106.58 1ffv n ILE 31 Ca 0.03 0.06 0.03 0.00 -0.27 0.00 0.00 62.75 62.59 1ffv n ILE 31 Cb 0.32 -0.67 0.04 0.00 -1.74 0.00 0.00 39.64 37.59 1ffv n ILE 31 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ffv n GLN 32 N -1.24 2.45 -2.72 6.28 6.02 -1.02 -5.00 117.38 122.14 1ffv n GLN 32 Ca 0.12 -1.76 -0.16 0.00 -0.01 0.00 0.00 57.00 55.19 1ffv n GLN 32 Cb 0.17 -1.12 0.02 0.00 1.02 0.00 0.00 30.24 30.33 1ffv n GLN 32 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ffv n GLY 33 N -0.74 -0.20 0.73 1.08 0.00 -0.96 -4.92 105.19 100.18 1ffv n GLY 33 Ca 0.04 -0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.01 1ffv n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ffv n LYS 34 N -3.03 2.61 -1.44 1.61 4.76 0.12 -5.01 118.16 117.78 1ffv n LYS 34 Ca -0.10 -2.80 -0.29 0.00 -2.87 0.00 0.00 58.31 52.25 1ffv n LYS 34 Cb 0.60 -1.78 0.12 0.00 -1.84 0.00 0.00 35.03 32.13 1ffv n LYS 34 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1ffv s GLY 35 N -2.12 1.60 -0.45 0.72 0.00 -1.23 -4.80 107.32 101.03 1ffv s GLY 35 Ca 0.40 -0.32 0.02 0.00 0.00 0.00 0.00 44.72 44.83 1ffv s GLY 35 CO 0.08 0.19 0.24 0.21 0.00 0.00 0.00 173.10 173.82 1ffv s ASN 36 N -3.81 3.75 0.28 1.64 2.47 -1.26 -5.05 114.94 112.96 1ffv s ASN 36 Ca 0.63 -2.69 0.01 0.00 0.42 0.00 0.00 52.86 51.23 1ffv s ASN 36 Cb -0.16 -1.13 -0.04 0.00 -1.45 0.00 0.00 41.25 38.48 1ffv s ASN 36 CO 0.55 -0.26 0.46 -0.31 -3.72 0.00 0.00 177.10 173.81 1ffv s TYR 37 N 0.25 3.48 0.30 0.43 2.02 -1.26 -0.93 117.35 121.65 1ffv s TYR 37 Ca 0.18 0.26 0.04 0.00 -0.37 0.00 0.00 57.07 57.17 1ffv s TYR 37 Cb -0.24 -1.80 0.79 0.00 -0.40 0.00 0.00 41.96 40.30 1ffv s TYR 37 CO 0.00 0.28 1.61 0.28 -1.57 0.00 0.00 175.55 176.15 1ffv h VAL 38 N 1.09 0.17 0.00 0.71 2.07 -1.94 0.32 116.25 118.67 1ffv h VAL 38 Ca -0.50 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1ffv h VAL 38 Cb 1.21 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1ffv h VAL 38 CO 0.63 0.02 0.00 -0.67 0.02 0.00 0.00 177.57 177.57 1ffv n ASP 39 N -5.34 0.00 0.07 0.57 2.03 -1.26 -2.51 116.55 110.11 1ffv n ASP 39 Ca 0.24 -0.85 0.12 0.00 0.52 0.00 0.00 54.79 54.81 1ffv n ASP 39 Cb 0.77 -0.02 0.11 0.00 -0.72 0.00 0.00 41.12 41.27 1ffv n ASP 39 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1ffv h ASP 40 N 0.00 0.00 -3.27 1.67 3.32 -0.73 -3.46 116.42 113.95 1ffv h ASP 40 Ca 0.00 -0.18 -0.53 0.00 0.02 0.00 0.00 57.03 56.33 1ffv h ASP 40 Cb 0.02 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.57 1ffv h ASP 40 CO 0.00 0.09 0.55 -0.63 -1.72 0.00 0.00 179.24 177.54 1ffv s ILE 41 N -3.22 3.94 -0.07 0.35 1.01 -1.05 -5.00 121.20 117.17 1ffv s ILE 41 Ca 0.04 1.45 -0.00 0.00 0.00 0.00 0.00 60.65 62.14 1ffv s ILE 41 Cb 0.13 -3.93 0.02 0.00 0.01 0.00 0.00 42.46 38.69 1ffv s ILE 41 CO 0.75 0.14 -0.03 -0.54 0.00 0.00 0.00 174.94 175.26 1ffv s LYS 42 N 0.73 0.83 0.20 2.79 1.02 -1.26 -5.09 119.74 118.95 1ffv s LYS 42 Ca 0.57 -0.03 0.11 0.00 0.02 0.00 0.00 55.97 56.63 1ffv s LYS 42 Cb -0.30 -1.00 -0.04 0.00 -0.52 0.00 0.00 37.83 35.96 1ffv s LYS 42 CO 0.31 -0.20 -0.22 -1.64 -0.92 0.00 0.00 175.35 172.67 1ffv s MET 43 N 1.48 1.48 0.28 1.68 -1.94 -1.26 -5.08 119.30 115.94 1ffv s MET 43 Ca -0.02 -1.53 -0.30 0.00 -1.71 0.00 0.00 55.69 52.13 1ffv s MET 43 Cb -0.13 -1.72 -0.11 0.00 2.01 0.00 0.00 34.83 34.88 1ffv s MET 43 CO -0.03 0.36 1.62 -2.14 -0.01 0.00 0.00 175.02 174.82 1ffv s PRO 44 N -2.80 4.12 0.00 2.03 0.02 -1.26 -2.06 135.00 135.05 1ffv s PRO 44 Ca 0.21 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1ffv s PRO 44 Cb -0.07 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.42 1ffv s PRO 44 CO 0.10 -0.66 0.00 0.41 -0.33 0.00 0.00 177.00 176.51 1ffv n GLY 45 N 2.51 0.32 3.69 0.52 0.00 -1.26 -4.60 105.19 106.37 1ffv n GLY 45 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1ffv n GLY 45 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ffv s MET 46 N -0.83 4.20 0.41 1.61 0.00 -0.87 -4.39 119.30 119.44 1ffv s MET 46 Ca 0.00 2.34 0.08 0.00 0.00 0.00 0.00 55.69 58.11 1ffv s MET 46 Cb 0.00 -3.51 -0.01 0.00 0.00 0.00 0.00 34.83 31.31 1ffv s MET 46 CO 0.00 -0.71 0.42 -0.51 0.00 0.00 0.00 175.02 174.22 1ffv s LEU 47 N 2.34 3.47 -0.05 4.11 1.43 0.03 -4.94 118.68 125.07 1ffv s LEU 47 Ca 0.73 -0.66 0.05 0.00 -1.03 0.00 0.00 54.13 53.23 1ffv s LEU 47 Cb -0.41 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 1ffv s LEU 47 CO 0.32 -0.67 -0.22 -2.28 0.23 0.00 0.00 176.35 173.73 1ffv s HIS 48 N -2.44 2.50 -0.09 0.29 2.46 0.87 -0.97 115.29 117.92 1ffv s HIS 48 Ca 0.50 -0.52 0.02 0.00 0.47 0.00 0.00 55.06 55.52 1ffv s HIS 48 Cb -0.05 -1.60 -0.02 0.00 -0.13 0.00 0.00 32.58 30.78 1ffv s HIS 48 CO 0.29 -0.08 -0.13 1.41 -2.47 0.00 0.00 174.74 173.75 1ffv s MET 49 N -0.36 2.95 0.21 2.88 1.75 -0.29 0.14 119.30 126.59 1ffv s MET 49 Ca 0.03 -0.69 0.08 0.00 -1.25 0.00 0.00 55.69 53.86 1ffv s MET 49 Cb -0.12 -2.51 -0.05 0.00 2.84 0.00 0.00 34.83 34.99 1ffv s MET 49 CO 0.02 0.42 -0.14 0.34 -0.65 0.00 0.00 175.02 175.01 1ffv s ASP 50 N -0.19 2.60 -0.09 1.11 -1.08 -0.72 -4.57 116.67 113.73 1ffv s ASP 50 Ca 0.00 -1.04 0.03 0.00 -0.52 0.00 0.00 52.55 51.02 1ffv s ASP 50 Cb -0.13 -0.14 -0.02 0.00 -1.46 0.00 0.00 42.92 41.17 1ffv s ASP 50 CO 0.03 -0.18 -0.17 -0.63 0.52 0.00 0.00 175.17 174.74 1ffv s ILE 51 N -2.97 2.74 -0.28 4.11 1.01 -1.26 -1.57 121.20 122.97 1ffv s ILE 51 Ca 0.23 -0.80 -0.24 0.00 0.00 0.00 0.00 60.65 59.83 1ffv s ILE 51 Cb -0.00 -2.09 -0.00 0.00 0.01 0.00 0.00 42.46 40.38 1ffv s ILE 51 CO 0.07 0.56 0.83 -0.69 0.00 0.00 0.00 174.94 175.71 1ffv s VAL 52 N -0.08 4.78 0.20 2.92 1.01 0.12 -4.97 120.40 124.38 1ffv s VAL 52 Ca -0.03 1.40 0.07 0.00 0.00 0.00 0.00 61.98 63.41 1ffv s VAL 52 Cb -0.14 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 1ffv s VAL 52 CO 0.04 -0.20 0.09 -0.13 0.00 0.00 0.00 175.10 174.90 1ffv s ARG 53 N 2.98 2.67 0.05 2.72 0.52 -1.26 -0.77 118.95 125.85 1ffv s ARG 53 Ca 0.35 -1.06 -0.31 0.00 -0.52 0.00 0.00 55.73 54.20 1ffv s ARG 53 Cb -0.14 -2.47 -0.07 0.00 0.52 0.00 0.00 34.95 32.78 1ffv s ARG 53 CO 0.11 0.44 1.55 0.00 0.02 0.00 0.00 175.30 177.42 1ffv s ALA 54 N -1.90 3.65 -0.70 2.13 0.00 0.32 -4.83 121.76 120.42 1ffv s ALA 54 Ca 0.30 1.10 0.25 0.00 0.00 0.00 0.00 51.96 53.61 1ffv s ALA 54 Cb -0.09 -3.65 0.63 0.00 0.00 0.00 0.00 23.12 20.01 1ffv s ALA 54 CO 0.22 -1.01 1.60 -0.35 0.00 0.00 0.00 175.76 176.21 1ffv n PRO 55 N 5.42 0.27 -4.43 0.00 -0.04 -1.26 0.54 135.00 135.50 1ffv n PRO 55 Ca 0.15 0.16 -0.25 0.00 -0.04 0.00 0.00 63.50 63.52 1ffv n PRO 55 Cb 0.42 -1.75 -0.09 0.00 -0.04 0.00 0.00 33.50 32.03 1ffv n PRO 55 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1ffv s ILE 56 N -3.12 2.48 -0.10 0.52 -4.36 -1.26 -4.88 121.20 110.47 1ffv s ILE 56 Ca 0.09 -2.08 0.15 0.00 -0.26 0.00 0.00 60.65 58.55 1ffv s ILE 56 Cb 0.13 -2.72 -0.10 0.00 1.25 0.00 0.00 42.46 41.02 1ffv s ILE 56 CO 0.65 -0.21 0.99 0.00 0.24 0.00 0.00 174.94 176.60 1ffv h ALA 57 N 1.92 0.65 -2.19 2.27 0.00 -1.85 -3.11 119.26 116.94 1ffv h ALA 57 Ca -0.42 -0.82 -0.01 0.00 0.00 0.00 0.00 54.91 53.65 1ffv h ALA 57 Cb 1.25 0.18 -0.23 0.00 0.00 0.00 0.00 17.79 19.00 1ffv h ALA 57 CO 0.68 0.95 -0.09 -1.58 0.00 0.00 0.00 179.25 179.20 1ffv s HIS 58 N -2.88 -0.96 0.00 0.00 5.65 -1.26 -1.79 115.29 114.05 1ffv s HIS 58 Ca -0.01 1.91 0.00 0.00 0.25 0.00 0.00 55.06 57.21 1ffv s HIS 58 Cb 0.08 0.55 0.00 0.00 -1.18 0.00 0.00 32.58 32.03 1ffv s HIS 58 CO 0.80 -0.49 0.00 0.41 -0.65 0.00 0.00 174.74 174.80 1ffv n GLY 59 N 4.46 1.82 3.79 1.59 0.00 -1.08 -1.53 105.19 114.24 1ffv n GLY 59 Ca -0.20 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 44.67 1ffv n GLY 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ffv s ARG 60 N -2.00 4.46 -0.46 1.61 0.52 0.21 -0.68 118.95 122.61 1ffv s ARG 60 Ca 0.00 1.14 -0.21 0.00 -0.52 0.00 0.00 55.73 56.14 1ffv s ARG 60 Cb 0.00 -2.88 0.03 0.00 0.52 0.00 0.00 34.95 32.62 1ffv s ARG 60 CO 0.00 0.36 0.71 0.42 0.02 0.00 0.00 175.30 176.80 1ffv s ILE 61 N -1.53 4.74 -0.10 1.52 1.01 -0.42 -0.71 121.20 125.71 1ffv s ILE 61 Ca 0.46 0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.94 1ffv s ILE 61 Cb -0.18 -4.29 -0.24 0.00 0.01 0.00 0.00 42.46 37.76 1ffv s ILE 61 CO 0.23 -0.72 0.93 0.11 0.00 0.00 0.00 174.94 175.50 1ffv h LYS 62 N 8.97 -0.00 -1.93 2.79 1.57 -1.02 -3.47 116.57 123.48 1ffv h LYS 62 Ca -0.26 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.50 1ffv h LYS 62 Cb 1.09 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.19 1ffv h LYS 62 CO 0.94 0.83 0.21 0.21 -0.57 0.00 0.00 179.45 181.07 1ffv s LYS 63 N -2.89 0.85 -0.14 3.15 2.20 -1.13 -4.99 119.74 116.78 1ffv s LYS 63 Ca -0.18 0.71 -0.01 0.00 -0.36 0.00 0.00 55.97 56.13 1ffv s LYS 63 Cb -0.01 0.41 -0.01 0.00 -1.51 0.00 0.00 37.83 36.70 1ffv s LYS 63 CO 0.68 -0.16 -0.12 0.42 -0.36 0.00 0.00 175.35 175.81 1ffv s ILE 64 N -0.14 3.10 -0.36 5.43 1.01 -1.26 -0.61 121.20 128.36 1ffv s ILE 64 Ca -0.03 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 59.86 1ffv s ILE 64 Cb -0.03 -2.31 0.01 0.00 0.01 0.00 0.00 42.46 40.13 1ffv s ILE 64 CO 0.03 0.52 0.23 -1.00 0.00 0.00 0.00 174.94 174.71 1ffv s HIS 65 N 0.44 3.23 -0.11 3.97 3.76 0.63 -4.95 115.29 122.25 1ffv s HIS 65 Ca -0.09 -0.58 0.20 0.00 -0.15 0.00 0.00 55.06 54.44 1ffv s HIS 65 Cb -0.16 -2.47 -0.29 0.00 1.11 0.00 0.00 32.58 30.76 1ffv s HIS 65 CO 0.05 -0.52 0.29 1.63 -0.85 0.00 0.00 174.74 175.34 1ffv n LYS 66 N 5.07 0.67 -0.22 1.40 5.02 -1.26 -3.34 118.16 125.49 1ffv n LYS 66 Ca -0.12 -0.10 0.03 0.00 -2.02 0.00 0.00 58.31 56.09 1ffv n LYS 66 Cb 0.48 -1.52 0.14 0.00 -0.02 0.00 0.00 35.03 34.11 1ffv n LYS 66 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1ffv h ASP 67 N 0.00 0.13 -0.59 4.39 3.32 -1.95 -0.61 116.42 121.12 1ffv h ASP 67 Ca -0.27 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 56.82 1ffv h ASP 67 Cb 1.61 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 41.26 1ffv h ASP 67 CO 0.01 0.06 0.08 0.00 -1.72 0.00 0.00 179.24 177.68 1ffv h ALA 68 N 1.51 0.78 -0.27 3.45 0.00 -1.86 -1.93 119.26 120.94 1ffv h ALA 68 Ca 0.36 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1ffv h ALA 68 Cb 0.53 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ffv h ALA 68 CO -0.40 0.54 -0.05 0.00 0.00 0.00 0.00 179.25 179.34 1ffv h ALA 69 N 1.01 0.37 -0.32 0.00 0.00 -1.69 -2.98 119.26 115.64 1ffv h ALA 69 Ca 0.18 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1ffv h ALA 69 Cb 0.44 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1ffv h ALA 69 CO 0.01 0.16 0.07 -0.07 0.00 0.00 0.00 179.25 179.42 1ffv h LEU 70 N 0.27 0.42 -0.76 0.00 3.38 -1.04 -2.72 115.31 114.86 1ffv h LEU 70 Ca 0.07 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1ffv h LEU 70 Cb 0.51 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1ffv h LEU 70 CO 0.02 0.44 -0.28 0.00 0.09 0.00 0.00 178.44 178.71 1ffv h ALA 71 N 1.62 0.93 -2.65 1.53 0.00 -1.29 -3.45 119.26 115.96 1ffv h ALA 71 Ca 0.11 -0.26 -0.52 0.00 0.00 0.00 0.00 54.91 54.24 1ffv h ALA 71 Cb 0.20 -0.05 0.06 0.00 0.00 0.00 0.00 17.79 18.00 1ffv h ALA 71 CO -0.00 0.35 0.99 1.41 0.00 0.00 0.00 179.25 182.00 1ffv s MET 72 N -3.45 4.14 0.25 0.00 0.00 -1.03 -4.93 119.30 114.28 1ffv s MET 72 Ca 0.02 2.57 -0.30 0.00 0.00 0.00 0.00 55.69 57.97 1ffv s MET 72 Cb 0.09 -3.10 -0.10 0.00 0.00 0.00 0.00 34.83 31.73 1ffv s MET 72 CO 0.67 -0.73 1.43 -1.25 0.00 0.00 0.00 175.02 175.14 1ffv s PRO 73 N 1.20 4.27 0.00 4.11 0.04 -1.26 -2.69 135.00 140.67 1ffv s PRO 73 Ca 0.74 2.29 0.00 0.00 0.04 0.00 0.00 61.00 64.07 1ffv s PRO 73 Cb -0.49 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 30.94 1ffv s PRO 73 CO 0.32 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.35 1ffv n GLY 74 N 2.21 2.36 3.68 0.56 0.00 -1.26 -4.99 105.19 107.76 1ffv n GLY 74 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1ffv n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ffv s VAL 75 N -2.57 5.09 -0.17 1.61 1.01 -1.10 -0.61 120.40 123.67 1ffv s VAL 75 Ca 0.00 1.10 0.16 0.00 0.00 0.00 0.00 61.98 63.24 1ffv s VAL 75 Cb 0.00 -3.90 -0.24 0.00 0.00 0.00 0.00 36.38 32.24 1ffv s VAL 75 CO 0.00 0.21 0.18 1.41 0.00 0.00 0.00 175.10 176.90 1ffv n HIS 76 N 4.44 0.22 -3.50 5.22 8.25 0.29 -4.92 115.22 125.21 1ffv n HIS 76 Ca -0.04 0.08 -0.12 0.00 -0.26 0.00 0.00 57.72 57.38 1ffv n HIS 76 Cb 0.51 -1.04 -0.04 0.00 1.12 0.00 0.00 29.99 30.54 1ffv n HIS 76 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ffv s ALA 77 N -2.51 -1.77 -0.10 -1.41 0.00 -1.20 -5.01 121.76 109.75 1ffv s ALA 77 Ca -0.10 1.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.90 1ffv s ALA 77 Cb 0.07 0.23 0.04 0.00 0.00 0.00 0.00 23.12 23.45 1ffv s ALA 77 CO 0.82 -0.56 0.01 0.08 0.00 0.00 0.00 175.76 176.11 1ffv s VAL 78 N -2.45 0.41 0.14 0.00 1.01 -1.26 -1.06 120.40 117.18 1ffv s VAL 78 Ca -0.01 -0.04 0.09 0.00 0.00 0.00 0.00 61.98 62.02 1ffv s VAL 78 Cb -0.01 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1ffv s VAL 78 CO -0.04 0.15 -0.18 -0.76 0.00 0.00 0.00 175.10 174.27 1ffv s LEU 79 N 1.95 2.68 0.00 3.92 1.43 0.10 -4.98 118.68 123.78 1ffv s LEU 79 Ca 0.04 -0.62 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 1ffv s LEU 79 Cb -0.13 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 1ffv s LEU 79 CO -0.06 0.16 0.09 0.35 0.23 0.00 0.00 176.35 177.12 1ffv n THR 80 N 0.60 0.00 0.28 5.49 -2.24 -1.26 -1.27 114.28 115.88 1ffv n THR 80 Ca -0.14 -1.29 0.14 0.00 -2.27 0.00 0.00 64.05 60.49 1ffv n THR 80 Cb 0.54 0.49 0.86 0.00 -2.10 0.00 0.00 70.33 70.11 1ffv n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffv h ALA 81 N 1.39 1.64 -0.46 6.98 0.00 -1.79 -1.65 119.26 125.37 1ffv h ALA 81 Ca -0.17 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1ffv h ALA 81 Cb 0.66 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1ffv h ALA 81 CO 0.26 -0.03 0.16 0.93 0.00 0.00 0.00 179.25 180.58 1ffv h GLU 82 N 0.00 0.66 0.00 0.00 4.39 -1.95 -0.44 114.58 117.24 1ffv h GLU 82 Ca 0.01 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1ffv h GLU 82 Cb 0.04 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1ffv h GLU 82 CO -0.00 0.57 0.00 -0.44 -1.16 0.00 0.00 179.01 177.98 1ffv h ASP 83 N 0.66 0.00 0.61 1.42 3.32 -1.69 -3.27 116.42 117.47 1ffv h ASP 83 Ca 0.16 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.98 1ffv h ASP 83 Cb 0.17 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 1ffv h ASP 83 CO -0.01 0.00 -1.54 -0.07 -1.72 0.00 0.00 179.24 175.90 1ffv h LEU 84 N 0.00 0.00 -0.53 1.55 4.07 -1.24 -3.40 115.31 115.75 1ffv h LEU 84 Ca 0.00 0.00 0.09 0.00 0.08 0.00 0.00 57.88 58.05 1ffv h LEU 84 Cb 0.83 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.50 1ffv h LEU 84 CO 0.00 0.79 0.11 0.11 -1.08 0.00 0.00 178.44 178.37 1ffv h LYS 85 N 0.00 0.24 0.00 1.13 1.57 -1.17 -0.89 116.57 117.45 1ffv h LYS 85 Ca -0.22 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1ffv h LYS 85 Cb 1.80 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 34.05 1ffv h LYS 85 CO 0.06 0.16 -0.00 -1.35 -0.57 0.00 0.00 179.45 177.75 1ffv h PRO 86 N 0.25 0.00 -0.24 3.15 0.11 -1.77 0.71 132.00 134.20 1ffv h PRO 86 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 1ffv h PRO 86 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1ffv h PRO 86 CO -0.35 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.72 1ffv n LEU 87 N -3.29 3.06 -3.68 2.35 4.77 -0.70 -4.96 117.00 114.56 1ffv n LEU 87 Ca -0.03 -1.36 -0.26 0.00 -0.03 0.00 0.00 56.01 54.33 1ffv n LEU 87 Cb 0.08 -0.15 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 1ffv n LEU 87 CO 0.22 0.63 0.19 0.29 -1.33 0.00 0.00 177.39 177.39 1ffv n LYS 88 N 1.23 -7.02 -0.08 3.23 5.02 0.24 -4.93 118.16 115.85 1ffv n LYS 88 Ca 0.15 0.75 0.03 0.00 -2.02 0.00 0.00 58.31 57.22 1ffv n LYS 88 Cb 0.53 -5.75 0.07 0.00 -0.02 0.00 0.00 35.03 29.86 1ffv n LYS 88 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ffv n LEU 89 N -4.86 2.39 0.15 -0.35 4.77 -0.42 -4.57 117.00 114.10 1ffv n LEU 89 Ca 0.02 -2.11 0.13 0.00 -0.03 0.00 0.00 56.01 54.02 1ffv n LEU 89 Cb 0.55 -0.12 0.47 0.00 -2.33 0.00 0.00 43.42 41.99 1ffv n LEU 89 CO 0.68 0.59 0.88 1.12 -1.33 0.00 0.00 177.39 179.33 1ffv h HIS 90 N 0.71 0.00 -3.98 -1.77 2.07 -1.86 -3.41 115.15 106.91 1ffv h HIS 90 Ca 0.00 0.00 -0.40 0.00 -2.85 0.00 0.00 60.37 57.12 1ffv h HIS 90 Cb 0.64 0.00 -0.23 0.00 2.57 0.00 0.00 27.41 30.40 1ffv h HIS 90 CO 0.09 0.00 -0.78 -1.58 -3.07 0.00 0.00 177.93 172.60 1ffv s TRP 91 N -3.29 1.10 0.04 6.12 0.52 -1.26 0.48 118.94 122.65 1ffv s TRP 91 Ca 0.06 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 55.78 1ffv s TRP 91 Cb 0.10 -0.64 -0.02 0.00 -1.15 0.00 0.00 33.47 31.76 1ffv s TRP 91 CO 0.48 0.03 -0.07 0.00 0.02 0.00 0.00 176.95 177.41 1ffv s MET 92 N -1.47 0.51 0.53 4.98 0.23 0.22 -4.84 119.30 119.45 1ffv s MET 92 Ca -0.02 -0.76 -0.19 0.00 -1.03 0.00 0.00 55.69 53.69 1ffv s MET 92 Cb -0.09 -0.23 -0.07 0.00 -1.53 0.00 0.00 34.83 32.92 1ffv s MET 92 CO 0.02 0.03 1.05 -1.25 -2.03 0.00 0.00 175.02 172.84 1ffv s PRO 93 N -1.66 3.60 0.36 3.16 0.04 -1.26 -0.61 135.00 138.62 1ffv s PRO 93 Ca -0.10 1.34 0.09 0.00 0.04 0.00 0.00 61.00 62.36 1ffv s PRO 93 Cb -0.09 -2.06 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 1ffv s PRO 93 CO -0.00 -0.60 -0.02 0.95 0.04 0.00 0.00 177.00 177.37 1ffv s THR 94 N -2.11 2.34 0.16 1.26 -4.23 -0.36 -4.83 115.64 107.87 1ffv s THR 94 Ca 0.67 -2.05 0.34 0.00 -1.18 0.00 0.00 61.69 59.46 1ffv s THR 94 Cb -0.17 -2.79 0.35 0.00 1.34 0.00 0.00 72.50 71.23 1ffv s THR 94 CO 0.26 -0.15 2.02 -0.07 -0.54 0.00 0.00 174.62 176.14 1ffv h LEU 95 N 1.86 0.00 -1.02 4.79 3.38 -1.84 -1.89 115.31 120.58 1ffv h LEU 95 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1ffv h LEU 95 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1ffv h LEU 95 CO 0.71 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.24 1ffv n ALA 96 N -1.97 2.56 -0.74 1.53 0.00 -1.23 -4.56 120.51 116.10 1ffv n ALA 96 Ca -0.01 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1ffv n ALA 96 Cb 0.14 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1ffv n ALA 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffv n GLY 97 N 1.18 0.68 1.74 0.00 0.00 -0.71 -4.89 105.19 103.19 1ffv n GLY 97 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 1ffv n GLY 97 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ffv n ASP 98 N 0.00 1.61 -4.35 1.61 2.03 -1.26 -4.58 116.55 111.61 1ffv n ASP 98 Ca 0.00 -1.83 -0.25 0.00 0.52 0.00 0.00 54.79 53.23 1ffv n ASP 98 Cb 0.00 -0.06 -0.12 0.00 -0.72 0.00 0.00 41.12 40.22 1ffv n ASP 98 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1ffv s VAL 99 N -1.10 1.99 0.03 5.18 -7.23 -1.26 -1.22 120.40 116.78 1ffv s VAL 99 Ca 0.17 -1.81 0.04 0.00 -1.81 0.00 0.00 61.98 58.58 1ffv s VAL 99 Cb -0.01 -1.85 -0.02 0.00 0.56 0.00 0.00 36.38 35.06 1ffv s VAL 99 CO 0.11 -0.12 -0.13 0.00 -0.31 0.00 0.00 175.10 174.65 1ffv s ALA 100 N -1.52 1.05 0.06 1.32 0.00 0.22 -4.61 121.76 118.29 1ffv s ALA 100 Ca 0.14 -0.73 -0.31 0.00 0.00 0.00 0.00 51.96 51.06 1ffv s ALA 100 Cb -0.08 -0.18 -0.06 0.00 0.00 0.00 0.00 23.12 22.80 1ffv s ALA 100 CO 0.07 0.20 1.26 0.00 0.00 0.00 0.00 175.76 177.29 1ffv s ALA 101 N -0.74 3.46 -0.11 0.00 0.00 -1.26 -0.61 121.76 122.50 1ffv s ALA 101 Ca 0.01 0.91 -0.27 0.00 0.00 0.00 0.00 51.96 52.61 1ffv s ALA 101 Cb -0.07 -3.48 -0.28 0.00 0.00 0.00 0.00 23.12 19.29 1ffv s ALA 101 CO 0.01 -0.53 0.81 0.28 0.00 0.00 0.00 175.76 176.33 1ffv h VAL 102 N 4.50 1.71 -3.46 0.00 2.07 -0.21 -3.45 116.25 117.40 1ffv h VAL 102 Ca -0.41 -2.41 -0.40 0.00 0.82 0.00 0.00 66.70 64.30 1ffv h VAL 102 Cb 1.21 3.33 -0.34 0.00 -1.52 0.00 0.00 31.29 33.97 1ffv h VAL 102 CO 0.83 0.64 -0.77 -0.76 0.02 0.00 0.00 177.57 177.54 1ffv s LEU 103 N -8.12 1.27 -0.05 2.57 1.43 -1.22 -4.73 118.68 109.83 1ffv s LEU 103 Ca -0.17 -0.11 -0.36 0.00 -1.03 0.00 0.00 54.13 52.45 1ffv s LEU 103 Cb -0.02 -0.41 -0.14 0.00 0.03 0.00 0.00 46.19 45.64 1ffv s LEU 103 CO 0.74 -0.07 1.65 0.00 0.23 0.00 0.00 176.35 178.90 1ffv n ALA 104 N 4.11 0.22 -1.64 4.21 0.00 0.42 -4.64 120.51 123.20 1ffv n ALA 104 Ca -0.24 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1ffv n ALA 104 Cb 0.51 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1ffv n ALA 104 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ffv n ASP 105 N 4.64 0.00 0.11 0.00 2.03 -1.26 -4.50 116.55 117.57 1ffv n ASP 105 Ca 0.22 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.51 1ffv n ASP 105 Cb 0.22 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.66 1ffv n ASP 105 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1ffv h GLU 106 N 0.00 0.00 -3.32 -0.67 5.08 -1.92 -3.44 114.58 110.31 1ffv h GLU 106 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ffv h GLU 106 Cb 0.00 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 1ffv h GLU 106 CO 0.00 0.71 0.06 -1.59 -1.00 0.00 0.00 179.01 177.19 1ffv s LYS 107 N -3.08 1.69 -0.08 2.33 -2.85 -1.26 -1.30 119.74 115.18 1ffv s LYS 107 Ca 0.01 -1.14 0.00 0.00 -1.00 0.00 0.00 55.97 53.85 1ffv s LYS 107 Cb 0.10 0.54 -0.03 0.00 -2.06 0.00 0.00 37.83 36.38 1ffv s LYS 107 CO 0.77 -0.74 -0.06 0.14 0.10 0.00 0.00 175.35 175.55 1ffv s VAL 108 N -3.92 3.73 -0.48 1.79 -7.23 0.15 -4.75 120.40 109.69 1ffv s VAL 108 Ca 0.17 -0.46 0.20 0.00 -1.81 0.00 0.00 61.98 60.08 1ffv s VAL 108 Cb -0.03 -2.54 -0.27 0.00 0.56 0.00 0.00 36.38 34.09 1ffv s VAL 108 CO 0.08 0.58 0.65 1.41 -0.31 0.00 0.00 175.10 177.52 1ffv n HIS 109 N 2.45 0.00 -3.57 2.82 -0.00 -1.26 -2.63 115.22 113.03 1ffv n HIS 109 Ca -0.18 0.00 -0.17 0.00 -0.00 0.00 0.00 57.72 57.37 1ffv n HIS 109 Cb 0.53 -0.24 -0.07 0.00 -0.00 0.00 0.00 29.99 30.21 1ffv n HIS 109 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 1ffv s PHE 110 N -3.18 -0.57 0.45 4.41 -0.71 -0.74 -3.82 117.98 113.83 1ffv s PHE 110 Ca -0.00 0.99 -0.25 0.00 -1.04 0.00 0.00 56.93 56.63 1ffv s PHE 110 Cb 0.14 0.35 -0.08 0.00 -1.21 0.00 0.00 43.02 42.22 1ffv s PHE 110 CO 0.85 -0.56 1.41 -1.14 -1.34 0.00 0.00 175.22 174.44 1ffv s GLN 111 N -1.16 3.66 -0.07 1.99 0.74 -1.18 -2.29 119.66 121.35 1ffv s GLN 111 Ca -0.11 2.39 0.00 0.00 0.05 0.00 0.00 55.36 57.68 1ffv s GLN 111 Cb -0.01 -2.63 0.00 0.00 1.10 0.00 0.00 33.01 31.47 1ffv s GLN 111 CO 0.09 -0.82 0.00 -1.33 -0.55 0.00 0.00 175.29 172.67 1ffv n MET 112 N -0.23 -0.51 -2.04 1.67 2.81 0.19 -4.88 117.12 114.12 1ffv n MET 112 Ca 0.05 0.20 -0.34 0.00 -1.81 0.00 0.00 57.70 55.80 1ffv n MET 112 Cb 0.42 -3.64 0.02 0.00 -0.71 0.00 0.00 33.22 29.32 1ffv n MET 112 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 1ffv s GLN 113 N -0.77 3.10 -0.21 0.03 0.74 -0.97 -4.44 119.66 117.14 1ffv s GLN 113 Ca 0.00 1.56 -0.29 0.00 0.05 0.00 0.00 55.36 56.68 1ffv s GLN 113 Cb 0.00 -1.98 -0.02 0.00 1.10 0.00 0.00 33.01 32.11 1ffv s GLN 113 CO 0.00 -1.04 1.54 -1.21 -0.55 0.00 0.00 175.29 174.02 1ffv s GLU 114 N -3.58 3.90 -0.18 1.67 8.01 -1.26 -0.52 118.70 126.74 1ffv s GLU 114 Ca 0.71 1.66 0.01 0.00 0.01 0.00 0.00 54.97 57.36 1ffv s GLU 114 Cb -0.23 -3.98 -0.12 0.00 -4.31 0.00 0.00 34.13 25.49 1ffv s GLU 114 CO 0.33 -1.16 -0.16 0.28 0.01 0.00 0.00 175.26 174.56 1ffv n VAL 115 N 6.17 1.03 -3.83 2.63 0.31 0.05 -0.44 118.33 124.25 1ffv n VAL 115 Ca 0.17 -0.39 -0.09 0.00 -0.01 0.00 0.00 64.34 64.02 1ffv n VAL 115 Cb 0.45 -1.15 -0.04 0.00 -0.91 0.00 0.00 33.84 32.19 1ffv n VAL 115 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ffv s ALA 116 N -2.36 -0.76 0.05 3.52 0.00 -1.01 -4.28 121.76 116.93 1ffv s ALA 116 Ca -0.24 -0.43 0.03 0.00 0.00 0.00 0.00 51.96 51.32 1ffv s ALA 116 Cb 0.06 0.90 -0.03 0.00 0.00 0.00 0.00 23.12 24.06 1ffv s ALA 116 CO 0.41 -0.84 -0.11 0.96 0.00 0.00 0.00 175.76 176.19 1ffv s ILE 117 N -3.92 0.79 0.05 0.00 -4.36 -0.40 0.13 121.20 113.50 1ffv s ILE 117 Ca 0.13 -1.15 0.08 0.00 -0.26 0.00 0.00 60.65 59.45 1ffv s ILE 117 Cb -0.01 -0.81 -0.03 0.00 1.25 0.00 0.00 42.46 42.86 1ffv s ILE 117 CO 0.02 -0.29 -0.22 0.68 0.24 0.00 0.00 174.94 175.37 1ffv s VAL 118 N -1.28 1.78 -0.12 8.37 -7.23 -0.61 -0.72 120.40 120.58 1ffv s VAL 118 Ca -0.06 -1.27 0.03 0.00 -1.81 0.00 0.00 61.98 58.87 1ffv s VAL 118 Cb -0.10 -1.55 0.00 0.00 0.56 0.00 0.00 36.38 35.30 1ffv s VAL 118 CO 0.01 0.22 -0.22 -0.63 -0.31 0.00 0.00 175.10 174.17 1ffv s ILE 119 N -0.83 2.15 0.28 -0.62 1.09 -0.22 -1.75 121.20 121.30 1ffv s ILE 119 Ca 0.08 -0.97 0.03 0.00 -1.10 0.00 0.00 60.65 58.70 1ffv s ILE 119 Cb -0.09 -1.85 -0.04 0.00 -1.06 0.00 0.00 42.46 39.43 1ffv s ILE 119 CO 0.02 0.55 0.18 0.00 -0.10 0.00 0.00 174.94 175.59 1ffv s ALA 120 N 0.57 1.73 0.46 9.38 0.00 0.12 -0.55 121.76 133.47 1ffv s ALA 120 Ca -0.13 -1.82 0.12 0.00 0.00 0.00 0.00 51.96 50.14 1ffv s ALA 120 Cb -0.17 1.29 1.04 0.00 0.00 0.00 0.00 23.12 25.28 1ffv s ALA 120 CO 0.04 -0.57 2.07 -0.44 0.00 0.00 0.00 175.76 176.86 1ffv h ASP 121 N 2.30 0.18 -5.14 0.00 3.32 -1.15 0.25 116.42 116.18 1ffv h ASP 121 Ca -0.32 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.66 1ffv h ASP 121 Cb 1.25 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.72 1ffv h ASP 121 CO 0.48 0.18 0.12 1.51 -1.72 0.00 0.00 179.24 179.82 1ffv s ASP 122 N -6.92 0.14 0.40 6.45 1.47 -1.26 -4.48 116.67 112.47 1ffv s ASP 122 Ca -0.06 -1.09 0.19 0.00 1.18 0.00 0.00 52.55 52.76 1ffv s ASP 122 Cb 0.17 0.76 0.85 0.00 -0.34 0.00 0.00 42.92 44.36 1ffv s ASP 122 CO 0.70 -1.48 1.83 0.08 0.68 0.00 0.00 175.17 176.98 1ffv h ARG 123 N 2.05 0.00 0.05 2.11 0.11 -1.90 -1.84 114.38 114.96 1ffv h ARG 123 Ca -0.28 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.80 1ffv h ARG 123 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1ffv h ARG 123 CO 0.36 0.32 -0.02 1.88 0.10 0.00 0.00 179.97 182.61 1ffv h TYR 124 N 0.00 -0.06 -0.67 4.08 -1.99 -1.99 -1.53 116.97 114.81 1ffv h TYR 124 Ca -0.00 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.68 1ffv h TYR 124 Cb 0.71 0.02 -0.03 0.00 2.00 0.00 0.00 36.73 39.43 1ffv h TYR 124 CO 0.00 0.35 0.25 0.82 -0.00 0.00 0.00 178.16 179.58 1ffv h ILE 125 N -0.48 1.24 -0.61 -2.88 2.04 -1.96 -2.44 117.51 112.42 1ffv h ILE 125 Ca -0.01 -0.78 0.04 0.00 1.00 0.00 0.00 64.86 65.11 1ffv h ILE 125 Cb 0.43 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 1ffv h ILE 125 CO 0.01 0.31 0.35 0.00 0.00 0.00 0.00 178.15 178.82 1ffv h ALA 126 N 1.11 0.80 -0.52 1.87 0.00 -1.32 0.97 119.26 122.16 1ffv h ALA 126 Ca 0.22 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1ffv h ALA 126 Cb 0.23 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ffv h ALA 126 CO -0.02 0.04 0.13 0.00 0.00 0.00 0.00 179.25 179.41 1ffv h ALA 127 N 1.30 1.25 -0.45 0.00 0.00 -0.97 -1.59 119.26 118.81 1ffv h ALA 127 Ca 0.26 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1ffv h ALA 127 Cb 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1ffv h ALA 127 CO -0.15 0.52 0.03 -0.44 0.00 0.00 0.00 179.25 179.21 1ffv h ASP 128 N 0.77 0.75 -0.77 0.00 3.32 -0.85 -2.95 116.42 116.68 1ffv h ASP 128 Ca 0.17 -0.29 0.03 0.00 0.02 0.00 0.00 57.03 56.96 1ffv h ASP 128 Cb 0.27 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 1ffv h ASP 128 CO -0.00 0.85 0.51 0.00 -1.72 0.00 0.00 179.24 178.87 1ffv h ALA 129 N 0.92 1.53 -0.41 3.45 0.00 -0.19 -2.26 119.26 122.30 1ffv h ALA 129 Ca 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ffv h ALA 129 Cb 0.45 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1ffv h ALA 129 CO 0.02 0.40 0.23 0.28 0.00 0.00 0.00 179.25 180.18 1ffv h VAL 130 N 0.96 1.15 0.00 0.00 2.07 -1.15 -2.33 116.25 116.95 1ffv h VAL 130 Ca 0.30 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.41 1ffv h VAL 130 Cb 0.02 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1ffv h VAL 130 CO -0.08 0.15 -0.19 -0.33 0.02 0.00 0.00 177.57 177.13 1ffv h GLU 131 N 0.53 0.00 0.00 1.57 4.39 -1.34 -2.50 114.58 117.24 1ffv h GLU 131 Ca 0.14 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.75 1ffv h GLU 131 Cb 0.04 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1ffv h GLU 131 CO -0.02 0.19 -0.45 0.00 -1.16 0.00 0.00 179.01 177.57 1ffv h ALA 132 N 1.81 0.94 -1.94 3.43 0.00 -0.92 -3.42 119.26 119.16 1ffv h ALA 132 Ca -0.00 -0.41 -0.57 0.00 0.00 0.00 0.00 54.91 53.93 1ffv h ALA 132 Cb 0.39 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1ffv h ALA 132 CO 0.03 0.57 0.92 0.08 0.00 0.00 0.00 179.25 180.84 1ffv s VAL 133 N -3.53 4.28 -0.15 0.00 1.01 -0.94 -4.48 120.40 116.59 1ffv s VAL 133 Ca 0.00 1.45 -0.09 0.00 0.00 0.00 0.00 61.98 63.34 1ffv s VAL 133 Cb 0.11 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1ffv s VAL 133 CO 0.71 -0.51 0.15 -0.54 0.00 0.00 0.00 175.10 174.90 1ffv s LYS 134 N 4.00 3.77 -0.05 2.72 1.02 -1.21 -4.94 119.74 125.04 1ffv s LYS 134 Ca 0.52 -0.15 0.04 0.00 0.02 0.00 0.00 55.97 56.39 1ffv s LYS 134 Cb -0.14 -3.29 0.00 0.00 -0.52 0.00 0.00 37.83 33.88 1ffv s LYS 134 CO 0.21 0.57 -0.16 0.08 -0.92 0.00 0.00 175.35 175.13 1ffv s VAL 135 N -0.43 1.38 -0.18 3.17 1.01 -1.26 -0.27 120.40 123.82 1ffv s VAL 135 Ca 0.12 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 1ffv s VAL 135 Cb -0.12 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 1ffv s VAL 135 CO 0.02 0.40 0.09 -1.61 0.00 0.00 0.00 175.10 174.00 1ffv s GLU 136 N 0.25 3.96 0.18 2.72 2.02 0.22 -4.99 118.70 123.05 1ffv s GLU 136 Ca -0.08 -0.28 0.07 0.00 0.02 0.00 0.00 54.97 54.70 1ffv s GLU 136 Cb -0.13 -3.27 -0.04 0.00 0.10 0.00 0.00 34.13 30.79 1ffv s GLU 136 CO 0.03 0.35 -0.15 0.71 0.02 0.00 0.00 175.26 176.23 1ffv s TYR 137 N 0.17 1.62 -0.35 1.61 2.02 -1.26 -0.36 117.35 120.80 1ffv s TYR 137 Ca 0.06 -0.57 0.01 0.00 -0.37 0.00 0.00 57.07 56.20 1ffv s TYR 137 Cb -0.12 -0.79 0.09 0.00 -0.40 0.00 0.00 41.96 40.75 1ffv s TYR 137 CO -0.00 0.28 0.07 -0.51 -1.57 0.00 0.00 175.55 173.82 1ffv s ASP 138 N -3.02 4.89 0.48 2.29 1.01 0.11 -4.88 116.67 117.55 1ffv s ASP 138 Ca 0.18 -1.91 -0.24 0.00 0.71 0.00 0.00 52.55 51.29 1ffv s ASP 138 Cb -0.02 -1.69 -0.07 0.00 1.01 0.00 0.00 42.92 42.15 1ffv s ASP 138 CO 0.05 -0.39 1.40 -1.61 0.21 0.00 0.00 175.17 174.84 1ffv s GLU 139 N 1.05 3.52 0.17 8.23 2.02 -1.26 -0.62 118.70 131.80 1ffv s GLU 139 Ca 0.05 2.36 0.09 0.00 0.02 0.00 0.00 54.97 57.49 1ffv s GLU 139 Cb -0.20 -2.53 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 1ffv s GLU 139 CO -0.06 -0.93 -0.19 -0.51 0.02 0.00 0.00 175.26 173.60 1ffv s LEU 140 N -2.96 2.44 0.25 1.80 1.43 -0.58 -4.85 118.68 116.20 1ffv s LEU 140 Ca 0.64 -0.87 -0.31 0.00 -1.03 0.00 0.00 54.13 52.56 1ffv s LEU 140 Cb -0.43 -0.87 -0.12 0.00 0.03 0.00 0.00 46.19 44.81 1ffv s LEU 140 CO 0.54 -0.02 1.65 -2.16 0.23 0.00 0.00 176.35 176.59 1ffv s PRO 141 N -2.81 4.13 0.38 1.29 0.04 -1.26 -4.65 135.00 132.13 1ffv s PRO 141 Ca 0.17 2.58 -0.17 0.00 0.04 0.00 0.00 61.00 63.62 1ffv s PRO 141 Cb -0.06 -3.05 -0.09 0.00 0.04 0.00 0.00 34.50 31.34 1ffv s PRO 141 CO 0.07 -0.68 0.83 0.08 0.04 0.00 0.00 177.00 177.34 1ffv s VAL 142 N 0.59 4.58 -0.24 -0.36 1.01 -1.26 -4.89 120.40 119.83 1ffv s VAL 142 Ca 0.69 1.11 0.01 0.00 0.00 0.00 0.00 61.98 63.79 1ffv s VAL 142 Cb -0.48 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.33 1ffv s VAL 142 CO 0.40 -0.31 -0.05 -0.69 0.00 0.00 0.00 175.10 174.45 1ffv s VAL 143 N -2.15 1.59 -0.05 2.92 1.01 -1.26 -4.98 120.40 117.48 1ffv s VAL 143 Ca 0.57 -1.31 0.05 0.00 0.00 0.00 0.00 61.98 61.28 1ffv s VAL 143 Cb -0.10 -1.87 -0.07 0.00 0.00 0.00 0.00 36.38 34.35 1ffv s VAL 143 CO 0.19 -0.14 0.12 2.30 0.00 0.00 0.00 175.10 177.56 1ffv n ILE 144 N 4.64 0.00 -4.17 2.22 -5.35 -1.26 -0.95 119.36 114.49 1ffv n ILE 144 Ca -0.11 -0.17 -0.34 0.00 -0.27 0.00 0.00 62.75 61.85 1ffv n ILE 144 Cb 0.44 0.54 -0.12 0.00 -1.74 0.00 0.00 39.64 38.76 1ffv n ILE 144 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1ffv s ASP 145 N -2.27 5.05 0.26 7.28 -1.08 -1.26 -4.97 116.67 119.68 1ffv s ASP 145 Ca -0.01 -0.10 -0.03 0.00 -0.52 0.00 0.00 52.55 51.90 1ffv s ASP 145 Cb 0.03 -1.85 0.45 0.00 -1.46 0.00 0.00 42.92 40.09 1ffv s ASP 145 CO 0.19 0.13 1.81 -0.65 0.52 0.00 0.00 175.17 177.17 1ffv h PRO 146 N 7.00 0.79 -0.48 4.34 0.11 -1.94 -1.52 132.00 140.31 1ffv h PRO 146 Ca -0.34 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.67 1ffv h PRO 146 Cb 1.18 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 1ffv h PRO 146 CO 0.64 0.53 0.12 0.82 -0.21 0.00 0.00 178.00 179.89 1ffv h ILE 147 N 0.82 1.24 0.00 4.15 1.08 -1.98 -2.45 117.51 120.37 1ffv h ILE 147 Ca 0.43 -0.83 -0.04 0.00 -0.39 0.00 0.00 64.86 64.03 1ffv h ILE 147 Cb 0.43 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 1ffv h ILE 147 CO -0.26 0.30 -0.19 0.44 -0.69 0.00 0.00 178.15 177.75 1ffv h ASP 148 N 0.65 0.00 0.29 1.72 3.45 -1.85 -2.86 116.42 117.81 1ffv h ASP 148 Ca 0.15 0.00 -0.07 0.00 0.43 0.00 0.00 57.03 57.54 1ffv h ASP 148 Cb 0.33 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.09 1ffv h ASP 148 CO 0.00 0.19 -0.32 0.00 -1.57 0.00 0.00 179.24 177.54 1ffv h ALA 149 N 1.81 1.42 -0.25 3.45 0.00 -0.79 -2.99 119.26 121.91 1ffv h ALA 149 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ffv h ALA 149 Cb 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ffv h ALA 149 CO 0.02 0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.99 1ffv n LEU 150 N -4.14 1.97 -4.77 0.00 4.77 -1.08 -4.61 117.00 109.13 1ffv n LEU 150 Ca -0.02 -0.87 -0.38 0.00 -0.03 0.00 0.00 56.01 54.72 1ffv n LEU 150 Cb 0.37 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 1ffv n LEU 150 CO 0.39 0.43 0.76 -0.75 -1.33 0.00 0.00 177.39 176.89 1ffv s LYS 151 N -1.68 4.26 0.25 3.23 2.20 -1.13 -4.95 119.74 121.91 1ffv s LYS 151 Ca 0.31 1.61 -0.05 0.00 -0.36 0.00 0.00 55.97 57.49 1ffv s LYS 151 Cb 0.17 -2.71 0.47 0.00 -1.51 0.00 0.00 37.83 34.25 1ffv s LYS 151 CO 0.25 -0.08 1.68 -1.35 -0.36 0.00 0.00 175.35 175.49 1ffv h PRO 152 N 2.83 0.24 -0.00 4.03 0.11 -1.91 -0.86 132.00 136.44 1ffv h PRO 152 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ffv h PRO 152 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ffv h PRO 152 CO 0.63 0.16 -0.01 -0.40 -0.21 0.00 0.00 178.00 178.18 1ffv n ASP 153 N -5.17 0.15 -4.74 -2.05 5.68 -1.26 -4.90 116.55 104.25 1ffv n ASP 153 Ca 0.14 -0.84 -0.42 0.00 -0.50 0.00 0.00 54.79 53.18 1ffv n ASP 153 Cb 0.47 -0.06 -0.01 0.00 -1.14 0.00 0.00 41.12 40.38 1ffv n ASP 153 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ffv n ALA 154 N -0.97 2.36 -1.72 2.12 0.00 -0.33 -4.93 120.51 117.04 1ffv n ALA 154 Ca 0.21 0.37 -0.37 0.00 0.00 0.00 0.00 53.44 53.65 1ffv n ALA 154 Cb 0.17 -2.43 0.07 0.00 0.00 0.00 0.00 19.45 17.25 1ffv n ALA 154 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ffv n PRO 155 N 1.74 1.12 -2.70 0.00 -0.04 -1.26 -4.95 135.00 128.91 1ffv n PRO 155 Ca 0.07 0.44 -0.43 0.00 -0.04 0.00 0.00 63.50 63.54 1ffv n PRO 155 Cb 0.37 -2.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.28 1ffv n PRO 155 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ffv s VAL 156 N -1.39 4.45 -0.13 0.52 1.01 -1.26 -4.91 120.40 118.70 1ffv s VAL 156 Ca 0.82 1.34 -0.11 0.00 0.00 0.00 0.00 61.98 64.03 1ffv s VAL 156 Cb -0.38 -4.44 -0.09 0.00 0.00 0.00 0.00 36.38 31.47 1ffv s VAL 156 CO 0.41 -0.66 0.19 -0.07 0.00 0.00 0.00 175.10 174.96 1ffv h LEU 157 N 10.41 0.00 -7.82 3.92 3.38 -1.92 -3.42 115.31 119.86 1ffv h LEU 157 Ca -0.22 -0.30 -0.74 0.00 0.09 0.00 0.00 57.88 56.71 1ffv h LEU 157 Cb 1.07 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.61 1ffv h LEU 157 CO 1.04 0.76 0.82 -0.13 0.09 0.00 0.00 178.44 181.01 1ffv s ARG 158 N -1.91 3.83 0.14 1.13 1.81 -1.26 -4.80 118.95 117.89 1ffv s ARG 158 Ca -0.10 -2.32 0.25 0.00 -1.72 0.00 0.00 55.73 51.84 1ffv s ARG 158 Cb 0.00 -4.83 0.93 0.00 -0.45 0.00 0.00 34.95 30.60 1ffv s ARG 158 CO 0.26 -1.62 1.76 0.39 -0.68 0.00 0.00 175.30 175.42 1ffv n GLU 159 N 5.34 0.15 0.20 3.54 1.02 -1.26 -3.08 120.64 126.55 1ffv n GLU 159 Ca 0.26 0.21 0.07 0.00 -0.02 0.00 0.00 57.16 57.68 1ffv n GLU 159 Cb 0.46 -1.71 0.35 0.00 -0.02 0.00 0.00 31.44 30.52 1ffv n GLU 159 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1ffv h ASP 160 N 0.00 0.00 -0.58 1.62 2.03 -1.99 -3.11 116.42 114.38 1ffv h ASP 160 Ca 0.00 0.00 -0.38 0.00 -0.73 0.00 0.00 57.03 55.92 1ffv h ASP 160 Cb 0.54 0.00 -0.24 0.00 -0.83 0.00 0.00 39.33 38.80 1ffv h ASP 160 CO 0.00 0.32 -0.15 0.00 -1.03 0.00 0.00 179.24 178.39 1ffv n LEU 161 N -3.45 4.98 -4.71 0.15 -0.00 -1.18 -5.00 117.00 107.79 1ffv n LEU 161 Ca 0.00 -4.17 -0.42 0.00 -0.00 0.00 0.00 56.01 51.42 1ffv n LEU 161 Cb 0.50 -0.61 -0.03 0.00 -0.00 0.00 0.00 43.42 43.28 1ffv n LEU 161 CO 0.36 1.57 0.91 0.00 -0.00 0.00 0.00 177.39 180.22 1ffv s ALA 162 N -3.46 3.42 0.00 1.47 0.00 -1.18 -2.67 121.76 119.34 1ffv s ALA 162 Ca 0.50 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.33 1ffv s ALA 162 Cb 0.43 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 20.09 1ffv s ALA 162 CO 0.01 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.70 1ffv n GLY 163 N 3.26 0.14 3.72 0.00 0.00 -1.26 -5.05 105.19 106.00 1ffv n GLY 163 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1ffv n GLY 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ffv s LYS 164 N -0.96 4.46 0.00 1.61 1.02 -1.09 -4.94 119.74 119.84 1ffv s LYS 164 Ca 0.00 0.97 0.18 0.00 0.02 0.00 0.00 55.97 57.14 1ffv s LYS 164 Cb 0.00 -3.44 0.08 0.00 -0.52 0.00 0.00 37.83 33.95 1ffv s LYS 164 CO 0.00 0.07 1.02 0.25 -0.92 0.00 0.00 175.35 175.77 1ffv n THR 165 N 3.69 0.00 -3.99 2.17 -2.24 -1.26 -4.90 114.28 107.75 1ffv n THR 165 Ca -0.00 -0.42 -0.08 0.00 -2.27 0.00 0.00 64.05 61.27 1ffv n THR 165 Cb 0.51 1.31 -0.10 0.00 -2.10 0.00 0.00 70.33 69.96 1ffv n THR 165 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ffv s SER 166 N -1.78 0.29 0.00 3.42 1.04 -1.26 -1.27 113.70 114.14 1ffv s SER 166 Ca 0.19 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.94 1ffv s SER 166 Cb 0.15 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1ffv s SER 166 CO 0.33 -0.49 0.00 0.61 0.98 0.00 0.00 173.24 174.67 1ffv n GLY 167 N 0.75 6.94 0.19 7.32 0.00 0.18 -4.83 105.19 115.75 1ffv n GLY 167 Ca -0.19 -1.86 0.14 0.00 0.00 0.00 0.00 46.02 44.12 1ffv n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffv h ALA 168 N 1.00 1.00 -0.62 4.61 0.00 -1.88 -3.30 119.26 120.07 1ffv h ALA 168 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.47 1ffv h ALA 168 Cb 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.39 1ffv h ALA 168 CO 0.00 0.00 -0.87 0.72 0.00 0.00 0.00 179.25 179.10 1ffv n HIS 169 N -2.74 2.21 0.00 0.00 8.25 -1.26 -5.06 115.22 116.62 1ffv n HIS 169 Ca 0.03 -2.13 0.00 0.00 -0.26 0.00 0.00 57.72 55.36 1ffv n HIS 169 Cb 0.38 -0.31 0.00 0.00 1.12 0.00 0.00 29.99 31.19 1ffv n HIS 169 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ffv n GLY 170 N -0.69 -1.93 3.74 -1.41 0.00 -1.24 -4.54 105.19 99.12 1ffv n GLY 170 Ca 0.34 -2.17 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 1ffv n GLY 170 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ffv s PRO 171 N -0.59 2.87 -0.17 1.61 0.04 -1.26 -0.65 135.00 136.85 1ffv s PRO 171 Ca 0.00 2.00 -0.00 0.00 0.04 0.00 0.00 61.00 63.04 1ffv s PRO 171 Cb 0.00 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.56 1ffv s PRO 171 CO 0.00 -1.33 -0.15 1.03 0.04 0.00 0.00 177.00 176.59 1ffv s ARG 172 N -3.24 3.15 0.26 4.56 0.52 -0.40 -4.65 118.95 119.16 1ffv s ARG 172 Ca 0.78 -0.76 0.21 0.00 -0.52 0.00 0.00 55.73 55.44 1ffv s ARG 172 Cb -0.35 -2.66 0.09 0.00 0.52 0.00 0.00 34.95 32.55 1ffv s ARG 172 CO 0.39 -0.10 1.23 0.93 0.02 0.00 0.00 175.30 177.76 1ffv h GLU 173 N 7.66 0.00 -3.78 3.54 5.08 -1.86 -3.44 114.58 121.78 1ffv h GLU 173 Ca -0.39 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.85 1ffv h GLU 173 Cb 1.17 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.24 1ffv h GLU 173 CO 0.60 0.09 -0.51 -1.58 -1.00 0.00 0.00 179.01 176.61 1ffv s HIS 174 N -3.22 0.19 0.62 4.33 5.04 -1.26 -5.02 115.29 115.97 1ffv s HIS 174 Ca 0.02 -0.48 0.35 0.00 -1.54 0.00 0.00 55.06 53.41 1ffv s HIS 174 Cb 0.08 -0.13 2.04 0.00 0.04 0.00 0.00 32.58 34.60 1ffv s HIS 174 CO 0.75 -0.37 2.29 1.12 -2.34 0.00 0.00 174.74 176.19 1ffv h HIS 175 N 3.65 0.00 -0.22 3.88 2.07 -1.93 -0.68 115.15 121.93 1ffv h HIS 175 Ca -0.32 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.20 1ffv h HIS 175 Cb 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 1ffv h HIS 175 CO 0.54 0.00 0.00 0.09 -3.07 0.00 0.00 177.93 175.49 1ffv n ASN 176 N -3.57 2.95 -4.70 3.10 3.02 -1.26 -4.69 115.26 110.11 1ffv n ASN 176 Ca -0.03 -1.87 -0.39 0.00 -0.03 0.00 0.00 54.58 52.26 1ffv n ASN 176 Cb 0.09 -0.13 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 1ffv n ASN 176 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1ffv s HIS 177 N -1.42 3.49 -0.23 3.10 2.46 -0.26 -0.15 115.29 122.28 1ffv s HIS 177 Ca 0.29 1.02 -0.19 0.00 0.47 0.00 0.00 55.06 56.64 1ffv s HIS 177 Cb 0.18 -2.71 -0.17 0.00 -0.13 0.00 0.00 32.58 29.74 1ffv s HIS 177 CO 0.25 0.03 0.06 -0.89 -2.47 0.00 0.00 174.74 171.73 1ffv n ILE 178 N 4.03 1.54 -3.70 0.89 5.41 0.13 -4.70 119.36 122.96 1ffv n ILE 178 Ca -0.03 -0.13 -0.02 0.00 1.00 0.00 0.00 62.75 63.57 1ffv n ILE 178 Cb 0.51 -1.99 -0.01 0.00 -0.71 0.00 0.00 39.64 37.43 1ffv n ILE 178 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 1ffv s PHE 179 N -2.40 -0.10 -0.04 1.39 -0.12 -1.19 -4.78 117.98 110.74 1ffv s PHE 179 Ca -0.31 -0.12 -0.01 0.00 -0.05 0.00 0.00 56.93 56.43 1ffv s PHE 179 Cb 0.08 0.60 0.03 0.00 -0.63 0.00 0.00 43.02 43.10 1ffv s PHE 179 CO 0.57 -0.60 0.04 0.99 -0.05 0.00 0.00 175.22 176.16 1ffv s THR 180 N -2.94 0.02 0.03 -4.49 2.01 -1.26 -1.52 115.64 107.48 1ffv s THR 180 Ca 0.13 0.29 0.05 0.00 0.31 0.00 0.00 61.69 62.46 1ffv s THR 180 Cb 0.01 -0.21 -0.02 0.00 0.01 0.00 0.00 72.50 72.29 1ffv s THR 180 CO -0.00 0.17 -0.14 0.86 -0.69 0.00 0.00 174.62 174.82 1ffv s TRP 181 N 1.76 1.19 0.11 4.92 -0.00 0.61 -4.95 118.94 122.58 1ffv s TRP 181 Ca 0.00 -0.32 -0.07 0.00 -0.00 0.00 0.00 56.10 55.71 1ffv s TRP 181 Cb -0.12 -0.72 -0.01 0.00 -0.00 0.00 0.00 33.47 32.61 1ffv s TRP 181 CO -0.03 0.02 0.18 0.20 -0.00 0.00 0.00 176.95 177.32 1ffv s GLY 182 N -0.92 0.35 0.07 5.86 0.00 -1.26 0.23 107.32 111.65 1ffv s GLY 182 Ca 0.02 -0.86 -0.13 0.00 0.00 0.00 0.00 44.72 43.75 1ffv s GLY 182 CO 0.01 -0.93 0.31 0.00 0.00 0.00 0.00 173.10 172.48 1ffv s ALA 183 N -3.92 -0.66 0.00 3.20 0.00 -0.95 -5.00 121.76 114.43 1ffv s ALA 183 Ca 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.94 1ffv s ALA 183 Cb 0.05 0.45 0.00 0.00 0.00 0.00 0.00 23.12 23.62 1ffv s ALA 183 CO -0.06 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.61 1ffv n GLY 184 N 0.22 -3.50 3.34 0.00 0.00 -1.26 -1.86 105.19 102.13 1ffv n GLY 184 Ca -0.17 -1.97 -0.45 0.00 0.00 0.00 0.00 46.02 43.42 1ffv n GLY 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ffv s ASP 185 N -1.16 6.18 0.08 1.61 -1.08 -0.66 -4.91 116.67 116.74 1ffv s ASP 185 Ca 0.00 -1.63 -0.33 0.00 -0.52 0.00 0.00 52.55 50.07 1ffv s ASP 185 Cb 0.00 -2.23 -0.16 0.00 -1.46 0.00 0.00 42.92 39.07 1ffv s ASP 185 CO 0.00 -0.90 1.61 0.50 0.52 0.00 0.00 175.17 176.90 1ffv h LYS 186 N 8.95 -0.85 -0.05 4.34 1.63 -1.89 -1.08 116.57 127.62 1ffv h LYS 186 Ca -0.30 0.06 0.03 0.00 -0.85 0.00 0.00 60.65 59.59 1ffv h LYS 186 Cb 1.10 0.19 -0.04 0.00 -0.60 0.00 0.00 32.23 32.89 1ffv h LYS 186 CO 1.03 -0.57 -0.15 0.00 -3.45 0.00 0.00 179.45 176.32 1ffv h ALA 187 N -0.54 -0.13 -0.85 5.00 0.00 -1.97 0.13 119.26 120.89 1ffv h ALA 187 Ca -0.06 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.92 1ffv h ALA 187 Cb 0.74 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1ffv h ALA 187 CO 0.03 -0.62 0.54 0.00 0.00 0.00 0.00 179.25 179.19 1ffv h ALA 188 N 0.76 1.13 -0.17 0.00 0.00 -1.97 -0.97 119.26 118.05 1ffv h ALA 188 Ca 0.07 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ffv h ALA 188 Cb 0.31 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ffv h ALA 188 CO -0.18 0.34 0.00 1.15 0.00 0.00 0.00 179.25 180.56 1ffv h THR 189 N 1.02 1.25 -0.40 0.00 2.02 -0.61 -2.52 112.91 113.67 1ffv h THR 189 Ca 0.35 -0.84 0.00 0.00 0.77 0.00 0.00 66.41 66.69 1ffv h THR 189 Cb 0.06 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1ffv h THR 189 CO -0.14 0.25 0.26 0.44 0.37 0.00 0.00 175.52 176.71 1ffv h ASP 190 N 0.05 0.47 -0.48 4.18 3.32 -0.43 -2.02 116.42 121.51 1ffv h ASP 190 Ca 0.05 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 1ffv h ASP 190 Cb 0.38 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1ffv h ASP 190 CO 0.01 0.34 -0.04 0.00 -1.72 0.00 0.00 179.24 177.83 1ffv h ALA 191 N 1.74 0.65 -0.20 3.45 0.00 -0.96 -1.38 119.26 122.55 1ffv h ALA 191 Ca 0.15 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ffv h ALA 191 Cb -0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1ffv h ALA 191 CO -0.03 0.49 0.05 0.28 0.00 0.00 0.00 179.25 180.04 1ffv h VAL 192 N 0.72 1.21 0.00 0.00 2.07 -0.99 -3.01 116.25 116.25 1ffv h VAL 192 Ca 0.13 -0.66 -0.07 0.00 0.82 0.00 0.00 66.70 66.92 1ffv h VAL 192 Cb 0.57 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1ffv h VAL 192 CO 0.03 0.21 -0.32 -0.26 0.02 0.00 0.00 177.57 177.25 1ffv h PHE 193 N 0.14 0.00 0.00 1.57 -1.00 -1.35 0.64 116.94 116.94 1ffv h PHE 193 Ca 0.06 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.80 1ffv h PHE 193 Cb 0.27 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.82 1ffv h PHE 193 CO 0.01 0.32 -0.19 0.00 -1.61 0.00 0.00 178.31 176.84 1ffv h ALA 194 N 1.68 1.64 0.00 2.45 0.00 -1.11 -3.32 119.26 120.60 1ffv h ALA 194 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ffv h ALA 194 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ffv h ALA 194 CO 0.04 0.24 0.00 0.09 0.00 0.00 0.00 179.25 179.62 1ffv n ASN 195 N -4.25 0.18 -4.67 0.00 3.02 -1.04 -5.07 115.26 103.43 1ffv n ASN 195 Ca -0.02 -0.55 -0.43 0.00 -0.03 0.00 0.00 54.58 53.54 1ffv n ASN 195 Cb 0.25 0.68 -0.01 0.00 -0.61 0.00 0.00 39.78 40.09 1ffv n ASN 195 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ffv n ALA 196 N -0.68 0.91 0.11 5.41 0.00 0.19 -4.91 120.51 121.53 1ffv n ALA 196 Ca 0.00 0.37 -0.02 0.00 0.00 0.00 0.00 53.44 53.79 1ffv n ALA 196 Cb 0.01 -2.20 0.21 0.00 0.00 0.00 0.00 19.45 17.46 1ffv n ALA 196 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ffv h PRO 197 N 2.54 0.19 -5.35 0.00 0.13 -1.91 -3.43 132.00 124.17 1ffv h PRO 197 Ca -0.44 -0.10 -0.68 0.00 -0.87 0.00 0.00 66.00 63.91 1ffv h PRO 197 Cb 1.30 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.10 1ffv h PRO 197 CO 0.63 0.63 -0.88 0.08 -0.23 0.00 0.00 178.00 178.23 1ffv s VAL 198 N -3.99 2.04 -0.09 1.56 1.01 -0.73 -5.00 120.40 115.20 1ffv s VAL 198 Ca -0.04 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 1ffv s VAL 198 Cb 0.13 -1.76 0.04 0.00 0.00 0.00 0.00 36.38 34.79 1ffv s VAL 198 CO 0.77 0.56 0.20 -0.89 0.00 0.00 0.00 175.10 175.74 1ffv s THR 199 N 0.32 -0.09 0.10 3.92 2.01 -1.26 -0.94 115.64 119.69 1ffv s THR 199 Ca -0.18 0.19 0.07 0.00 0.31 0.00 0.00 61.69 62.08 1ffv s THR 199 Cb -0.18 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 71.97 1ffv s THR 199 CO 0.09 0.08 -0.19 0.68 -0.69 0.00 0.00 174.62 174.59 1ffv s VAL 200 N 1.42 1.54 0.02 3.82 -7.23 -0.76 -5.01 120.40 114.20 1ffv s VAL 200 Ca -0.07 -1.51 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 1ffv s VAL 200 Cb -0.11 -1.44 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 1ffv s VAL 200 CO -0.07 -0.13 -0.05 -0.55 -0.31 0.00 0.00 175.10 173.99 1ffv s SER 201 N -1.92 0.49 -0.26 4.85 0.15 -1.26 -1.53 113.70 114.22 1ffv s SER 201 Ca 0.05 -0.31 -0.12 0.00 0.70 0.00 0.00 55.95 56.27 1ffv s SER 201 Cb -0.10 0.02 0.10 0.00 -1.71 0.00 0.00 66.02 64.33 1ffv s SER 201 CO 0.04 -0.12 0.60 -1.58 1.20 0.00 0.00 173.24 173.38 1ffv s GLN 202 N -0.87 0.57 0.05 5.44 2.00 -0.35 -5.00 119.66 121.50 1ffv s GLN 202 Ca -0.06 1.22 -0.15 0.00 -2.00 0.00 0.00 55.36 54.37 1ffv s GLN 202 Cb -0.06 0.39 -0.06 0.00 0.80 0.00 0.00 33.01 34.08 1ffv s GLN 202 CO -0.00 -0.18 0.46 -1.58 -0.50 0.00 0.00 175.29 173.49 1ffv s HIS 203 N 2.16 3.71 -0.12 1.67 5.65 -1.26 -1.20 115.29 125.90 1ffv s HIS 203 Ca -0.07 1.04 -0.17 0.00 0.25 0.00 0.00 55.06 56.10 1ffv s HIS 203 Cb -0.09 -2.33 0.04 0.00 -1.18 0.00 0.00 32.58 29.03 1ffv s HIS 203 CO -0.18 0.59 0.45 0.00 -0.65 0.00 0.00 174.74 174.95 1ffv s MET 204 N -1.31 0.63 -0.16 2.88 0.23 0.69 -5.00 119.30 117.26 1ffv s MET 204 Ca 0.28 0.40 -0.04 0.00 -1.03 0.00 0.00 55.69 55.30 1ffv s MET 204 Cb -0.17 0.30 -0.03 0.00 -1.53 0.00 0.00 34.83 33.40 1ffv s MET 204 CO 0.16 -0.12 -0.03 -0.47 -2.03 0.00 0.00 175.02 172.52 1ffv s TYR 205 N -0.29 3.03 -0.56 3.16 5.04 -1.26 -0.48 117.35 125.97 1ffv s TYR 205 Ca -0.04 -0.31 -0.13 0.00 -2.44 0.00 0.00 57.07 54.14 1ffv s TYR 205 Cb -0.03 -1.97 0.14 0.00 0.35 0.00 0.00 41.96 40.45 1ffv s TYR 205 CO 0.03 -0.05 0.49 -0.47 -1.34 0.00 0.00 175.55 174.20 1ffv s TYR 206 N 0.42 3.40 0.47 4.97 6.14 0.03 -4.48 117.35 128.29 1ffv s TYR 206 Ca -0.04 -1.66 -0.22 0.00 0.64 0.00 0.00 57.07 55.79 1ffv s TYR 206 Cb -0.14 -3.67 -0.09 0.00 0.42 0.00 0.00 41.96 38.47 1ffv s TYR 206 CO 0.03 -1.00 0.94 -2.30 0.64 0.00 0.00 175.55 173.86 1ffv n PRO 207 N 4.86 1.16 -2.20 4.97 -0.02 -1.26 -0.75 135.00 141.75 1ffv n PRO 207 Ca -0.07 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.41 1ffv n PRO 207 Cb 0.41 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.84 1ffv n PRO 207 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1ffv s ARG 208 N -2.17 4.22 0.35 -0.52 3.52 -1.26 -3.73 118.95 119.35 1ffv s ARG 208 Ca 0.66 1.96 0.03 0.00 -0.13 0.00 0.00 55.73 58.25 1ffv s ARG 208 Cb -0.52 -3.81 -0.04 0.00 -1.56 0.00 0.00 34.95 29.03 1ffv s ARG 208 CO 0.54 -0.73 0.10 0.14 -0.81 0.00 0.00 175.30 174.55 1ffv s VAL 209 N 3.43 0.75 -0.04 7.11 -7.23 -0.70 -2.46 120.40 121.27 1ffv s VAL 209 Ca 0.65 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.86 1ffv s VAL 209 Cb -0.29 -2.56 -0.00 0.00 0.56 0.00 0.00 36.38 34.09 1ffv s VAL 209 CO 0.24 0.00 -0.16 -2.28 -0.31 0.00 0.00 175.10 172.59 1ffv s HIS 210 N -3.37 1.56 0.60 2.82 2.46 -1.26 -0.33 115.29 117.77 1ffv s HIS 210 Ca 0.32 -0.43 0.31 0.00 0.47 0.00 0.00 55.06 55.72 1ffv s HIS 210 Cb 0.06 -1.06 1.86 0.00 -0.13 0.00 0.00 32.58 33.31 1ffv s HIS 210 CO 0.15 -0.15 2.23 -1.00 -2.47 0.00 0.00 174.74 173.50 1ffv h PRO 211 N 6.26 0.00 -6.49 2.88 0.13 -1.88 -3.47 132.00 129.42 1ffv h PRO 211 Ca -0.33 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.54 1ffv h PRO 211 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ffv h PRO 211 CO 0.48 0.00 -0.51 0.00 -0.23 0.00 0.00 178.00 177.74 1ffv s PRO 213 N -4.72 3.54 0.27 0.00 0.04 -1.26 -4.91 135.00 127.95 1ffv s PRO 213 Ca 0.11 1.90 -0.02 0.00 0.04 0.00 0.00 61.00 63.03 1ffv s PRO 213 Cb -0.06 -2.34 0.41 0.00 0.04 0.00 0.00 34.50 32.55 1ffv s PRO 213 CO 0.44 -0.77 1.88 1.25 0.04 0.00 0.00 177.00 179.84 1ffv h LEU 214 N 1.81 1.04 -9.28 -3.56 5.85 -1.88 -3.37 115.31 105.92 1ffv h LEU 214 Ca -0.50 0.01 -0.58 0.00 0.84 0.00 0.00 57.88 57.65 1ffv h LEU 214 Cb 1.26 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 1ffv h LEU 214 CO 0.59 0.66 -0.03 -0.70 -0.34 0.00 0.00 178.44 178.62 1ffv s GLU 215 N -6.04 4.33 0.91 1.25 2.12 -1.11 -5.07 118.70 115.08 1ffv s GLU 215 Ca -0.12 0.58 -0.15 0.00 0.36 0.00 0.00 54.97 55.63 1ffv s GLU 215 Cb 0.20 -3.48 0.21 0.00 0.26 0.00 0.00 34.13 31.33 1ffv s GLU 215 CO 0.81 0.04 1.20 0.25 -0.54 0.00 0.00 175.26 177.02 1ffv n THR 216 N 3.96 0.00 -2.81 -1.70 -2.24 -1.26 -4.86 114.28 105.36 1ffv n THR 216 Ca -0.04 -0.86 -0.33 0.00 -2.27 0.00 0.00 64.05 60.54 1ffv n THR 216 Cb 0.51 -1.53 -0.07 0.00 -2.10 0.00 0.00 70.33 67.14 1ffv n THR 216 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffv s GLY 218 N -2.12 -0.42 0.14 0.00 0.00 -1.26 -1.89 107.32 101.77 1ffv s GLY 218 Ca 0.61 0.72 -0.24 0.00 0.00 0.00 0.00 44.72 45.81 1ffv s GLY 218 CO 0.14 0.39 0.72 0.00 0.00 0.00 0.00 173.10 174.35 1ffv s VAL 220 N -3.60 1.33 -0.05 0.00 1.01 0.48 -0.58 120.40 118.99 1ffv s VAL 220 Ca 0.05 -1.60 -0.18 0.00 0.00 0.00 0.00 61.98 60.24 1ffv s VAL 220 Cb -0.02 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1ffv s VAL 220 CO -0.07 -0.56 0.51 0.00 0.00 0.00 0.00 175.10 174.98 1ffv s ALA 221 N 1.40 3.52 -0.29 5.51 0.00 0.01 -1.25 121.76 130.66 1ffv s ALA 221 Ca 0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 51.96 51.89 1ffv s ALA 221 Cb -0.18 -2.64 0.10 0.00 0.00 0.00 0.00 23.12 20.40 1ffv s ALA 221 CO -0.17 0.15 0.12 0.45 0.00 0.00 0.00 175.76 176.31 1ffv s SER 222 N 0.00 3.61 -0.23 0.00 0.15 0.60 -0.17 113.70 117.66 1ffv s SER 222 Ca 0.27 -1.34 -0.16 0.00 0.70 0.00 0.00 55.95 55.42 1ffv s SER 222 Cb -0.17 -0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 63.65 1ffv s SER 222 CO 0.13 -0.43 0.42 0.12 1.20 0.00 0.00 173.24 174.68 1ffv s PHE 223 N 2.00 3.33 -0.50 3.44 5.36 -1.26 -1.28 117.98 129.06 1ffv s PHE 223 Ca 0.09 0.58 -0.17 0.00 -0.96 0.00 0.00 56.93 56.47 1ffv s PHE 223 Cb -0.16 -2.57 0.09 0.00 -0.34 0.00 0.00 43.02 40.03 1ffv s PHE 223 CO -0.34 -0.11 0.49 0.34 -1.46 0.00 0.00 175.22 174.14 1ffv s ASP 224 N 1.27 6.17 0.55 6.13 -1.08 -0.48 -4.03 116.67 125.20 1ffv s ASP 224 Ca 0.19 -1.36 0.36 0.00 -0.52 0.00 0.00 52.55 51.21 1ffv s ASP 224 Cb -0.15 -2.22 1.77 0.00 -1.46 0.00 0.00 42.92 40.86 1ffv s ASP 224 CO 0.09 -0.78 2.09 1.55 0.52 0.00 0.00 175.17 178.64 1ffv h PRO 225 N 8.86 0.00 -0.01 4.34 0.13 -1.86 0.65 132.00 144.12 1ffv h PRO 225 Ca -0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1ffv h PRO 225 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ffv h PRO 225 CO 0.95 0.00 -0.02 0.82 -0.23 0.00 0.00 178.00 179.52 1ffv h ILE 226 N 0.00 1.52 0.00 -3.56 2.04 -1.96 -3.33 117.51 112.21 1ffv h ILE 226 Ca 0.00 -1.55 -0.07 0.00 1.00 0.00 0.00 64.86 64.24 1ffv h ILE 226 Cb 0.22 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.84 1ffv h ILE 226 CO 0.00 0.40 -1.19 0.29 0.00 0.00 0.00 178.15 177.65 1ffv n LYS 227 N -4.75 0.61 -1.36 2.37 5.02 -1.11 -4.98 118.16 113.97 1ffv n LYS 227 Ca -0.09 0.16 -0.01 0.00 -2.02 0.00 0.00 58.31 56.35 1ffv n LYS 227 Cb 0.34 -1.82 -0.00 0.00 -0.02 0.00 0.00 35.03 33.52 1ffv n LYS 227 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ffv n GLY 228 N 1.28 0.43 3.45 0.72 0.00 0.23 -5.05 105.19 106.25 1ffv n GLY 228 Ca -0.04 -0.96 -0.26 0.00 0.00 0.00 0.00 46.02 44.75 1ffv n GLY 228 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ffv s ASP 229 N -2.97 3.58 -0.14 1.61 1.47 -1.18 -4.95 116.67 114.09 1ffv s ASP 229 Ca 0.00 -0.85 -0.02 0.00 1.18 0.00 0.00 52.55 52.86 1ffv s ASP 229 Cb 0.00 -0.33 -0.02 0.00 -0.34 0.00 0.00 42.92 42.23 1ffv s ASP 229 CO 0.00 0.11 -0.07 -0.22 0.68 0.00 0.00 175.17 175.67 1ffv s LEU 230 N -2.81 3.06 -0.12 2.11 2.96 0.37 -1.38 118.68 122.86 1ffv s LEU 230 Ca 0.23 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1ffv s LEU 230 Cb -0.08 -1.72 0.02 0.00 0.50 0.00 0.00 46.19 44.92 1ffv s LEU 230 CO 0.11 0.17 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.32 1ffv s THR 231 N 0.32 1.24 -0.09 3.68 2.01 -0.40 0.18 115.64 122.57 1ffv s THR 231 Ca -0.06 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 1ffv s THR 231 Cb -0.15 -1.20 0.03 0.00 0.01 0.00 0.00 72.50 71.19 1ffv s THR 231 CO 0.04 0.40 -0.01 0.28 -0.69 0.00 0.00 174.62 174.64 1ffv s THR 232 N 1.52 0.51 0.01 -0.82 -1.32 -0.49 -0.29 115.64 114.75 1ffv s THR 232 Ca 0.03 -0.01 -0.28 0.00 -1.21 0.00 0.00 61.69 60.23 1ffv s THR 232 Cb -0.13 -0.67 -0.04 0.00 -1.51 0.00 0.00 72.50 70.15 1ffv s THR 232 CO -0.08 0.25 0.87 -0.31 -2.21 0.00 0.00 174.62 173.14 1ffv s TYR 233 N 1.91 3.67 0.05 9.09 1.51 -0.38 -1.96 117.35 131.25 1ffv s TYR 233 Ca 0.05 1.57 -0.16 0.00 -1.01 0.00 0.00 57.07 57.51 1ffv s TYR 233 Cb -0.13 -2.98 0.03 0.00 -0.11 0.00 0.00 41.96 38.77 1ffv s TYR 233 CO -0.06 0.09 0.36 -1.50 -1.11 0.00 0.00 175.55 173.34 1ffv s ILE 234 N 0.64 0.07 -1.29 2.71 2.07 -0.76 -0.39 121.20 124.25 1ffv s ILE 234 Ca 0.45 -0.57 -0.13 0.00 -1.41 0.00 0.00 60.65 58.99 1ffv s ILE 234 Cb -0.20 -0.98 0.13 0.00 0.13 0.00 0.00 42.46 41.54 1ffv s ILE 234 CO 0.25 -0.32 1.77 0.35 -1.91 0.00 0.00 174.94 175.08 1ffv n THR 235 N 0.44 4.10 -5.20 4.00 -2.24 -1.00 -4.22 114.28 110.16 1ffv n THR 235 Ca -0.18 -4.22 -0.30 0.00 -2.27 0.00 0.00 64.05 57.08 1ffv n THR 235 Cb 0.60 -2.43 -0.16 0.00 -2.10 0.00 0.00 70.33 66.24 1ffv n THR 235 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ffv s SER 236 N 2.50 2.86 0.00 3.42 0.15 -1.26 -4.78 113.70 116.59 1ffv s SER 236 Ca 0.45 -0.46 0.25 0.00 0.70 0.00 0.00 55.95 56.89 1ffv s SER 236 Cb 0.05 -0.51 0.78 0.00 -1.71 0.00 0.00 66.02 64.63 1ffv s SER 236 CO 0.00 0.27 1.58 0.00 1.20 0.00 0.00 173.24 176.30 1ffv n GLN 237 N 2.69 1.86 -2.94 5.44 6.02 0.41 -4.37 117.38 126.50 1ffv n GLN 237 Ca -0.16 -1.27 -0.14 0.00 -0.01 0.00 0.00 57.00 55.41 1ffv n GLN 237 Cb 0.52 -1.46 0.01 0.00 1.02 0.00 0.00 30.24 30.33 1ffv n GLN 237 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ffv n ALA 238 N 0.52 0.33 -0.08 -1.58 0.00 -1.26 -1.40 120.51 117.03 1ffv n ALA 238 Ca 0.17 -2.29 0.06 0.00 0.00 0.00 0.00 53.44 51.38 1ffv n ALA 238 Cb 0.41 -1.09 0.40 0.00 0.00 0.00 0.00 19.45 19.17 1ffv n ALA 238 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ffv h PRO 239 N 3.67 0.61 -0.27 0.00 0.13 -1.91 -1.98 132.00 132.25 1ffv h PRO 239 Ca -0.04 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.98 1ffv h PRO 239 Cb 0.99 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1ffv h PRO 239 CO 0.36 0.40 -0.11 0.45 -0.23 0.00 0.00 178.00 178.87 1ffv h HIS 240 N 0.63 0.63 -0.72 1.56 3.86 -1.91 -1.41 115.15 117.78 1ffv h HIS 240 Ca 0.22 -0.15 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1ffv h HIS 240 Cb 0.11 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.40 1ffv h HIS 240 CO -0.00 0.79 0.43 0.28 0.86 0.00 0.00 177.93 180.29 1ffv h VAL 241 N 0.29 1.21 -0.92 2.45 2.07 -1.72 -1.70 116.25 117.92 1ffv h VAL 241 Ca 0.06 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.12 1ffv h VAL 241 Cb 0.61 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 1ffv h VAL 241 CO 0.04 0.22 0.60 0.58 0.02 0.00 0.00 177.57 179.02 1ffv h VAL 242 N 0.98 1.24 -0.22 2.57 2.07 -1.24 -1.39 116.25 120.25 1ffv h VAL 242 Ca 0.26 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1ffv h VAL 242 Cb -0.02 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.63 1ffv h VAL 242 CO -0.05 0.23 0.12 -0.09 0.02 0.00 0.00 177.57 177.80 1ffv h ARG 243 N 1.25 0.31 -0.26 1.57 1.12 -0.38 0.34 114.38 118.33 1ffv h ARG 243 Ca 0.34 -0.04 0.01 0.00 -1.11 0.00 0.00 59.98 59.18 1ffv h ARG 243 Cb -0.13 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 29.75 1ffv h ARG 243 CO -0.07 0.30 0.14 1.15 -3.11 0.00 0.00 179.97 178.38 1ffv h THR 244 N 0.24 1.01 -0.35 0.20 2.02 -1.00 0.15 112.91 115.18 1ffv h THR 244 Ca 0.08 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 1ffv h THR 244 Cb 0.08 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1ffv h THR 244 CO -0.01 0.05 0.11 0.58 0.37 0.00 0.00 175.52 176.62 1ffv h VAL 245 N 0.28 1.21 -0.62 3.16 2.07 -1.07 -2.12 116.25 119.16 1ffv h VAL 245 Ca 0.10 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 1ffv h VAL 245 Cb 0.01 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1ffv h VAL 245 CO -0.06 0.24 0.18 0.58 0.02 0.00 0.00 177.57 178.53 1ffv h VAL 246 N 0.42 1.24 0.02 2.57 2.07 -0.13 -1.84 116.25 120.59 1ffv h VAL 246 Ca 0.11 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1ffv h VAL 246 Cb 0.26 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1ffv h VAL 246 CO -0.00 0.32 -0.05 -1.28 0.02 0.00 0.00 177.57 176.58 1ffv h SER 247 N 0.92 -0.14 0.16 0.57 0.87 -0.74 -1.29 113.55 113.89 1ffv h SER 247 Ca 0.20 0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.68 1ffv h SER 247 Cb 0.28 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1ffv h SER 247 CO -0.01 -0.08 -0.38 0.24 -0.53 0.00 0.00 176.83 176.07 1ffv h MET 248 N -0.10 0.31 0.00 2.24 2.86 -1.22 -0.63 114.93 118.39 1ffv h MET 248 Ca 0.01 -0.14 -0.14 0.00 -2.06 0.00 0.00 59.70 57.37 1ffv h MET 248 Cb 0.11 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 1ffv h MET 248 CO -0.04 0.65 -0.69 -0.07 1.06 0.00 0.00 176.91 177.83 1ffv h LEU 249 N 0.26 0.00 0.00 1.22 3.38 -1.23 -3.34 115.31 115.61 1ffv h LEU 249 Ca 0.03 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1ffv h LEU 249 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1ffv h LEU 249 CO 0.06 0.69 -1.82 -1.54 0.09 0.00 0.00 178.44 175.92 1ffv n SER 250 N -3.37 0.23 0.00 -0.43 3.41 -0.50 -4.98 113.62 107.98 1ffv n SER 250 Ca 0.01 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1ffv n SER 250 Cb 0.77 1.41 0.00 0.00 -0.26 0.00 0.00 64.21 66.13 1ffv n SER 250 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ffv n GLY 251 N 1.33 1.24 3.68 5.00 0.00 -0.25 -5.01 105.19 111.17 1ffv n GLY 251 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1ffv n GLY 251 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ffv s ILE 252 N -2.93 4.70 0.16 -0.61 1.01 -1.20 -4.98 121.20 117.35 1ffv s ILE 252 Ca 0.00 1.99 -0.34 0.00 0.00 0.00 0.00 60.65 62.30 1ffv s ILE 252 Cb 0.00 -4.28 -0.15 0.00 0.01 0.00 0.00 42.46 38.04 1ffv s ILE 252 CO 0.00 -0.05 1.39 -0.81 0.00 0.00 0.00 174.94 175.47 1ffv n PRO 253 N 5.40 1.62 -0.34 2.79 -0.04 -1.26 -4.58 135.00 138.59 1ffv n PRO 253 Ca 0.10 0.58 0.22 0.00 -0.04 0.00 0.00 63.50 64.36 1ffv n PRO 253 Cb 0.48 -2.24 0.45 0.00 -0.04 0.00 0.00 33.50 32.14 1ffv n PRO 253 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1ffv h GLU 254 N 4.66 0.41 0.00 0.54 4.81 -1.92 0.84 114.58 123.92 1ffv h GLU 254 Ca -0.45 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1ffv h GLU 254 Cb 1.30 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1ffv h GLU 254 CO 0.79 0.27 0.00 0.66 -0.73 0.00 0.00 179.01 180.00 1ffv h SER 255 N 0.42 0.00 -0.57 1.04 4.64 -1.98 -0.77 113.55 116.33 1ffv h SER 255 Ca 0.70 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.02 1ffv h SER 255 Cb 1.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 1ffv h SER 255 CO -0.55 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.70 1ffv n LYS 256 N -2.56 3.08 -4.41 4.77 5.02 0.29 -4.85 118.16 119.51 1ffv n LYS 256 Ca -0.00 -2.57 -0.33 0.00 -2.02 0.00 0.00 58.31 53.38 1ffv n LYS 256 Cb 0.15 -1.60 -0.15 0.00 -0.02 0.00 0.00 35.03 33.41 1ffv n LYS 256 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ffv s VAL 257 N -1.38 2.53 -0.21 -0.18 1.01 -0.30 -0.48 120.40 121.39 1ffv s VAL 257 Ca 0.42 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1ffv s VAL 257 Cb 0.25 -2.07 0.04 0.00 0.00 0.00 0.00 36.38 34.60 1ffv s VAL 257 CO 0.24 0.52 -0.11 -0.60 0.00 0.00 0.00 175.10 175.14 1ffv s ARG 258 N 0.98 2.14 -0.14 2.72 3.52 0.13 -4.90 118.95 123.39 1ffv s ARG 258 Ca -0.02 -0.91 -0.04 0.00 -0.13 0.00 0.00 55.73 54.62 1ffv s ARG 258 Cb -0.15 -2.49 -0.03 0.00 -1.56 0.00 0.00 34.95 30.71 1ffv s ARG 258 CO -0.03 -0.43 0.01 0.42 -0.81 0.00 0.00 175.30 174.46 1ffv s ILE 259 N 1.35 4.35 -0.14 4.11 -1.09 -1.26 -1.40 121.20 127.12 1ffv s ILE 259 Ca -0.02 -0.21 -0.02 0.00 -2.23 0.00 0.00 60.65 58.17 1ffv s ILE 259 Cb -0.16 -2.90 0.05 0.00 -1.58 0.00 0.00 42.46 37.86 1ffv s ILE 259 CO -0.08 0.52 0.02 0.54 -1.23 0.00 0.00 174.94 174.71 1ffv s VAL 260 N -0.05 0.43 -0.43 2.92 0.11 -0.83 -1.50 120.40 121.06 1ffv s VAL 260 Ca 0.04 -0.24 -0.23 0.00 -2.93 0.00 0.00 61.98 58.63 1ffv s VAL 260 Cb -0.13 -0.79 0.02 0.00 -1.53 0.00 0.00 36.38 33.96 1ffv s VAL 260 CO 0.02 -0.00 0.75 -0.44 -3.33 0.00 0.00 175.10 172.10 1ffv s SER 261 N 1.92 6.42 0.00 3.54 0.01 0.21 -1.82 113.70 123.98 1ffv s SER 261 Ca 0.02 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1ffv s SER 261 Cb -0.15 -2.37 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1ffv s SER 261 CO -0.07 -0.85 0.00 -0.81 0.41 0.00 0.00 173.24 171.92 1ffv n PRO 262 N 6.57 3.14 -2.62 12.44 -0.04 -1.26 -4.45 135.00 148.77 1ffv n PRO 262 Ca 0.02 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.06 1ffv n PRO 262 Cb 0.48 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.90 1ffv n PRO 262 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ffv s ASP 263 N -1.00 7.37 -0.13 3.54 1.01 -0.11 -5.01 116.67 122.34 1ffv s ASP 263 Ca 0.00 1.91 0.02 0.00 0.71 0.00 0.00 52.55 55.19 1ffv s ASP 263 Cb 0.00 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.34 1ffv s ASP 263 CO 0.00 -0.17 -0.19 -0.63 0.21 0.00 0.00 175.17 174.40 1ffv s ILE 264 N 0.06 2.44 -1.54 0.77 1.01 -1.26 -4.16 121.20 118.52 1ffv s ILE 264 Ca 0.49 -0.86 -0.10 0.00 0.00 0.00 0.00 60.65 60.18 1ffv s ILE 264 Cb -0.26 -1.99 -0.09 0.00 0.01 0.00 0.00 42.46 40.13 1ffv s ILE 264 CO 0.31 0.54 2.93 0.61 0.00 0.00 0.00 174.94 179.33 1ffv n GLY 265 N 3.82 4.14 0.00 6.18 0.00 -1.26 -4.44 105.19 113.63 1ffv n GLY 265 Ca -0.19 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1ffv n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffv n GLY 266 N 3.56 -1.09 1.11 -0.02 0.00 -1.16 -2.77 105.19 104.82 1ffv n GLY 266 Ca 0.76 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1ffv n GLY 266 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffv n GLY 267 N 0.10 -0.05 3.84 -0.02 0.00 -1.26 -4.76 105.19 103.04 1ffv n GLY 267 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1ffv n GLY 267 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ffv n PHE 268 N -3.39 -2.39 0.00 1.61 3.72 -1.26 -1.35 117.46 114.40 1ffv n PHE 268 Ca 0.00 0.92 0.00 0.00 -0.05 0.00 0.00 57.45 58.32 1ffv n PHE 268 Cb 0.09 -4.22 0.00 0.00 -0.94 0.00 0.00 39.48 34.41 1ffv n PHE 268 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ffv n GLY 269 N -1.74 2.27 0.25 1.37 0.00 -1.26 -0.71 105.19 105.37 1ffv n GLY 269 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1ffv n GLY 269 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1ffv h ASN 270 N 0.00 0.00 -0.37 1.61 -1.24 -1.52 -3.25 115.58 110.80 1ffv h ASN 270 Ca 0.00 0.00 -0.19 0.00 0.71 0.00 0.00 56.30 56.82 1ffv h ASN 270 Cb 0.00 0.00 -0.11 0.00 0.73 0.00 0.00 38.32 38.94 1ffv h ASN 270 CO 0.00 0.10 -0.05 0.29 -1.29 0.00 0.00 177.43 176.48 1ffv n LYS 271 N -3.24 1.89 0.02 6.67 5.02 -1.25 -4.54 118.16 122.72 1ffv n LYS 271 Ca 0.00 -3.17 -0.19 0.00 -2.02 0.00 0.00 58.31 52.93 1ffv n LYS 271 Cb 0.36 -1.83 -0.14 0.00 -0.02 0.00 0.00 35.03 33.40 1ffv n LYS 271 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1ffv h VAL 272 N 1.03 1.43 -3.93 -0.18 2.07 -1.87 0.12 116.25 114.92 1ffv h VAL 272 Ca 0.23 -2.47 -0.46 0.00 0.82 0.00 0.00 66.70 64.83 1ffv h VAL 272 Cb 1.70 3.09 0.12 0.00 -1.52 0.00 0.00 31.29 34.69 1ffv h VAL 272 CO 0.41 0.68 0.35 -0.83 0.02 0.00 0.00 177.57 178.21 1ffv s GLY 273 N -4.52 1.71 -0.23 2.17 0.00 -1.26 -4.56 107.32 100.63 1ffv s GLY 273 Ca -0.16 -1.07 -0.10 0.00 0.00 0.00 0.00 44.72 43.39 1ffv s GLY 273 CO 0.79 -0.46 0.14 -0.42 0.00 0.00 0.00 173.10 173.15 1ffv s ILE 274 N -3.62 5.19 0.07 0.90 1.01 -1.26 -4.97 121.20 118.53 1ffv s ILE 274 Ca 0.68 0.12 0.02 0.00 0.00 0.00 0.00 60.65 61.47 1ffv s ILE 274 Cb -0.07 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1ffv s ILE 274 CO 0.50 0.37 0.13 -0.31 0.00 0.00 0.00 174.94 175.62 1ffv s TYR 275 N 0.97 3.30 0.52 3.97 2.02 -1.26 -5.00 117.35 121.88 1ffv s TYR 275 Ca 0.07 0.14 0.32 0.00 -0.37 0.00 0.00 57.07 57.22 1ffv s TYR 275 Cb -0.13 -1.67 1.46 0.00 -0.40 0.00 0.00 41.96 41.22 1ffv s TYR 275 CO 0.04 0.55 1.84 -1.00 -1.57 0.00 0.00 175.55 175.40 1ffv h PRO 276 N 3.21 0.05 -0.94 -1.71 0.13 -1.88 0.60 132.00 131.47 1ffv h PRO 276 Ca -0.46 -0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.71 1ffv h PRO 276 Cb 1.16 -0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.22 1ffv h PRO 276 CO 0.69 0.03 0.60 0.78 -0.23 0.00 0.00 178.00 179.88 1ffv h GLY 277 N 0.05 1.39 0.70 1.56 0.00 -1.94 0.06 103.07 104.88 1ffv h GLY 277 Ca 0.50 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 47.38 1ffv h GLY 277 CO -0.04 0.35 -0.00 -0.97 0.00 0.00 0.00 176.54 175.88 1ffv h TYR 278 N 1.14 0.03 -0.84 5.60 0.05 -1.28 -2.20 116.97 119.47 1ffv h TYR 278 Ca 0.39 -0.00 0.07 0.00 0.05 0.00 0.00 58.73 59.23 1ffv h TYR 278 Cb 0.08 -0.01 -0.06 0.00 1.01 0.00 0.00 36.73 37.75 1ffv h TYR 278 CO -0.01 0.33 0.51 0.28 -1.05 0.00 0.00 178.16 178.22 1ffv h VAL 279 N -0.28 1.01 -0.46 -2.88 2.07 -1.37 -1.32 116.25 113.02 1ffv h VAL 279 Ca 0.00 -0.31 -0.06 0.00 0.82 0.00 0.00 66.70 67.15 1ffv h VAL 279 Cb 0.32 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1ffv h VAL 279 CO 0.00 0.17 0.06 0.00 0.02 0.00 0.00 177.57 177.82 1ffv h ALA 281 N 0.94 0.90 -0.17 0.00 0.00 -0.91 0.25 119.26 120.27 1ffv h ALA 281 Ca 0.14 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ffv h ALA 281 Cb 0.41 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ffv h ALA 281 CO 0.01 0.49 0.09 0.82 0.00 0.00 0.00 179.25 180.66 1ffv h ILE 282 N 0.98 1.11 -0.37 0.00 2.04 -1.10 -0.50 117.51 119.68 1ffv h ILE 282 Ca 0.24 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1ffv h ILE 282 Cb 0.15 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 1ffv h ILE 282 CO -0.03 0.10 0.20 0.58 0.00 0.00 0.00 178.15 179.00 1ffv h VAL 283 N 0.17 1.15 -0.83 1.67 2.07 -0.97 -1.07 116.25 118.45 1ffv h VAL 283 Ca 0.06 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1ffv h VAL 283 Cb 0.08 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1ffv h VAL 283 CO -0.01 0.15 0.50 0.00 0.02 0.00 0.00 177.57 178.24 1ffv h ALA 284 N 1.06 1.05 -0.70 1.67 0.00 -0.85 -0.74 119.26 120.75 1ffv h ALA 284 Ca 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1ffv h ALA 284 Cb 0.07 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1ffv h ALA 284 CO -0.02 0.51 0.36 1.03 0.00 0.00 0.00 179.25 181.13 1ffv h SER 285 N 1.13 0.90 -0.49 0.00 0.87 -0.60 0.28 113.55 115.65 1ffv h SER 285 Ca 0.30 -0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.70 1ffv h SER 285 Cb -0.05 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.66 1ffv h SER 285 CO -0.06 0.77 0.15 0.40 -0.53 0.00 0.00 176.83 177.56 1ffv h ILE 286 N 0.97 1.23 -0.38 2.23 2.04 -0.64 0.15 117.51 123.11 1ffv h ILE 286 Ca 0.24 -0.77 -0.11 0.00 1.00 0.00 0.00 64.86 65.23 1ffv h ILE 286 Cb 0.09 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1ffv h ILE 286 CO -0.03 0.28 -0.19 0.58 0.00 0.00 0.00 178.15 178.79 1ffv h VAL 287 N 0.65 1.28 -0.00 1.67 2.07 -0.78 -3.19 116.25 117.96 1ffv h VAL 287 Ca 0.16 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1ffv h VAL 287 Cb 0.28 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1ffv h VAL 287 CO -0.00 0.44 -0.35 0.18 0.02 0.00 0.00 177.57 177.85 1ffv n LEU 288 N -4.27 0.54 -2.23 2.57 4.77 0.94 -4.95 117.00 114.38 1ffv n LEU 288 Ca -0.02 0.01 -0.19 0.00 -0.03 0.00 0.00 56.01 55.77 1ffv n LEU 288 Cb 0.42 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1ffv n LEU 288 CO 0.44 0.12 -0.24 0.61 -1.33 0.00 0.00 177.39 177.00 1ffv n GLY 289 N 1.45 -0.43 3.44 -0.72 0.00 0.51 -4.98 105.19 104.45 1ffv n GLY 289 Ca 0.08 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1ffv n GLY 289 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ffv s ARG 290 N -4.99 1.27 0.32 1.61 1.70 -1.11 -4.72 118.95 113.02 1ffv s ARG 290 Ca 0.01 -0.73 -0.29 0.00 -0.47 0.00 0.00 55.73 54.26 1ffv s ARG 290 Cb -0.01 0.52 -0.12 0.00 -0.57 0.00 0.00 34.95 34.77 1ffv s ARG 290 CO 0.02 -0.53 1.37 -2.30 -1.08 0.00 0.00 175.30 172.77 1ffv n PRO 291 N -0.32 2.23 -4.16 3.89 -0.02 -1.26 -4.38 135.00 130.99 1ffv n PRO 291 Ca -0.13 0.79 -0.26 0.00 -2.02 0.00 0.00 63.50 61.88 1ffv n PRO 291 Cb 0.63 -2.42 -0.17 0.00 -0.02 0.00 0.00 33.50 31.53 1ffv n PRO 291 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ffv s VAL 292 N -0.78 1.04 -0.16 -1.45 1.01 0.76 -0.79 120.40 120.04 1ffv s VAL 292 Ca 0.59 -0.35 -0.07 0.00 0.00 0.00 0.00 61.98 62.15 1ffv s VAL 292 Cb -0.57 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 1ffv s VAL 292 CO 0.59 0.36 0.08 -0.75 0.00 0.00 0.00 175.10 175.37 1ffv s LYS 293 N 1.29 3.74 -0.09 2.72 2.20 -0.14 -0.81 119.74 128.66 1ffv s LYS 293 Ca -0.03 -0.30 0.01 0.00 -0.36 0.00 0.00 55.97 55.29 1ffv s LYS 293 Cb -0.14 -3.17 0.02 0.00 -1.51 0.00 0.00 37.83 33.04 1ffv s LYS 293 CO -0.04 0.44 -0.08 -0.46 -0.36 0.00 0.00 175.35 174.86 1ffv s TRP 294 N -0.11 1.34 -0.16 4.03 -0.00 0.25 -1.13 118.94 123.16 1ffv s TRP 294 Ca 0.07 -0.57 -0.05 0.00 -0.00 0.00 0.00 56.10 55.56 1ffv s TRP 294 Cb -0.12 -1.09 0.06 0.00 -0.00 0.00 0.00 33.47 32.33 1ffv s TRP 294 CO 0.01 -0.39 0.10 0.08 -0.00 0.00 0.00 176.95 176.76 1ffv s VAL 295 N 1.29 -0.13 0.62 5.86 1.01 -1.26 0.19 120.40 127.99 1ffv s VAL 295 Ca -0.03 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.72 1ffv s VAL 295 Cb -0.14 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 1ffv s VAL 295 CO -0.03 -0.21 1.05 -1.83 0.00 0.00 0.00 175.10 174.08 1ffv s GLU 296 N 2.17 3.23 0.47 2.72 -1.05 -0.79 -5.02 118.70 120.42 1ffv s GLU 296 Ca 0.03 1.12 -0.02 0.00 -0.15 0.00 0.00 54.97 55.94 1ffv s GLU 296 Cb -0.15 -2.02 -0.01 0.00 -0.44 0.00 0.00 34.13 31.50 1ffv s GLU 296 CO -0.09 -0.88 0.73 -0.51 0.95 0.00 0.00 175.26 175.46 1ffv s ASP 297 N -3.11 5.97 0.26 0.83 1.01 -1.26 -4.72 116.67 115.65 1ffv s ASP 297 Ca 0.62 0.57 -0.02 0.00 0.71 0.00 0.00 52.55 54.44 1ffv s ASP 297 Cb -0.15 -1.84 0.53 0.00 1.01 0.00 0.00 42.92 42.47 1ffv s ASP 297 CO 0.42 -0.68 1.73 -0.09 0.21 0.00 0.00 175.17 176.77 1ffv h ARG 298 N 0.29 0.48 -0.86 8.23 9.65 -1.97 -0.96 114.38 129.25 1ffv h ARG 298 Ca -0.47 -0.03 0.02 0.00 -1.10 0.00 0.00 59.98 58.40 1ffv h ARG 298 Cb 1.23 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 29.66 1ffv h ARG 298 CO 0.60 0.32 0.57 -0.24 2.80 0.00 0.00 179.97 184.02 1ffv h VAL 299 N 0.50 1.19 -0.21 0.20 3.04 -1.95 -1.26 116.25 117.75 1ffv h VAL 299 Ca 0.46 -0.39 -0.18 0.00 -1.01 0.00 0.00 66.70 65.58 1ffv h VAL 299 Cb 0.72 -0.04 -0.00 0.00 -2.01 0.00 0.00 31.29 29.96 1ffv h VAL 299 CO -0.41 0.21 -0.58 -0.33 -1.01 0.00 0.00 177.57 175.44 1ffv h GLU 300 N 1.13 0.69 0.27 4.17 5.08 -1.52 -1.42 114.58 122.98 1ffv h GLU 300 Ca 0.32 -0.46 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1ffv h GLU 300 Cb -0.08 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1ffv h GLU 300 CO -0.08 1.08 -0.13 -0.97 -1.00 0.00 0.00 179.01 177.91 1ffv h ASN 301 N 0.52 -0.30 -0.45 1.42 -1.24 -0.67 0.81 115.58 115.67 1ffv h ASN 301 Ca 0.00 -0.08 -0.07 0.00 0.71 0.00 0.00 56.30 56.86 1ffv h ASN 301 Cb 1.16 0.08 -0.02 0.00 0.73 0.00 0.00 38.32 40.27 1ffv h ASN 301 CO 0.12 -0.10 0.02 0.40 -1.29 0.00 0.00 177.43 176.58 1ffv h ILE 302 N -0.49 1.24 0.03 2.57 2.04 -1.29 -2.33 117.51 119.28 1ffv h ILE 302 Ca -0.04 -1.00 -0.23 0.00 1.00 0.00 0.00 64.86 64.59 1ffv h ILE 302 Cb 0.37 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1ffv h ILE 302 CO 0.06 0.36 -1.01 0.28 0.00 0.00 0.00 178.15 177.84 1ffv h SER 303 N 0.79 0.48 0.00 1.72 0.02 -1.15 -3.41 113.55 112.00 1ffv h SER 303 Ca 0.16 -0.41 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1ffv h SER 303 Cb 0.44 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1ffv h SER 303 CO 0.02 1.24 -0.04 0.35 -1.14 0.00 0.00 176.83 177.25 1ffv n THR 304 N -3.69 0.00 -2.49 -2.27 -2.24 0.27 -4.63 114.28 99.23 1ffv n THR 304 Ca -0.07 -0.45 -0.24 0.00 -2.27 0.00 0.00 64.05 61.02 1ffv n THR 304 Cb 0.88 0.98 0.10 0.00 -2.10 0.00 0.00 70.33 70.18 1ffv n THR 304 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ffv s THR 305 N -0.99 2.23 -0.20 4.28 -4.23 -0.88 -4.68 115.64 111.18 1ffv s THR 305 Ca 0.00 -0.51 -0.35 0.00 -1.18 0.00 0.00 61.69 59.65 1ffv s THR 305 Cb 0.00 -2.72 -0.11 0.00 1.34 0.00 0.00 72.50 71.01 1ffv s THR 305 CO 0.00 0.00 1.98 0.00 -0.54 0.00 0.00 174.62 176.06 1ffv n ALA 306 N -2.84 0.88 -1.97 3.99 0.00 -1.26 -4.85 120.51 114.45 1ffv n ALA 306 Ca 0.13 0.15 -0.25 0.00 0.00 0.00 0.00 53.44 53.47 1ffv n ALA 306 Cb 0.60 -2.52 0.12 0.00 0.00 0.00 0.00 19.45 17.65 1ffv n ALA 306 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1ffv s PHE 307 N 5.30 1.67 0.11 0.00 -0.12 -1.25 -4.45 117.98 119.24 1ffv s PHE 307 Ca 0.99 -0.10 0.05 0.00 -0.05 0.00 0.00 56.93 57.82 1ffv s PHE 307 Cb -0.75 -3.25 -0.04 0.00 -0.63 0.00 0.00 43.02 38.35 1ffv s PHE 307 CO 0.51 -1.89 -0.13 0.00 -0.05 0.00 0.00 175.22 173.66 1ffv s ALA 308 N -3.31 1.36 0.00 1.99 0.00 0.55 -1.02 121.76 121.33 1ffv s ALA 308 Ca 0.68 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1ffv s ALA 308 Cb -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.02 1ffv s ALA 308 CO 0.46 0.06 0.00 0.54 0.00 0.00 0.00 175.76 176.82 1ffv n ARG 309 N 0.57 0.00 -2.71 0.00 5.12 -0.97 -1.72 116.66 116.94 1ffv n ARG 309 Ca -0.16 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.68 1ffv n ARG 309 Cb 0.57 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.91 1ffv n ARG 309 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1ffv n ASP 310 N 6.74 -2.23 -4.36 0.55 -0.08 0.07 -4.78 116.55 112.47 1ffv n ASP 310 Ca 0.00 -0.29 -0.34 0.00 -1.51 0.00 0.00 54.79 52.65 1ffv n ASP 310 Cb 0.00 -2.68 -0.14 0.00 2.34 0.00 0.00 41.12 40.64 1ffv n ASP 310 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1ffv s TYR 311 N -3.17 2.89 -0.43 -0.67 1.51 -0.89 -2.11 117.35 114.48 1ffv s TYR 311 Ca 0.03 -0.74 -0.15 0.00 -1.01 0.00 0.00 57.07 55.19 1ffv s TYR 311 Cb -0.01 -1.96 0.04 0.00 -0.11 0.00 0.00 41.96 39.92 1ffv s TYR 311 CO 0.34 -0.33 0.35 -1.01 -1.11 0.00 0.00 175.55 173.80 1ffv s HIS 312 N 0.79 3.23 -0.05 2.71 3.76 -0.55 -0.79 115.29 124.38 1ffv s HIS 312 Ca -0.03 -0.67 0.04 0.00 -0.15 0.00 0.00 55.06 54.25 1ffv s HIS 312 Cb -0.15 -2.81 -0.02 0.00 1.11 0.00 0.00 32.58 30.70 1ffv s HIS 312 CO 0.01 -0.67 -0.16 -1.64 -0.85 0.00 0.00 174.74 171.43 1ffv s MET 313 N 1.74 2.51 -0.33 1.40 1.00 0.36 -1.32 119.30 124.67 1ffv s MET 313 Ca 0.06 -0.72 0.03 0.00 0.00 0.00 0.00 55.69 55.05 1ffv s MET 313 Cb -0.20 -2.36 0.09 0.00 0.00 0.00 0.00 34.83 32.36 1ffv s MET 313 CO 0.09 0.59 0.03 -0.51 0.00 0.00 0.00 175.02 175.22 1ffv s ASP 314 N -0.65 4.75 0.16 3.03 1.01 0.12 -0.22 116.67 124.88 1ffv s ASP 314 Ca 0.10 -1.93 -0.00 0.00 0.71 0.00 0.00 52.55 51.43 1ffv s ASP 314 Cb -0.11 -1.63 -0.04 0.00 1.01 0.00 0.00 42.92 42.15 1ffv s ASP 314 CO 0.01 -0.35 0.34 -0.83 0.21 0.00 0.00 175.17 174.55 1ffv s GLY 315 N 1.05 1.86 -0.09 0.21 0.00 -0.34 -1.81 107.32 108.20 1ffv s GLY 315 Ca 0.05 -0.86 -0.11 0.00 0.00 0.00 0.00 44.72 43.81 1ffv s GLY 315 CO -0.07 -0.83 0.29 -0.54 0.00 0.00 0.00 173.10 171.95 1ffv s GLU 316 N -3.14 0.40 -0.02 2.90 2.02 -0.38 -1.21 118.70 119.27 1ffv s GLU 316 Ca 0.37 0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.66 1ffv s GLU 316 Cb -0.11 0.19 0.00 0.00 0.10 0.00 0.00 34.13 34.31 1ffv s GLU 316 CO 0.28 -0.07 -0.07 -0.51 0.02 0.00 0.00 175.26 174.92 1ffv s LEU 317 N -0.15 1.79 -0.08 1.80 1.02 -0.58 -2.11 118.68 120.37 1ffv s LEU 317 Ca -0.03 -0.15 0.02 0.00 0.02 0.00 0.00 54.13 54.00 1ffv s LEU 317 Cb -0.03 -0.45 -0.02 0.00 0.02 0.00 0.00 46.19 45.71 1ffv s LEU 317 CO 0.01 0.05 -0.14 0.00 0.02 0.00 0.00 176.35 176.29 1ffv s ALA 318 N 0.18 2.64 0.32 4.21 0.00 -0.44 -1.82 121.76 126.86 1ffv s ALA 318 Ca -0.02 -0.95 -0.17 0.00 0.00 0.00 0.00 51.96 50.81 1ffv s ALA 318 Cb -0.07 -1.04 0.03 0.00 0.00 0.00 0.00 23.12 22.03 1ffv s ALA 318 CO 0.00 0.45 0.71 0.00 0.00 0.00 0.00 175.76 176.92 1ffv s ALA 319 N -0.37 -0.84 0.17 0.00 0.00 -0.12 0.98 121.76 121.58 1ffv s ALA 319 Ca 0.04 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.44 1ffv s ALA 319 Cb -0.12 0.83 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 1ffv s ALA 319 CO 0.02 -0.99 0.30 0.95 0.00 0.00 0.00 175.76 176.04 1ffv s THR 320 N -3.31 5.31 0.24 0.00 -4.23 -0.77 -1.77 115.64 111.11 1ffv s THR 320 Ca 0.15 -0.73 0.13 0.00 -1.18 0.00 0.00 61.69 60.06 1ffv s THR 320 Cb -0.05 -3.76 0.13 0.00 1.34 0.00 0.00 72.50 70.16 1ffv s THR 320 CO 0.09 -0.13 1.28 1.55 -0.54 0.00 0.00 174.62 176.87 1ffv h PRO 321 N 1.97 0.00 -0.13 3.99 0.13 -1.94 0.91 132.00 136.94 1ffv h PRO 321 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1ffv h PRO 321 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ffv h PRO 321 CO 0.67 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.04 1ffv n ASP 322 N -2.18 1.81 0.00 1.44 5.75 -1.26 -4.92 116.55 117.19 1ffv n ASP 322 Ca -0.01 -1.68 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 1ffv n ASP 322 Cb 0.46 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 1ffv n ASP 322 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ffv n GLY 323 N 1.18 0.77 3.65 6.12 0.00 0.31 -5.00 105.19 112.22 1ffv n GLY 323 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1ffv n GLY 323 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ffv s LYS 324 N -0.60 4.14 0.09 1.61 2.47 -1.24 -4.82 119.74 121.40 1ffv s LYS 324 Ca 0.00 1.20 -0.31 0.00 -1.56 0.00 0.00 55.97 55.31 1ffv s LYS 324 Cb 0.00 -3.71 -0.07 0.00 -1.46 0.00 0.00 37.83 32.59 1ffv s LYS 324 CO 0.00 -0.80 1.28 0.42 0.16 0.00 0.00 175.35 176.41 1ffv s ILE 325 N 3.51 3.67 -0.14 5.43 1.01 -1.26 -1.84 121.20 131.58 1ffv s ILE 325 Ca 0.46 1.21 0.15 0.00 0.00 0.00 0.00 60.65 62.47 1ffv s ILE 325 Cb -0.14 -3.78 -0.21 0.00 0.01 0.00 0.00 42.46 38.35 1ffv s ILE 325 CO 0.12 0.10 0.10 0.18 0.00 0.00 0.00 174.94 175.45 1ffv n LEU 326 N 3.83 0.00 -3.56 2.97 4.77 0.28 -4.66 117.00 120.63 1ffv n LEU 326 Ca 0.10 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.98 1ffv n LEU 326 Cb 0.44 0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 41.85 1ffv n LEU 326 CO 0.57 0.33 0.47 -0.83 -1.33 0.00 0.00 177.39 176.61 1ffv s GLY 327 N -4.81 -0.45 -0.02 -0.72 0.00 -1.03 -3.45 107.32 96.84 1ffv s GLY 327 Ca -0.08 0.35 0.00 0.00 0.00 0.00 0.00 44.72 44.99 1ffv s GLY 327 CO 0.66 0.11 0.01 -2.27 0.00 0.00 0.00 173.10 171.62 1ffv s LEU 328 N -2.77 1.17 -0.05 0.66 2.96 -0.34 -1.32 118.68 118.99 1ffv s LEU 328 Ca 0.05 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 1ffv s LEU 328 Cb -0.02 -0.14 0.02 0.00 0.50 0.00 0.00 46.19 46.55 1ffv s LEU 328 CO -0.07 -0.11 -0.03 -0.60 -1.32 0.00 0.00 176.35 174.22 1ffv s ARG 329 N 0.99 0.77 0.01 1.98 3.52 -0.90 -1.13 118.95 124.19 1ffv s ARG 329 Ca -0.09 -0.05 0.03 0.00 -0.13 0.00 0.00 55.73 55.49 1ffv s ARG 329 Cb -0.13 -0.87 -0.01 0.00 -1.56 0.00 0.00 34.95 32.38 1ffv s ARG 329 CO -0.02 -0.14 -0.10 0.08 -0.81 0.00 0.00 175.30 174.31 1ffv s VAL 330 N 1.18 0.77 -0.04 7.11 1.01 -0.27 -1.25 120.40 128.92 1ffv s VAL 330 Ca -0.07 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1ffv s VAL 330 Cb -0.14 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.57 1ffv s VAL 330 CO -0.01 0.06 -0.03 0.20 0.00 0.00 0.00 175.10 175.31 1ffv s ASN 331 N -0.66 0.81 0.03 3.32 -0.87 -0.75 -1.35 114.94 115.46 1ffv s ASN 331 Ca 0.01 -0.10 0.04 0.00 -1.57 0.00 0.00 52.86 51.24 1ffv s ASN 331 Cb -0.06 -0.38 -0.02 0.00 -0.02 0.00 0.00 41.25 40.78 1ffv s ASN 331 CO 0.00 -0.07 -0.11 -0.69 -2.57 0.00 0.00 177.10 173.66 1ffv s VAL 332 N 0.97 0.84 -0.26 1.60 1.01 0.47 -0.70 120.40 124.34 1ffv s VAL 332 Ca -0.10 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1ffv s VAL 332 Cb -0.14 -0.78 0.03 0.00 0.00 0.00 0.00 36.38 35.49 1ffv s VAL 332 CO -0.01 -0.03 -0.05 -0.69 0.00 0.00 0.00 175.10 174.33 1ffv s VAL 333 N -0.76 2.98 -0.21 2.92 1.01 -0.43 -1.11 120.40 124.79 1ffv s VAL 333 Ca -0.00 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 60.84 1ffv s VAL 333 Cb -0.07 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 1ffv s VAL 333 CO 0.01 0.17 0.23 0.00 0.00 0.00 0.00 175.10 175.51 1ffv s ALA 334 N 1.34 3.61 -0.48 5.51 0.00 0.19 -1.48 121.76 130.45 1ffv s ALA 334 Ca 0.00 -0.69 -0.18 0.00 0.00 0.00 0.00 51.96 51.09 1ffv s ALA 334 Cb -0.17 -2.37 0.05 0.00 0.00 0.00 0.00 23.12 20.63 1ffv s ALA 334 CO -0.04 -0.09 0.52 0.34 0.00 0.00 0.00 175.76 176.49 1ffv s ASP 335 N 0.81 6.20 0.00 0.00 -1.08 -0.90 -0.05 116.67 121.65 1ffv s ASP 335 Ca 0.12 -0.96 0.21 0.00 -0.52 0.00 0.00 52.55 51.40 1ffv s ASP 335 Cb -0.13 -2.25 0.34 0.00 -1.46 0.00 0.00 42.92 39.42 1ffv s ASP 335 CO 0.04 -0.75 1.29 1.41 0.52 0.00 0.00 175.17 177.68 1ffv n HIS 336 N 5.77 0.36 -4.18 -5.34 8.25 -0.86 -4.86 115.22 114.37 1ffv n HIS 336 Ca -0.08 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.17 1ffv n HIS 336 Cb 0.45 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.56 1ffv n HIS 336 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ffv n GLY 337 N 1.27 -1.63 0.20 -1.41 0.00 -1.26 -4.10 105.19 98.27 1ffv n GLY 337 Ca 0.16 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 1ffv n GLY 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffv h ALA 338 N -0.18 -0.24 -4.32 4.61 0.00 0.19 -2.75 119.26 116.57 1ffv h ALA 338 Ca 0.00 -0.01 -0.68 0.00 0.00 0.00 0.00 54.91 54.22 1ffv h ALA 338 Cb 0.00 0.26 -0.27 0.00 0.00 0.00 0.00 17.79 17.78 1ffv h ALA 338 CO 0.00 -0.67 -0.88 -0.06 0.00 0.00 0.00 179.25 177.64 1ffv s PHE 339 N -6.13 2.24 -0.68 0.00 0.08 -1.26 -4.79 117.98 107.44 1ffv s PHE 339 Ca -0.15 -0.41 -0.24 0.00 0.12 0.00 0.00 56.93 56.25 1ffv s PHE 339 Cb 0.08 -1.36 0.05 0.00 -0.57 0.00 0.00 43.02 41.22 1ffv s PHE 339 CO 0.66 0.09 1.09 0.34 -0.10 0.00 0.00 175.22 177.30 1ffv s ASP 340 N -1.12 6.18 -0.20 1.36 2.15 -1.26 -4.45 116.67 119.34 1ffv s ASP 340 Ca 0.11 -0.72 0.14 0.00 0.43 0.00 0.00 52.55 52.50 1ffv s ASP 340 Cb -0.10 -2.48 0.40 0.00 -0.30 0.00 0.00 42.92 40.45 1ffv s ASP 340 CO 0.01 -1.58 1.25 0.00 -0.17 0.00 0.00 175.17 174.69 1ffv n ALA 341 N 8.35 3.27 -1.83 3.66 0.00 -1.26 -4.08 120.51 128.62 1ffv n ALA 341 Ca -0.01 -2.98 -0.42 0.00 0.00 0.00 0.00 53.44 50.03 1ffv n ALA 341 Cb 0.47 -0.45 -0.03 0.00 0.00 0.00 0.00 19.45 19.44 1ffv n ALA 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ffv s ALA 343 N 5.09 3.64 -0.14 0.00 0.00 -1.26 -3.57 121.76 125.51 1ffv s ALA 343 Ca 0.83 1.09 -0.34 0.00 0.00 0.00 0.00 51.96 53.54 1ffv s ALA 343 Cb -0.36 -3.73 0.13 0.00 0.00 0.00 0.00 23.12 19.16 1ffv s ALA 343 CO 0.35 -1.29 1.15 -0.51 0.00 0.00 0.00 175.76 175.46 1ffv s ASP 344 N 3.06 -0.18 0.47 0.00 1.01 -1.26 -4.69 116.67 115.08 1ffv s ASP 344 Ca 0.75 -0.01 -0.23 0.00 0.71 0.00 0.00 52.55 53.77 1ffv s ASP 344 Cb -0.37 0.20 -0.07 0.00 1.01 0.00 0.00 42.92 43.69 1ffv s ASP 344 CO 0.32 -0.32 1.23 -2.84 0.21 0.00 0.00 175.17 173.77 1ffv s PRO 345 N -2.57 3.65 0.60 8.23 0.02 -1.26 -4.78 135.00 138.90 1ffv s PRO 345 Ca 0.09 1.94 0.28 0.00 0.02 0.00 0.00 61.00 63.33 1ffv s PRO 345 Cb -0.01 -2.43 1.40 0.00 0.02 0.00 0.00 34.50 33.48 1ffv s PRO 345 CO -0.05 -0.69 1.81 1.79 -0.33 0.00 0.00 177.00 179.53 1ffv h THR 346 N 1.88 0.28 -0.23 0.99 1.35 -1.39 -1.05 112.91 114.74 1ffv h THR 346 Ca -0.50 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 1ffv h THR 346 Cb 1.26 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 1ffv h THR 346 CO 0.60 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 176.16 1ffv n LYS 347 N -3.56 1.98 -3.60 4.72 5.02 -1.26 -4.64 118.16 116.81 1ffv n LYS 347 Ca 0.09 -1.47 -0.27 0.00 -2.02 0.00 0.00 58.31 54.64 1ffv n LYS 347 Cb 0.77 -1.43 -0.11 0.00 -0.02 0.00 0.00 35.03 34.24 1ffv n LYS 347 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1ffv n PHE 348 N 0.70 1.02 0.18 2.13 3.01 -0.40 -4.93 117.46 119.17 1ffv n PHE 348 Ca 0.17 -3.77 0.04 0.00 1.01 0.00 0.00 57.45 54.90 1ffv n PHE 348 Cb 0.42 -0.16 0.20 0.00 -0.01 0.00 0.00 39.48 39.93 1ffv n PHE 348 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1ffv n PRO 349 N 2.34 0.03 -0.53 -1.08 -0.04 -1.26 -0.43 135.00 134.03 1ffv n PRO 349 Ca 0.25 0.45 0.06 0.00 -0.04 0.00 0.00 63.50 64.23 1ffv n PRO 349 Cb 0.42 -1.59 0.14 0.00 -0.04 0.00 0.00 33.50 32.43 1ffv n PRO 349 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ffv n ALA 350 N -1.56 2.87 -0.69 0.55 0.00 -1.26 -5.05 120.51 115.36 1ffv n ALA 350 Ca 0.01 -2.73 0.00 0.00 0.00 0.00 0.00 53.44 50.71 1ffv n ALA 350 Cb 0.07 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1ffv n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffv n GLY 351 N -0.91 2.19 2.43 0.00 0.00 0.42 -2.34 105.19 106.98 1ffv n GLY 351 Ca 0.14 -0.39 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 1ffv n GLY 351 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ffv n LEU 352 N 0.00 7.19 0.30 0.99 4.77 0.39 -4.67 117.00 125.97 1ffv n LEU 352 Ca 0.00 -4.51 0.16 0.00 -0.03 0.00 0.00 56.01 51.63 1ffv n LEU 352 Cb 0.00 -0.90 0.93 0.00 -2.33 0.00 0.00 43.42 41.12 1ffv n LEU 352 CO 0.00 1.65 1.10 0.15 -1.33 0.00 0.00 177.39 178.97 1ffv h PHE 353 N 2.27 0.00 0.00 -1.77 3.57 -1.60 -2.29 116.94 117.12 1ffv h PHE 353 Ca 0.56 0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.06 1ffv h PHE 353 Cb 0.73 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.47 1ffv h PHE 353 CO 1.28 0.02 0.00 -2.39 -2.23 0.00 0.00 178.31 174.99 1ffv n HIS 354 N -3.67 0.00 0.18 0.41 1.44 -1.26 -1.63 115.22 110.69 1ffv n HIS 354 Ca -0.03 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.79 1ffv n HIS 354 Cb 0.11 -0.04 0.27 0.00 0.12 0.00 0.00 29.99 30.46 1ffv n HIS 354 CO 0.00 0.00 0.00 1.51 -2.81 0.00 0.00 176.34 175.04 1ffv n ILE 355 N -0.12 0.70 0.72 0.61 0.00 -0.86 -4.39 119.36 116.02 1ffv n ILE 355 Ca 0.00 -0.78 0.03 0.00 0.00 0.00 0.00 62.75 62.00 1ffv n ILE 355 Cb 0.09 0.55 0.18 0.00 0.00 0.00 0.00 39.64 40.46 1ffv n ILE 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ffv n SER 357 N -0.76 0.31 0.00 0.00 3.41 -1.26 -4.56 113.62 110.76 1ffv n SER 357 Ca 0.04 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 1ffv n SER 357 Cb 0.02 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 1ffv n SER 357 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ffv n GLY 358 N 1.33 1.28 0.87 5.00 0.00 -0.73 -3.09 105.19 109.85 1ffv n GLY 358 Ca 0.06 -0.62 0.03 0.00 0.00 0.00 0.00 46.02 45.49 1ffv n GLY 358 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ffv n SER 359 N -1.39 2.38 -4.51 1.61 7.64 -1.26 -4.82 113.62 113.26 1ffv n SER 359 Ca 0.00 -2.24 -0.31 0.00 1.01 0.00 0.00 58.87 57.32 1ffv n SER 359 Cb 0.00 -0.45 -0.12 0.00 -1.01 0.00 0.00 64.21 62.63 1ffv n SER 359 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1ffv s TYR 360 N -1.65 2.70 -1.07 1.43 2.02 -1.18 -1.40 117.35 118.20 1ffv s TYR 360 Ca 0.20 -0.16 -0.22 0.00 -0.37 0.00 0.00 57.07 56.52 1ffv s TYR 360 Cb 0.14 -1.54 0.06 0.00 -0.40 0.00 0.00 41.96 40.22 1ffv s TYR 360 CO 0.08 0.29 1.48 0.34 -1.57 0.00 0.00 175.55 176.17 1ffv s ASP 361 N -1.34 6.57 -0.31 2.29 2.15 -0.46 -4.82 116.67 120.75 1ffv s ASP 361 Ca 0.15 -1.67 -0.09 0.00 0.43 0.00 0.00 52.55 51.37 1ffv s ASP 361 Cb -0.11 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1ffv s ASP 361 CO 0.06 -1.42 0.14 -0.63 -0.17 0.00 0.00 175.17 173.15 1ffv s ILE 362 N 4.69 4.45 0.33 4.11 1.01 -1.26 -4.91 121.20 129.62 1ffv s ILE 362 Ca 0.47 -0.54 0.30 0.00 0.00 0.00 0.00 60.65 60.87 1ffv s ILE 362 Cb 0.00 -3.30 0.31 0.00 0.01 0.00 0.00 42.46 39.49 1ffv s ILE 362 CO -0.07 0.03 2.04 1.55 0.00 0.00 0.00 174.94 178.49 1ffv h PRO 363 N 8.33 0.00 -3.35 2.79 0.13 -1.83 -3.36 132.00 134.71 1ffv h PRO 363 Ca -0.31 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.54 1ffv h PRO 363 Cb 1.14 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.93 1ffv h PRO 363 CO 0.62 0.11 -0.66 1.03 -0.23 0.00 0.00 178.00 178.86 1ffv s ARG 364 N -3.99 0.02 0.09 0.86 0.52 -1.22 -4.89 118.95 110.35 1ffv s ARG 364 Ca -0.02 0.32 -0.20 0.00 -0.52 0.00 0.00 55.73 55.31 1ffv s ARG 364 Cb 0.12 -0.24 0.05 0.00 0.52 0.00 0.00 34.95 35.39 1ffv s ARG 364 CO 0.57 -0.19 0.48 0.00 0.02 0.00 0.00 175.30 176.18 1ffv s ALA 365 N 1.31 -1.20 -0.27 2.13 0.00 -1.26 -1.19 121.76 121.28 1ffv s ALA 365 Ca -0.07 0.32 -0.23 0.00 0.00 0.00 0.00 51.96 51.98 1ffv s ALA 365 Cb -0.12 0.57 0.08 0.00 0.00 0.00 0.00 23.12 23.64 1ffv s ALA 365 CO -0.05 -0.59 0.75 -1.58 0.00 0.00 0.00 175.76 174.30 1ffv s HIS 366 N -3.13 -0.79 0.10 0.00 5.04 -0.28 -1.65 115.29 114.57 1ffv s HIS 366 Ca -0.01 1.87 0.05 0.00 -1.54 0.00 0.00 55.06 55.42 1ffv s HIS 366 Cb 0.00 0.34 -0.03 0.00 0.04 0.00 0.00 32.58 32.92 1ffv s HIS 366 CO -0.07 -0.38 -0.13 0.00 -2.34 0.00 0.00 174.74 171.81 1ffv s SER 368 N -2.23 0.07 -0.09 0.00 0.15 -0.46 -2.23 113.70 108.92 1ffv s SER 368 Ca 0.04 0.45 0.04 0.00 0.70 0.00 0.00 55.95 57.18 1ffv s SER 368 Cb -0.06 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.64 1ffv s SER 368 CO 0.02 -0.19 -0.22 -0.69 1.20 0.00 0.00 173.24 173.36 1ffv s VAL 369 N 1.65 1.91 -0.24 4.45 1.01 0.13 -0.39 120.40 128.93 1ffv s VAL 369 Ca -0.05 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.01 1ffv s VAL 369 Cb -0.11 -1.66 0.05 0.00 0.00 0.00 0.00 36.38 34.66 1ffv s VAL 369 CO -0.07 0.53 -0.12 -0.75 0.00 0.00 0.00 175.10 174.68 1ffv s LYS 370 N 0.33 2.31 0.08 2.72 2.20 -0.27 -0.29 119.74 126.82 1ffv s LYS 370 Ca -0.16 -1.16 -0.16 0.00 -0.36 0.00 0.00 55.97 54.12 1ffv s LYS 370 Cb -0.17 -2.75 -0.06 0.00 -1.51 0.00 0.00 37.83 33.34 1ffv s LYS 370 CO 0.08 -0.49 0.52 0.20 -0.36 0.00 0.00 175.35 175.30 1ffv s GLY 371 N 1.20 2.55 0.07 5.54 0.00 -0.58 0.56 107.32 116.66 1ffv s GLY 371 Ca -0.05 -0.10 0.02 0.00 0.00 0.00 0.00 44.72 44.60 1ffv s GLY 371 CO -0.07 0.26 -0.08 -1.34 0.00 0.00 0.00 173.10 171.87 1ffv s VAL 372 N -1.23 0.66 0.26 1.40 -7.23 0.93 -0.69 120.40 114.49 1ffv s VAL 372 Ca 0.31 -1.49 -0.20 0.00 -1.81 0.00 0.00 61.98 58.79 1ffv s VAL 372 Cb -0.17 -1.13 -0.09 0.00 0.56 0.00 0.00 36.38 35.55 1ffv s VAL 372 CO 0.18 -0.59 0.77 -0.31 -0.31 0.00 0.00 175.10 174.83 1ffv s TYR 373 N -2.38 3.62 0.14 2.82 2.02 0.79 -2.03 117.35 122.32 1ffv s TYR 373 Ca 0.01 1.45 -0.12 0.00 -0.37 0.00 0.00 57.07 58.03 1ffv s TYR 373 Cb -0.03 -2.67 0.01 0.00 -0.40 0.00 0.00 41.96 38.87 1ffv s TYR 373 CO -0.02 0.28 0.32 0.95 -1.57 0.00 0.00 175.55 175.51 1ffv s THR 374 N -1.60 0.08 -1.38 -0.71 -4.23 -1.04 -4.88 115.64 101.88 1ffv s THR 374 Ca 0.46 -1.05 -0.14 0.00 -1.18 0.00 0.00 61.69 59.78 1ffv s THR 374 Cb -0.16 -1.50 -0.02 0.00 1.34 0.00 0.00 72.50 72.16 1ffv s THR 374 CO 0.21 -0.38 2.35 0.59 -0.54 0.00 0.00 174.62 176.85 1ffv n ASN 375 N -0.19 4.87 -4.14 3.99 5.03 -0.12 -0.17 115.26 124.52 1ffv n ASN 375 Ca -0.12 -2.73 -0.11 0.00 0.87 0.00 0.00 54.58 52.49 1ffv n ASN 375 Cb 0.63 -1.53 -0.09 0.00 -1.02 0.00 0.00 39.78 37.77 1ffv n ASN 375 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1ffv s LYS 376 N 3.22 1.23 0.51 3.52 1.02 -1.25 -4.55 119.74 123.44 1ffv s LYS 376 Ca 0.53 -1.50 -0.21 0.00 0.02 0.00 0.00 55.97 54.80 1ffv s LYS 376 Cb 0.15 0.31 -0.06 0.00 -0.52 0.00 0.00 37.83 37.71 1ffv s LYS 376 CO -0.05 -0.42 1.19 0.00 -0.92 0.00 0.00 175.35 175.15 1ffv s ALA 377 N -4.11 2.81 1.00 5.17 0.00 -1.26 -0.61 121.76 124.77 1ffv s ALA 377 Ca 0.33 0.98 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 1ffv s ALA 377 Cb 0.05 -3.42 0.19 0.00 0.00 0.00 0.00 23.12 19.95 1ffv s ALA 377 CO 0.09 -0.88 1.08 -2.14 0.00 0.00 0.00 175.76 173.92 1ffv s PRO 378 N -2.97 0.38 0.00 0.00 0.02 -1.26 -4.40 135.00 126.78 1ffv s PRO 378 Ca 0.69 0.74 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1ffv s PRO 378 Cb -0.30 -1.71 0.00 0.00 0.02 0.00 0.00 34.50 32.51 1ffv s PRO 378 CO 0.35 -2.82 0.00 0.41 -0.33 0.00 0.00 177.00 174.61 1ffv n GLY 379 N -0.58 0.79 0.00 0.52 0.00 -1.26 -3.95 105.19 100.70 1ffv n GLY 379 Ca 0.06 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1ffv n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffv n GLY 380 N 0.00 3.62 3.46 -0.02 0.00 -0.19 -4.19 105.19 107.88 1ffv n GLY 380 Ca 0.00 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1ffv n GLY 380 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ffv s VAL 381 N 0.00 5.01 -1.00 1.61 1.01 -1.25 -2.30 120.40 123.48 1ffv s VAL 381 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1ffv s VAL 381 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1ffv s VAL 381 CO 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 175.10 174.97 1ffv n ALA 382 N 5.08 0.00 0.00 5.51 0.00 -1.26 -4.53 120.51 125.31 1ffv n ALA 382 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1ffv n ALA 382 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1ffv n ALA 382 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1ffv n TYR 383 N 0.08 0.00 -2.43 0.00 4.19 0.11 -4.76 117.16 114.36 1ffv n TYR 383 Ca 0.00 0.00 0.03 0.00 3.31 0.00 0.00 57.90 61.24 1ffv n TYR 383 Cb 0.00 -0.89 0.01 0.00 0.49 0.00 0.00 39.34 38.95 1ffv n TYR 383 CO 0.00 0.00 0.00 0.43 0.91 0.00 0.00 176.86 178.20 1ffv n SER 386 N 0.00 0.77 -1.93 2.98 7.64 -1.26 -4.96 113.62 116.86 1ffv n SER 386 Ca 0.00 -1.99 -0.00 0.00 1.01 0.00 0.00 58.87 57.88 1ffv n SER 386 Cb 0.00 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1ffv n SER 386 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1ffv n PHE 387 N 0.43 -0.81 -1.16 1.43 3.72 -1.26 -4.21 117.46 115.60 1ffv n PHE 387 Ca 0.03 0.31 -0.05 0.00 -0.05 0.00 0.00 57.45 57.68 1ffv n PHE 387 Cb 1.08 -2.28 -0.02 0.00 -0.94 0.00 0.00 39.48 37.32 1ffv n PHE 387 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1ffv n ARG 388 N -1.27 -1.42 0.04 -1.08 5.12 -1.26 -0.46 116.66 116.32 1ffv n ARG 388 Ca -0.00 0.62 -0.04 0.00 -1.93 0.00 0.00 57.85 56.50 1ffv n ARG 388 Cb 0.50 -4.80 0.19 0.00 -1.16 0.00 0.00 32.46 27.19 1ffv n ARG 388 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1ffv h VAL 389 N 0.00 1.29 -0.40 1.55 2.07 -1.83 -2.14 116.25 116.79 1ffv h VAL 389 Ca -0.11 -1.41 0.07 0.00 0.82 0.00 0.00 66.70 66.07 1ffv h VAL 389 Cb 0.88 1.50 -0.06 0.00 -1.52 0.00 0.00 31.29 32.08 1ffv h VAL 389 CO 0.16 0.44 0.03 0.71 0.02 0.00 0.00 177.57 178.93 1ffv h THR 390 N 0.36 0.73 -0.54 2.57 1.35 -1.90 0.20 112.91 115.69 1ffv h THR 390 Ca 0.04 -0.05 -0.11 0.00 -0.55 0.00 0.00 66.41 65.75 1ffv h THR 390 Cb 0.77 0.58 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 1ffv h THR 390 CO 0.06 0.03 -0.08 -0.33 -0.25 0.00 0.00 175.52 174.94 1ffv h GLU 391 N 0.14 1.00 -0.31 4.72 3.07 -1.91 -1.87 114.58 119.42 1ffv h GLU 391 Ca 0.20 -0.35 -0.02 0.00 -0.50 0.00 0.00 59.36 58.68 1ffv h GLU 391 Cb 0.27 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1ffv h GLU 391 CO -0.30 1.03 0.11 0.00 -1.40 0.00 0.00 179.01 178.45 1ffv h ALA 392 N 0.99 0.41 -0.45 3.43 0.00 -0.67 -1.15 119.26 121.82 1ffv h ALA 392 Ca 0.15 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1ffv h ALA 392 Cb 0.64 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1ffv h ALA 392 CO 0.04 0.02 -0.27 0.28 0.00 0.00 0.00 179.25 179.32 1ffv h VAL 393 N 0.35 1.27 -0.72 0.00 2.07 -0.60 -2.78 116.25 115.84 1ffv h VAL 393 Ca 0.10 -1.44 -0.07 0.00 0.82 0.00 0.00 66.70 66.11 1ffv h VAL 393 Cb 0.21 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1ffv h VAL 393 CO -0.01 0.49 0.18 0.22 0.02 0.00 0.00 177.57 178.48 1ffv h TYR 394 N 0.83 1.21 0.57 1.57 3.20 -1.25 -1.73 116.97 121.37 1ffv h TYR 394 Ca 0.09 -0.14 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1ffv h TYR 394 Cb 0.86 -0.34 0.01 0.00 1.54 0.00 0.00 36.73 38.79 1ffv h TYR 394 CO 0.06 0.97 -0.28 1.25 -1.64 0.00 0.00 178.16 178.52 1ffv h LEU 395 N 1.09 -0.65 -0.49 2.82 7.12 -1.14 -1.96 115.31 122.10 1ffv h LEU 395 Ca 0.23 -0.01 -0.04 0.00 0.13 0.00 0.00 57.88 58.19 1ffv h LEU 395 Cb 0.37 0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 40.65 1ffv h LEU 395 CO 0.00 -0.41 0.17 -0.29 -0.13 0.00 0.00 178.44 177.78 1ffv h ILE 396 N -0.86 1.22 -0.36 4.05 6.09 -1.45 -0.79 117.51 125.40 1ffv h ILE 396 Ca -0.08 -0.72 -0.09 0.00 -1.37 0.00 0.00 64.86 62.60 1ffv h ILE 396 Cb 0.62 0.78 -0.02 0.00 0.47 0.00 0.00 36.82 38.68 1ffv h ILE 396 CO 0.13 0.27 -0.14 -0.33 -3.07 0.00 0.00 178.15 175.01 1ffv h GLU 397 N 0.65 0.65 -0.27 2.19 4.39 -1.37 0.10 114.58 120.92 1ffv h GLU 397 Ca 0.16 -0.21 -0.15 0.00 0.34 0.00 0.00 59.36 59.50 1ffv h GLU 397 Cb 0.25 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1ffv h GLU 397 CO -0.01 0.76 -0.41 0.00 -1.16 0.00 0.00 179.01 178.20 1ffv h ARG 398 N 0.59 0.74 -0.77 2.33 2.47 -1.23 -2.66 114.38 115.86 1ffv h ARG 398 Ca 0.10 -0.45 -0.04 0.00 -1.26 0.00 0.00 59.98 58.33 1ffv h ARG 398 Cb 0.57 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.90 1ffv h ARG 398 CO 0.04 1.07 0.32 0.52 0.56 0.00 0.00 179.97 182.48 1ffv h MET 399 N 0.48 1.14 -0.60 0.04 2.86 -0.75 -0.96 114.93 117.15 1ffv h MET 399 Ca 0.02 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.42 1ffv h MET 399 Cb 1.00 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 32.44 1ffv h MET 399 CO 0.09 0.92 0.19 0.28 1.06 0.00 0.00 176.91 179.46 1ffv h VAL 400 N 1.11 1.23 -0.65 -2.22 2.07 -0.79 -0.37 116.25 116.63 1ffv h VAL 400 Ca 0.26 -0.77 -0.09 0.00 0.82 0.00 0.00 66.70 66.92 1ffv h VAL 400 Cb 0.19 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1ffv h VAL 400 CO -0.02 0.30 0.07 0.44 0.02 0.00 0.00 177.57 178.37 1ffv h ASP 401 N 0.88 1.06 -0.58 0.57 3.32 -1.05 -0.06 116.42 120.56 1ffv h ASP 401 Ca 0.20 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 1ffv h ASP 401 Cb 0.24 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 1ffv h ASP 401 CO -0.01 1.07 0.25 0.58 -1.72 0.00 0.00 179.24 179.41 1ffv h VAL 402 N 1.01 1.22 -0.28 -1.35 2.07 -0.53 -1.25 116.25 117.15 1ffv h VAL 402 Ca 0.19 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1ffv h VAL 402 Cb 0.49 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1ffv h VAL 402 CO 0.02 0.26 0.08 0.25 0.02 0.00 0.00 177.57 178.20 1ffv h LEU 403 N 0.79 0.40 -1.17 2.57 5.85 -0.80 -1.91 115.31 121.03 1ffv h LEU 403 Ca 0.19 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.76 1ffv h LEU 403 Cb 0.17 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 1ffv h LEU 403 CO -0.02 0.51 0.57 0.00 -0.34 0.00 0.00 178.44 179.16 1ffv h ALA 404 N 0.91 1.50 -0.01 1.25 0.00 -0.79 -1.77 119.26 120.35 1ffv h ALA 404 Ca 0.09 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1ffv h ALA 404 Cb 0.25 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1ffv h ALA 404 CO -0.00 0.39 -0.66 1.96 0.00 0.00 0.00 179.25 180.93 1ffv h GLN 405 N 1.03 0.04 -0.01 0.00 4.20 -0.95 0.55 115.11 119.98 1ffv h GLN 405 Ca 0.36 -0.03 -0.19 0.00 0.06 0.00 0.00 58.65 58.84 1ffv h GLN 405 Cb 0.12 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1ffv h GLN 405 CO -0.12 0.69 -0.85 -0.22 -0.67 0.00 0.00 178.83 177.66 1ffv h LYS 406 N 0.03 0.24 -0.01 1.46 3.64 -0.68 -3.02 116.57 118.23 1ffv h LYS 406 Ca -0.01 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1ffv h LYS 406 Cb 1.18 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1ffv h LYS 406 CO 0.09 0.95 -0.11 1.28 -2.27 0.00 0.00 179.45 179.40 1ffv n LEU 407 N -3.70 1.16 -3.68 5.20 4.77 -0.73 -4.92 117.00 115.09 1ffv n LEU 407 Ca -0.04 -0.34 -0.24 0.00 -0.03 0.00 0.00 56.01 55.36 1ffv n LEU 407 Cb 0.78 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.87 1ffv n LEU 407 CO 0.48 0.20 0.13 -3.20 -1.33 0.00 0.00 177.39 173.67 1ffv n ASN 408 N -0.29 -4.27 -4.53 -1.43 5.15 -0.38 -4.98 115.26 104.53 1ffv n ASN 408 Ca 0.16 -0.67 -0.33 0.00 -0.60 0.00 0.00 54.58 53.14 1ffv n ASN 408 Cb 0.33 -4.55 -0.12 0.00 -0.53 0.00 0.00 39.78 34.91 1ffv n ASN 408 CO 0.00 0.00 0.00 -0.32 1.40 0.00 0.00 177.26 178.34 1ffv s MET 409 N -6.18 2.67 0.28 1.20 1.75 0.18 -5.02 119.30 114.19 1ffv s MET 409 Ca 0.41 -0.62 -0.29 0.00 -1.25 0.00 0.00 55.69 53.94 1ffv s MET 409 Cb -0.19 -2.50 -0.13 0.00 2.84 0.00 0.00 34.83 34.84 1ffv s MET 409 CO 0.77 0.63 1.23 -3.47 -0.65 0.00 0.00 175.02 173.53 1ffv n ASP 410 N 2.32 2.20 0.22 1.11 2.03 -1.26 -4.46 116.55 118.71 1ffv n ASP 410 Ca -0.18 1.17 0.08 0.00 0.52 0.00 0.00 54.79 56.39 1ffv n ASP 410 Cb 0.53 -1.38 0.50 0.00 -0.72 0.00 0.00 41.12 40.04 1ffv n ASP 410 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1ffv h LYS 411 N 2.99 0.00 0.16 -0.67 1.57 -1.97 -2.33 116.57 116.33 1ffv h LYS 411 Ca -0.44 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.11 1ffv h LYS 411 Cb 1.30 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.63 1ffv h LYS 411 CO 0.67 0.26 -1.07 0.00 -0.57 0.00 0.00 179.45 178.73 1ffv h ALA 412 N 1.74 -0.05 -0.56 3.86 0.00 -1.97 -3.31 119.26 118.97 1ffv h ALA 412 Ca -0.00 -0.81 0.05 0.00 0.00 0.00 0.00 54.91 54.15 1ffv h ALA 412 Cb 0.62 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1ffv h ALA 412 CO 0.03 0.53 0.29 1.49 0.00 0.00 0.00 179.25 181.59 1ffv h GLU 413 N -0.25 0.53 0.00 0.00 4.81 -1.92 -1.67 114.58 116.09 1ffv h GLU 413 Ca -0.20 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.96 1ffv h GLU 413 Cb 1.78 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 31.03 1ffv h GLU 413 CO 0.16 0.35 -0.19 0.97 -0.73 0.00 0.00 179.01 179.58 1ffv h ILE 414 N 0.55 0.93 0.03 2.32 2.10 -1.57 -1.90 117.51 119.97 1ffv h ILE 414 Ca 0.25 -0.69 -0.11 0.00 1.08 0.00 0.00 64.86 65.38 1ffv h ILE 414 Cb 0.15 1.40 0.01 0.00 -1.09 0.00 0.00 36.82 37.29 1ffv h ILE 414 CO -0.17 0.18 -0.45 0.03 -1.08 0.00 0.00 178.15 176.66 1ffv h ARG 415 N 0.00 0.26 0.00 2.19 3.08 -1.48 -2.85 114.38 115.58 1ffv h ARG 415 Ca -0.00 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 59.73 1ffv h ARG 415 Cb 0.38 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 1ffv h ARG 415 CO 0.02 1.05 -0.01 0.00 -1.07 0.00 0.00 179.97 179.96 1ffv h ALA 416 N 0.22 1.44 0.03 0.04 0.00 -1.09 0.90 119.26 120.81 1ffv h ALA 416 Ca -0.06 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.61 1ffv h ALA 416 Cb 1.23 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ffv h ALA 416 CO 0.09 0.01 -0.99 -0.22 0.00 0.00 0.00 179.25 178.14 1ffv h LYS 417 N 0.00 0.29 -0.01 0.00 1.63 -1.33 -3.34 116.57 113.81 1ffv h LYS 417 Ca -0.00 -0.35 0.00 0.00 -0.85 0.00 0.00 60.65 59.45 1ffv h LYS 417 Cb 0.03 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.77 1ffv h LYS 417 CO 0.00 1.08 -0.69 0.09 -3.45 0.00 0.00 179.45 176.48 1ffv n ASN 418 N -3.65 1.39 -4.57 4.20 3.02 -0.47 -4.98 115.26 110.21 1ffv n ASN 418 Ca -0.06 -1.19 -0.39 0.00 -0.03 0.00 0.00 54.58 52.90 1ffv n ASN 418 Cb 0.87 0.75 0.03 0.00 -0.61 0.00 0.00 39.78 40.83 1ffv n ASN 418 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1ffv n PHE 419 N -0.79 0.48 -2.45 3.10 3.72 0.19 -1.35 117.46 120.35 1ffv n PHE 419 Ca 0.06 0.49 -0.42 0.00 -0.05 0.00 0.00 57.45 57.53 1ffv n PHE 419 Cb 0.36 -2.11 -0.03 0.00 -0.94 0.00 0.00 39.48 36.76 1ffv n PHE 419 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1ffv s ILE 420 N -1.48 4.17 0.52 4.37 1.01 -0.49 -4.48 121.20 124.82 1ffv s ILE 420 Ca 0.69 1.54 -0.20 0.00 0.00 0.00 0.00 60.65 62.68 1ffv s ILE 420 Cb -0.48 -3.99 -0.07 0.00 0.01 0.00 0.00 42.46 37.93 1ffv s ILE 420 CO 0.53 0.08 1.11 -0.13 0.00 0.00 0.00 174.94 176.53 1ffv s ARG 421 N 1.49 3.49 0.29 2.79 0.52 -1.26 -4.68 118.95 121.58 1ffv s ARG 421 Ca 0.57 1.58 0.03 0.00 -0.52 0.00 0.00 55.73 57.39 1ffv s ARG 421 Cb -0.27 -2.07 0.65 0.00 0.52 0.00 0.00 34.95 33.78 1ffv s ARG 421 CO 0.27 -0.73 1.77 -0.22 0.02 0.00 0.00 175.30 176.40 1ffv h LYS 422 N 1.37 0.67 0.00 3.54 3.64 -1.94 -0.16 116.57 123.69 1ffv h LYS 422 Ca -0.50 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1ffv h LYS 422 Cb 1.25 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1ffv h LYS 422 CO 0.58 0.44 0.00 0.39 -2.27 0.00 0.00 179.45 178.59 1ffv n GLU 423 N -4.82 0.18 0.03 1.90 4.71 -1.26 -2.88 120.64 118.50 1ffv n GLU 423 Ca 0.21 0.12 0.13 0.00 -0.01 0.00 0.00 57.16 57.61 1ffv n GLU 423 Cb 0.52 -1.50 0.35 0.00 -1.01 0.00 0.00 31.44 29.80 1ffv n GLU 423 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1ffv n GLN 424 N -1.36 0.12 -2.85 3.49 6.02 -0.07 -4.87 117.38 117.85 1ffv n GLN 424 Ca 0.08 0.06 -0.39 0.00 -0.01 0.00 0.00 57.00 56.73 1ffv n GLN 424 Cb 0.18 -1.60 -0.06 0.00 1.02 0.00 0.00 30.24 29.79 1ffv n GLN 424 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1ffv s PHE 425 N -3.06 3.92 -0.08 1.08 0.08 -1.14 -2.78 117.98 116.00 1ffv s PHE 425 Ca 0.10 1.79 -0.30 0.00 0.12 0.00 0.00 56.93 58.64 1ffv s PHE 425 Cb 0.16 -2.89 -0.04 0.00 -0.57 0.00 0.00 43.02 39.68 1ffv s PHE 425 CO 0.65 0.45 1.46 -1.25 -0.10 0.00 0.00 175.22 176.43 1ffv s PRO 426 N -1.27 4.22 -0.18 0.24 0.04 -1.26 -5.01 135.00 131.78 1ffv s PRO 426 Ca 0.40 1.95 -0.13 0.00 0.04 0.00 0.00 61.00 63.26 1ffv s PRO 426 Cb -0.24 -3.81 -0.05 0.00 0.04 0.00 0.00 34.50 30.45 1ffv s PRO 426 CO 0.29 -0.73 0.28 -0.47 0.04 0.00 0.00 177.00 176.41 1ffv s TYR 427 N 3.45 3.42 -0.32 0.56 5.04 -1.00 -4.89 117.35 123.61 1ffv s TYR 427 Ca 0.65 0.52 -0.13 0.00 -2.44 0.00 0.00 57.07 55.66 1ffv s TYR 427 Cb -0.29 -2.35 -0.02 0.00 0.35 0.00 0.00 41.96 39.65 1ffv s TYR 427 CO 0.24 0.17 0.28 0.99 -1.34 0.00 0.00 175.55 175.89 1ffv s THR 428 N 0.72 5.24 0.98 4.34 2.01 -1.26 -0.15 115.64 127.52 1ffv s THR 428 Ca 0.15 0.03 -0.15 0.00 0.31 0.00 0.00 61.69 62.03 1ffv s THR 428 Cb -0.13 -3.71 0.18 0.00 0.01 0.00 0.00 72.50 68.85 1ffv s THR 428 CO 0.04 0.03 1.18 0.42 -0.69 0.00 0.00 174.62 175.60 1ffv s THR 429 N 1.86 1.92 -0.44 -0.82 -4.23 -0.21 -4.89 115.64 108.84 1ffv s THR 429 Ca 0.09 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 60.80 1ffv s THR 429 Cb -0.17 -2.76 0.20 0.00 1.34 0.00 0.00 72.50 71.12 1ffv s THR 429 CO 0.11 0.00 1.61 1.67 -0.54 0.00 0.00 174.62 177.47 1ffv n GLN 430 N -3.96 0.14 0.00 3.99 -0.06 -1.26 -1.08 117.38 115.16 1ffv n GLN 430 Ca 0.10 0.51 0.10 0.00 -2.00 0.00 0.00 57.00 55.71 1ffv n GLN 430 Cb 0.59 -1.85 0.08 0.00 -4.06 0.00 0.00 30.24 25.00 1ffv n GLN 430 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 1ffv n PHE 431 N -2.13 0.00 -0.28 3.69 3.72 -1.26 -4.47 117.46 116.74 1ffv n PHE 431 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1ffv n PHE 431 Cb 0.12 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 1ffv n PHE 431 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ffv n GLY 432 N 1.11 0.69 3.80 1.37 0.00 -0.24 -4.76 105.19 107.15 1ffv n GLY 432 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1ffv n GLY 432 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ffv s PHE 433 N -2.43 3.61 -0.59 1.61 0.08 -1.26 -4.81 117.98 114.18 1ffv s PHE 433 Ca 0.00 1.62 -0.06 0.00 0.12 0.00 0.00 56.93 58.61 1ffv s PHE 433 Cb 0.00 -2.81 0.15 0.00 -0.57 0.00 0.00 43.02 39.80 1ffv s PHE 433 CO 0.00 0.19 0.43 -2.00 -0.10 0.00 0.00 175.22 173.74 1ffv s GLU 434 N -2.25 2.61 0.12 0.44 2.12 -1.26 -1.04 118.70 119.45 1ffv s GLU 434 Ca 0.50 -2.26 -0.32 0.00 0.36 0.00 0.00 54.97 53.25 1ffv s GLU 434 Cb -0.16 -3.85 -0.12 0.00 0.26 0.00 0.00 34.13 30.26 1ffv s GLU 434 CO 0.21 -1.18 1.77 0.66 -0.54 0.00 0.00 175.26 176.18 1ffv n TYR 435 N 4.01 2.54 0.12 5.30 4.02 0.79 -4.83 117.16 129.11 1ffv n TYR 435 Ca 0.04 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.90 57.79 1ffv n TYR 435 Cb 0.40 -2.67 -0.08 0.00 -0.02 0.00 0.00 39.34 36.97 1ffv n TYR 435 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 176.86 176.23 1ffv h ASP 436 N 7.73 -0.25 -5.03 7.72 2.03 -1.88 -2.64 116.42 124.10 1ffv h ASP 436 Ca -0.46 -0.19 0.07 0.00 -0.73 0.00 0.00 57.03 55.73 1ffv h ASP 436 Cb 1.23 0.06 -0.07 0.00 -0.83 0.00 0.00 39.33 39.72 1ffv h ASP 436 CO 0.94 0.06 0.27 -0.94 -1.03 0.00 0.00 179.24 178.54 1ffv s SER 437 N -5.17 -0.31 0.00 4.15 1.04 -1.26 -4.13 113.70 108.03 1ffv s SER 437 Ca -0.15 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.84 1ffv s SER 437 Cb 0.03 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.80 1ffv s SER 437 CO 0.60 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1ffv n GLY 438 N -0.44 1.09 2.73 7.32 0.00 -1.26 -4.87 105.19 109.76 1ffv n GLY 438 Ca -0.07 -0.76 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 1ffv n GLY 438 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ffv n ASP 439 N 0.00 -2.96 -0.13 1.61 -0.08 -1.26 -4.50 116.55 109.23 1ffv n ASP 439 Ca 0.00 -3.15 -0.11 0.00 -1.51 0.00 0.00 54.79 50.02 1ffv n ASP 439 Cb 0.00 1.70 0.01 0.00 2.34 0.00 0.00 41.12 45.16 1ffv n ASP 439 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 1ffv h TYR 440 N 4.36 1.09 -0.23 -0.67 0.05 -1.97 -3.16 116.97 116.43 1ffv h TYR 440 Ca -0.07 -0.29 0.00 0.00 0.05 0.00 0.00 58.73 58.43 1ffv h TYR 440 Cb 1.05 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.53 1ffv h TYR 440 CO 0.06 1.10 0.15 0.45 -1.05 0.00 0.00 178.16 178.87 1ffv h HIS 441 N 0.79 0.29 -0.53 4.88 3.86 -1.96 -0.34 115.15 122.14 1ffv h HIS 441 Ca 0.09 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1ffv h HIS 441 Cb 0.87 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 29.21 1ffv h HIS 441 CO 0.05 0.19 0.30 1.15 0.86 0.00 0.00 177.93 180.48 1ffv h THR 442 N 0.32 1.17 -0.54 2.45 2.02 -2.01 -1.60 112.91 114.72 1ffv h THR 442 Ca 0.09 -0.43 -0.09 0.00 0.77 0.00 0.00 66.41 66.75 1ffv h THR 442 Cb -0.03 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 1ffv h THR 442 CO -0.02 0.18 -0.02 0.00 0.37 0.00 0.00 175.52 176.04 1ffv h ALA 443 N 1.13 0.95 -0.22 6.16 0.00 -1.48 -2.10 119.26 123.70 1ffv h ALA 443 Ca 0.19 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1ffv h ALA 443 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1ffv h ALA 443 CO -0.03 0.63 -0.00 1.25 0.00 0.00 0.00 179.25 181.09 1ffv h LEU 444 N 0.86 0.38 -0.99 0.00 5.85 -0.82 -2.56 115.31 118.04 1ffv h LEU 444 Ca 0.16 -0.31 0.06 0.00 0.84 0.00 0.00 57.88 58.62 1ffv h LEU 444 Cb 0.53 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 1ffv h LEU 444 CO 0.03 0.60 0.64 0.50 -0.34 0.00 0.00 178.44 179.87 1ffv h LYS 445 N 0.15 1.15 -0.38 1.25 3.64 -1.17 -0.68 116.57 120.52 1ffv h LYS 445 Ca 0.06 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1ffv h LYS 445 Cb 0.41 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 1ffv h LYS 445 CO 0.01 0.76 0.22 -0.22 -2.27 0.00 0.00 179.45 177.95 1ffv h LYS 446 N 1.18 0.44 -0.20 1.90 3.64 -1.18 -1.50 116.57 120.84 1ffv h LYS 446 Ca 0.42 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.72 1ffv h LYS 446 Cb 0.13 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1ffv h LYS 446 CO -0.16 0.29 -0.06 0.28 -2.27 0.00 0.00 179.45 177.53 1ffv h VAL 447 N 0.45 1.29 -0.63 2.00 2.07 -0.96 -1.40 116.25 119.07 1ffv h VAL 447 Ca 0.15 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.65 1ffv h VAL 447 Cb 0.01 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 1ffv h VAL 447 CO -0.07 0.32 0.36 -0.07 0.02 0.00 0.00 177.57 178.14 1ffv h LEU 448 N 0.12 0.56 -0.54 2.57 3.38 -1.00 -2.10 115.31 118.31 1ffv h LEU 448 Ca 0.05 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 1ffv h LEU 448 Cb 0.52 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1ffv h LEU 448 CO 0.02 0.38 -0.23 0.44 0.09 0.00 0.00 178.44 179.14 1ffv h ASP 449 N 0.69 0.96 -0.70 -0.43 3.32 -1.25 -1.06 116.42 117.96 1ffv h ASP 449 Ca 0.27 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1ffv h ASP 449 Cb 0.11 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 1ffv h ASP 449 CO -0.14 1.14 0.39 0.00 -1.72 0.00 0.00 179.24 178.91 1ffv h ALA 450 N 0.92 1.35 -0.26 3.45 0.00 -0.69 -2.76 119.26 121.28 1ffv h ALA 450 Ca 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ffv h ALA 450 Cb 0.80 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ffv h ALA 450 CO 0.07 0.53 0.00 1.33 0.00 0.00 0.00 179.25 181.18 1ffv n VAL 451 N -4.37 0.34 -3.53 0.00 0.24 -0.84 -4.99 118.33 105.18 1ffv n VAL 451 Ca 0.07 -0.67 -0.24 0.00 -2.04 0.00 0.00 64.34 61.46 1ffv n VAL 451 Cb 0.10 1.14 0.04 0.00 -1.47 0.00 0.00 33.84 33.65 1ffv n VAL 451 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1ffv n ASP 452 N 1.37 -5.88 -0.16 -1.34 -0.08 -0.71 -4.74 116.55 105.00 1ffv n ASP 452 Ca 0.17 -0.83 -0.03 0.00 -1.51 0.00 0.00 54.79 52.59 1ffv n ASP 452 Cb 0.58 -3.81 0.04 0.00 2.34 0.00 0.00 41.12 40.27 1ffv n ASP 452 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1ffv h TYR 453 N -1.28 -0.20 -0.69 -0.67 3.20 -1.52 -1.79 116.97 114.02 1ffv h TYR 453 Ca -0.56 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.39 1ffv h TYR 453 Cb 1.31 0.17 -0.04 0.00 1.54 0.00 0.00 36.73 39.71 1ffv h TYR 453 CO 0.30 -0.19 0.45 -1.00 -1.64 0.00 0.00 178.16 176.08 1ffv h PRO 454 N 0.03 0.80 -0.21 1.82 0.13 -1.91 -1.05 132.00 131.61 1ffv h PRO 454 Ca 0.25 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 65.24 1ffv h PRO 454 Cb 0.38 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.32 1ffv h PRO 454 CO -0.50 0.53 -0.26 0.00 -0.23 0.00 0.00 178.00 177.54 1ffv h ALA 455 N 1.60 1.17 -0.47 -0.56 0.00 -1.70 -0.56 119.26 118.74 1ffv h ALA 455 Ca 0.28 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1ffv h ALA 455 Cb 0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1ffv h ALA 455 CO -0.08 0.53 0.02 -0.07 0.00 0.00 0.00 179.25 179.66 1ffv h LEU 456 N 0.35 0.79 -0.92 0.00 3.38 -0.61 -0.63 115.31 117.68 1ffv h LEU 456 Ca 0.05 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.63 1ffv h LEU 456 Cb 0.65 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1ffv h LEU 456 CO 0.05 0.89 -0.22 0.03 0.09 0.00 0.00 178.44 179.28 1ffv h ARG 457 N 0.67 0.54 -0.35 1.13 2.47 -0.92 -1.15 114.38 116.77 1ffv h ARG 457 Ca 0.14 -0.20 -0.05 0.00 -1.26 0.00 0.00 59.98 58.61 1ffv h ARG 457 Cb 0.47 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.74 1ffv h ARG 457 CO 0.02 0.73 0.03 0.00 0.56 0.00 0.00 179.97 181.30 1ffv h ALA 458 N 1.28 0.46 -0.66 0.04 0.00 -0.79 -0.87 119.26 118.72 1ffv h ALA 458 Ca 0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1ffv h ALA 458 Cb 0.65 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1ffv h ALA 458 CO 0.05 0.20 0.30 1.49 0.00 0.00 0.00 179.25 181.28 1ffv h GLU 459 N 0.41 0.97 -0.84 0.00 4.81 -0.93 -1.92 114.58 117.09 1ffv h GLU 459 Ca 0.10 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1ffv h GLU 459 Cb 0.41 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 1ffv h GLU 459 CO 0.01 0.78 0.42 0.37 -0.73 0.00 0.00 179.01 179.86 1ffv h GLN 460 N 0.92 1.20 -0.68 1.92 4.15 -1.01 -2.08 115.11 119.53 1ffv h GLN 460 Ca 0.23 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 1ffv h GLN 460 Cb 0.15 -0.22 -0.03 0.00 0.21 0.00 0.00 27.48 27.59 1ffv h GLN 460 CO -0.03 0.91 0.17 0.00 -1.93 0.00 0.00 178.83 177.95 1ffv h ALA 461 N 1.26 1.02 0.05 3.38 0.00 -0.72 -2.31 119.26 121.94 1ffv h ALA 461 Ca 0.29 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ffv h ALA 461 Cb 0.10 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1ffv h ALA 461 CO -0.04 0.64 -0.02 0.00 0.00 0.00 0.00 179.25 179.83 1ffv h ALA 462 N 1.16 -0.07 -0.82 0.00 0.00 -0.92 -2.58 119.26 116.04 1ffv h ALA 462 Ca 0.22 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1ffv h ALA 462 Cb 0.35 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1ffv h ALA 462 CO 0.00 -0.41 0.51 0.00 0.00 0.00 0.00 179.25 179.35 1ffv h ARG 463 N -0.31 0.93 0.00 0.00 3.08 -1.36 -1.43 114.38 115.29 1ffv h ARG 463 Ca -0.01 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1ffv h ARG 463 Cb 0.28 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1ffv h ARG 463 CO 0.01 0.62 -0.13 0.00 -1.07 0.00 0.00 179.97 179.40 1ffv h ARG 464 N 0.96 0.00 -0.08 0.04 3.08 -1.37 -3.04 114.38 113.97 1ffv h ARG 464 Ca 0.35 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.38 1ffv h ARG 464 Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1ffv h ARG 464 CO -0.15 0.13 -0.02 0.00 -1.07 0.00 0.00 179.97 178.86 1ffv h ALA 465 N 1.87 0.11 -2.00 0.04 0.00 -0.84 -3.41 119.26 115.02 1ffv h ALA 465 Ca -0.00 -0.22 -0.57 0.00 0.00 0.00 0.00 54.91 54.12 1ffv h ALA 465 Cb 0.29 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1ffv h ALA 465 CO 0.02 -0.16 0.95 0.34 0.00 0.00 0.00 179.25 180.39 1ffv s ASP 466 N -5.74 6.74 0.59 0.00 3.68 -1.15 -4.90 116.67 115.88 1ffv s ASP 466 Ca -0.15 1.31 0.34 0.00 2.13 0.00 0.00 52.55 56.18 1ffv s ASP 466 Cb 0.04 -2.54 1.84 0.00 -1.45 0.00 0.00 42.92 40.81 1ffv s ASP 466 CO 0.70 -1.00 2.21 -0.65 0.13 0.00 0.00 175.17 176.56 1ffv h PRO 467 N 9.00 0.00 -0.56 4.34 0.11 -1.83 -2.89 132.00 140.17 1ffv h PRO 467 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1ffv h PRO 467 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1ffv h PRO 467 CO 1.02 0.04 0.00 0.09 -0.21 0.00 0.00 178.00 178.94 1ffv n ASN 468 N -3.49 5.62 -4.66 -2.05 5.03 -1.26 -4.95 115.26 109.50 1ffv n ASN 468 Ca -0.02 -2.93 -0.42 0.00 0.87 0.00 0.00 54.58 52.07 1ffv n ASN 468 Cb 0.15 -0.68 -0.03 0.00 -1.02 0.00 0.00 39.78 38.21 1ffv n ASN 468 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1ffv s SER 469 N -0.87 6.75 0.29 6.41 0.15 -1.09 -4.87 113.70 120.46 1ffv s SER 469 Ca 0.54 2.08 0.20 0.00 0.70 0.00 0.00 55.95 59.47 1ffv s SER 469 Cb 0.41 -2.53 1.05 0.00 -1.71 0.00 0.00 66.02 63.24 1ffv s SER 469 CO 0.16 -0.88 1.60 -0.81 1.20 0.00 0.00 173.24 174.51 1ffv n PRO 470 N 6.99 0.13 -4.10 5.44 -0.04 -1.26 -4.74 135.00 137.41 1ffv n PRO 470 Ca 0.16 0.61 -0.14 0.00 -0.04 0.00 0.00 63.50 64.09 1ffv n PRO 470 Cb 0.43 -1.91 -0.11 0.00 -0.04 0.00 0.00 33.50 31.87 1ffv n PRO 470 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ffv s THR 471 N -3.48 0.71 -0.09 0.52 -4.23 -1.26 -1.82 115.64 105.99 1ffv s THR 471 Ca -0.02 -1.23 -0.10 0.00 -1.18 0.00 0.00 61.69 59.16 1ffv s THR 471 Cb 0.06 -0.84 -0.05 0.00 1.34 0.00 0.00 72.50 73.01 1ffv s THR 471 CO 0.19 -0.39 0.23 -0.76 -0.54 0.00 0.00 174.62 173.35 1ffv s LEU 472 N -1.78 4.40 -0.15 4.79 1.43 0.05 -4.88 118.68 122.53 1ffv s LEU 472 Ca -0.06 0.61 -0.03 0.00 -1.03 0.00 0.00 54.13 53.62 1ffv s LEU 472 Cb -0.08 -2.25 -0.03 0.00 0.03 0.00 0.00 46.19 43.86 1ffv s LEU 472 CO 0.00 0.35 -0.05 -0.32 0.23 0.00 0.00 176.35 176.57 1ffv s MET 473 N -0.88 3.64 -0.03 1.70 -2.45 -1.26 -0.40 119.30 119.62 1ffv s MET 473 Ca 0.17 -0.54 0.04 0.00 -1.25 0.00 0.00 55.69 54.11 1ffv s MET 473 Cb -0.13 -2.88 -0.00 0.00 1.25 0.00 0.00 34.83 33.07 1ffv s MET 473 CO 0.07 0.24 -0.13 0.20 1.05 0.00 0.00 175.02 176.45 1ffv s GLY 474 N 0.35 0.70 -0.19 2.11 0.00 -0.74 -4.16 107.32 105.39 1ffv s GLY 474 Ca -0.05 -0.52 -0.01 0.00 0.00 0.00 0.00 44.72 44.14 1ffv s GLY 474 CO 0.03 -0.28 -0.14 -0.42 0.00 0.00 0.00 173.10 172.29 1ffv s ILE 475 N 0.00 2.63 -0.09 0.90 1.01 -1.26 -1.05 121.20 123.36 1ffv s ILE 475 Ca -0.01 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.89 1ffv s ILE 475 Cb -0.09 -2.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 1ffv s ILE 475 CO 0.01 0.50 -0.09 -0.83 0.00 0.00 0.00 174.94 174.52 1ffv s GLY 476 N 1.23 1.63 -0.04 6.18 0.00 0.13 -4.36 107.32 112.09 1ffv s GLY 476 Ca 0.03 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.85 1ffv s GLY 476 CO -0.07 -0.50 -0.03 -2.27 0.00 0.00 0.00 173.10 170.24 1ffv s LEU 477 N -0.38 1.23 -0.06 0.66 2.96 -1.26 -0.75 118.68 121.08 1ffv s LEU 477 Ca 0.05 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1ffv s LEU 477 Cb -0.12 -0.37 0.02 0.00 0.50 0.00 0.00 46.19 46.21 1ffv s LEU 477 CO 0.02 -0.08 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.19 1ffv s VAL 478 N 1.02 0.92 -0.32 1.68 1.01 0.24 -4.92 120.40 120.04 1ffv s VAL 478 Ca -0.10 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1ffv s VAL 478 Cb -0.14 -0.87 0.09 0.00 0.00 0.00 0.00 36.38 35.47 1ffv s VAL 478 CO -0.01 0.31 0.04 0.42 0.00 0.00 0.00 175.10 175.86 1ffv s THR 479 N 0.75 1.84 0.31 3.92 -4.23 -1.26 -0.23 115.64 116.74 1ffv s THR 479 Ca -0.13 -1.94 0.10 0.00 -1.18 0.00 0.00 61.69 58.53 1ffv s THR 479 Cb -0.15 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.33 1ffv s THR 479 CO 0.02 -0.53 -0.07 0.72 -0.54 0.00 0.00 174.62 174.23 1ffv s PHE 480 N 1.15 2.48 -0.09 3.99 -0.71 -0.73 -4.55 117.98 119.53 1ffv s PHE 480 Ca 0.08 -0.39 0.01 0.00 -1.04 0.00 0.00 56.93 55.59 1ffv s PHE 480 Cb -0.19 -1.29 0.02 0.00 -1.21 0.00 0.00 43.02 40.35 1ffv s PHE 480 CO -0.12 0.58 -0.09 0.99 -1.34 0.00 0.00 175.22 175.24 1ffv s THR 481 N -2.50 1.04 0.35 -4.49 2.01 -1.26 -1.82 115.64 108.96 1ffv s THR 481 Ca 0.33 -0.36 0.04 0.00 0.31 0.00 0.00 61.69 62.01 1ffv s THR 481 Cb -0.02 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.48 1ffv s THR 481 CO 0.18 0.35 0.51 -1.61 -0.69 0.00 0.00 174.62 173.36 1ffv s GLU 482 N 1.17 3.18 -0.32 4.92 0.41 0.40 -4.88 118.70 123.57 1ffv s GLU 482 Ca -0.05 -0.80 -0.00 0.00 -0.41 0.00 0.00 54.97 53.70 1ffv s GLU 482 Cb -0.14 -2.76 0.10 0.00 -1.78 0.00 0.00 34.13 29.55 1ffv s GLU 482 CO -0.02 0.04 0.11 0.08 -0.49 0.00 0.00 175.26 174.98 1ffv s VAL 483 N -2.25 0.93 0.05 2.63 1.01 -1.26 -3.84 120.40 117.68 1ffv s VAL 483 Ca 0.44 -1.52 0.06 0.00 0.00 0.00 0.00 61.98 60.96 1ffv s VAL 483 Cb -0.10 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 1ffv s VAL 483 CO 0.33 -0.70 -0.17 0.68 0.00 0.00 0.00 175.10 175.23 1ffv s VAL 484 N 1.48 1.39 0.00 2.92 -7.23 -0.22 -4.87 120.40 113.88 1ffv s VAL 484 Ca 0.11 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 59.12 1ffv s VAL 484 Cb -0.18 -1.24 0.00 0.00 0.56 0.00 0.00 36.38 35.52 1ffv s VAL 484 CO -0.22 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 1ffv n GLY 485 N 1.75 0.98 3.44 2.32 0.00 -1.22 -0.41 105.19 112.06 1ffv n GLY 485 Ca -0.18 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.27 1ffv n GLY 485 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffv n ALA 486 N 0.00 0.36 0.00 4.61 0.00 -1.26 -4.66 120.51 119.56 1ffv n ALA 486 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1ffv n ALA 486 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.18 1ffv n ALA 486 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffv n GLY 487 N 6.29 -0.60 3.09 0.00 0.00 -1.25 -4.75 105.19 107.98 1ffv n GLY 487 Ca 0.43 0.07 -0.47 0.00 0.00 0.00 0.00 46.02 46.05 1ffv n GLY 487 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ffv n PRO 488 N -2.51 0.00 -0.02 1.61 -0.02 -1.21 -3.45 135.00 129.40 1ffv n PRO 488 Ca 0.00 0.00 0.19 0.00 -2.02 0.00 0.00 63.50 61.67 1ffv n PRO 488 Cb 0.00 -1.38 0.65 0.00 -0.02 0.00 0.00 33.50 32.75 1ffv n PRO 488 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1ffv h SER 489 N 9.57 0.08 0.25 2.55 4.64 -1.83 0.99 113.55 129.80 1ffv h SER 489 Ca -0.07 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.20 1ffv h SER 489 Cb 1.25 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1ffv h SER 489 CO 1.13 0.04 -0.24 0.07 -0.87 0.00 0.00 176.83 176.96 1ffv h LYS 490 N 0.08 0.00 0.00 4.77 2.10 -1.97 -3.31 116.57 118.25 1ffv h LYS 490 Ca 0.26 0.00 -0.37 0.00 -2.00 0.00 0.00 60.65 58.54 1ffv h LYS 490 Cb 0.93 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.20 1ffv h LYS 490 CO -0.02 0.24 -2.32 -0.12 -2.00 0.00 0.00 179.45 175.23 1ffv n MET 491 N -4.22 0.55 -4.70 0.07 0.00 -0.01 -5.00 117.12 103.81 1ffv n MET 491 Ca -0.02 0.17 -0.33 0.00 0.00 0.00 0.00 57.70 57.52 1ffv n MET 491 Cb 0.30 -1.42 -0.14 0.00 0.00 0.00 0.00 33.22 31.97 1ffv n MET 491 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ffv s ASP 493 N 0.24 -0.36 -0.33 0.00 1.47 -1.26 -1.65 116.67 114.77 1ffv s ASP 493 Ca -0.07 0.45 -0.06 0.00 1.18 0.00 0.00 52.55 54.04 1ffv s ASP 493 Cb -0.15 0.53 0.04 0.00 -0.34 0.00 0.00 42.92 43.00 1ffv s ASP 493 CO 0.05 -0.39 0.10 -0.63 0.68 0.00 0.00 175.17 174.97 1ffv s ILE 494 N -0.84 3.77 -1.36 2.11 -1.09 -0.05 -1.14 121.20 122.59 1ffv s ILE 494 Ca -0.09 -1.09 -0.08 0.00 -2.23 0.00 0.00 60.65 57.16 1ffv s ILE 494 Cb -0.04 -3.11 0.06 0.00 -1.58 0.00 0.00 42.46 37.79 1ffv s ILE 494 CO 0.04 -0.14 0.54 0.18 -1.23 0.00 0.00 174.94 174.33 1ffv n LEU 495 N 4.81 -1.88 0.00 2.97 4.77 -1.26 -1.04 117.00 125.37 1ffv n LEU 495 Ca -0.13 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 1ffv n LEU 495 Cb 0.45 -2.36 0.00 0.00 -2.33 0.00 0.00 43.42 39.18 1ffv n LEU 495 CO 0.31 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1ffv n GLY 496 N -1.28 2.89 3.64 -0.72 0.00 -1.26 -5.04 105.19 103.41 1ffv n GLY 496 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1ffv n GLY 496 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ffv s VAL 497 N -2.69 4.86 0.34 1.61 1.01 -0.20 -4.99 120.40 120.33 1ffv s VAL 497 Ca 0.00 1.45 -0.27 0.00 0.00 0.00 0.00 61.98 63.16 1ffv s VAL 497 Cb 0.00 -4.09 -0.12 0.00 0.00 0.00 0.00 36.38 32.17 1ffv s VAL 497 CO 0.00 -0.08 1.08 0.61 0.00 0.00 0.00 175.10 176.71 1ffv n GLY 498 N 3.87 -0.03 2.28 4.51 0.00 -1.26 -0.87 105.19 113.69 1ffv n GLY 498 Ca 0.04 0.26 -0.31 0.00 0.00 0.00 0.00 46.02 46.02 1ffv n GLY 498 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ffv n MET 499 N 0.50 3.28 -0.96 1.61 0.00 -0.66 -4.81 117.12 116.08 1ffv n MET 499 Ca 0.08 -2.12 -0.05 0.00 0.00 0.00 0.00 57.70 55.61 1ffv n MET 499 Cb 0.35 -2.49 0.03 0.00 0.00 0.00 0.00 33.22 31.12 1ffv n MET 499 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 175.97 177.94 1ffv n PHE 500 N 2.67 -3.39 -3.92 2.03 1.16 -1.26 -3.88 117.46 110.88 1ffv n PHE 500 Ca 0.63 -0.37 -0.09 0.00 -1.87 0.00 0.00 57.45 55.75 1ffv n PHE 500 Cb 0.45 -0.17 -0.02 0.00 -1.61 0.00 0.00 39.48 38.13 1ffv n PHE 500 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1ffv s ASP 501 N -1.93 -0.03 0.26 5.98 -1.08 -0.91 -3.87 116.67 115.10 1ffv s ASP 501 Ca 0.15 -0.92 -0.06 0.00 -0.52 0.00 0.00 52.55 51.20 1ffv s ASP 501 Cb -0.01 0.71 -0.02 0.00 -1.46 0.00 0.00 42.92 42.14 1ffv s ASP 501 CO 0.10 -1.36 0.36 -0.94 0.52 0.00 0.00 175.17 173.85 1ffv s SER 502 N -3.02 0.29 -0.19 -0.34 1.04 -1.26 -0.03 113.70 110.19 1ffv s SER 502 Ca 0.18 -1.24 -0.21 0.00 0.48 0.00 0.00 55.95 55.16 1ffv s SER 502 Cb -0.04 0.54 0.06 0.00 0.10 0.00 0.00 66.02 66.68 1ffv s SER 502 CO 0.10 -1.08 0.57 0.00 0.98 0.00 0.00 173.24 173.81 1ffv s GLU 504 N 0.09 1.29 -0.05 0.00 2.12 -0.10 -1.06 118.70 121.00 1ffv s GLU 504 Ca -0.02 -0.22 0.06 0.00 0.36 0.00 0.00 54.97 55.15 1ffv s GLU 504 Cb -0.04 -1.28 -0.01 0.00 0.26 0.00 0.00 34.13 33.07 1ffv s GLU 504 CO 0.02 -0.14 -0.24 0.42 -0.54 0.00 0.00 175.26 174.78 1ffv s ILE 505 N 1.24 1.97 -0.10 -3.70 1.01 0.07 -1.41 121.20 120.28 1ffv s ILE 505 Ca -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.58 1ffv s ILE 505 Cb -0.14 -1.67 0.02 0.00 0.01 0.00 0.00 42.46 40.68 1ffv s ILE 505 CO -0.02 0.55 -0.09 -0.60 0.00 0.00 0.00 174.94 174.77 1ffv s ARG 506 N -0.17 1.61 -0.16 2.79 3.52 -0.51 -1.35 118.95 124.69 1ffv s ARG 506 Ca -0.03 -0.32 -0.16 0.00 -0.13 0.00 0.00 55.73 55.09 1ffv s ARG 506 Cb -0.13 -1.55 -0.04 0.00 -1.56 0.00 0.00 34.95 31.66 1ffv s ARG 506 CO 0.03 -0.18 0.41 0.42 -0.81 0.00 0.00 175.30 175.18 1ffv s ILE 507 N 1.37 5.21 0.58 4.11 -1.09 -0.38 -1.68 121.20 129.33 1ffv s ILE 507 Ca -0.01 0.78 -0.10 0.00 -2.23 0.00 0.00 60.65 59.09 1ffv s ILE 507 Cb -0.14 -3.75 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 1ffv s ILE 507 CO -0.05 0.30 0.97 -1.00 -1.23 0.00 0.00 174.94 173.93 1ffv s HIS 508 N 0.92 3.61 0.48 3.97 3.76 -0.15 -4.53 115.29 123.34 1ffv s HIS 508 Ca 0.21 1.19 0.29 0.00 -0.15 0.00 0.00 55.06 56.59 1ffv s HIS 508 Cb -0.15 -2.62 1.36 0.00 1.11 0.00 0.00 32.58 32.28 1ffv s HIS 508 CO 0.08 -0.58 1.79 -1.35 -0.85 0.00 0.00 174.74 173.83 1ffv h PRO 509 N -0.14 0.16 -0.02 8.40 0.11 -1.88 -0.82 132.00 137.82 1ffv h PRO 509 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ffv h PRO 509 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ffv h PRO 509 CO 0.62 0.11 -0.00 0.25 -0.21 0.00 0.00 178.00 178.76 1ffv n THR 510 N -4.39 0.00 0.00 -1.15 -2.24 -1.26 -3.00 114.28 102.24 1ffv n THR 510 Ca 0.25 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1ffv n THR 510 Cb 1.07 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.84 1ffv n THR 510 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffv n GLY 511 N 1.18 2.46 2.24 3.38 0.00 -0.31 -4.91 105.19 109.23 1ffv n GLY 511 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 1ffv n GLY 511 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ffv n SER 512 N 0.00 0.07 -3.60 1.61 3.41 -1.26 -4.77 113.62 109.08 1ffv n SER 512 Ca 0.00 -1.28 -0.09 0.00 -0.26 0.00 0.00 58.87 57.24 1ffv n SER 512 Cb 0.00 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.34 1ffv n SER 512 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ffv s ALA 513 N -3.97 -1.57 -0.03 7.33 0.00 -1.05 -0.98 121.76 121.50 1ffv s ALA 513 Ca 0.44 0.35 0.07 0.00 0.00 0.00 0.00 51.96 52.82 1ffv s ALA 513 Cb -0.01 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 23.83 1ffv s ALA 513 CO 0.31 -0.86 -0.25 -1.50 0.00 0.00 0.00 175.76 173.46 1ffv s ILE 514 N -3.58 1.96 -0.02 0.00 2.07 -0.68 -1.30 121.20 119.66 1ffv s ILE 514 Ca 0.06 -1.05 0.01 0.00 -1.41 0.00 0.00 60.65 58.25 1ffv s ILE 514 Cb -0.02 -1.63 0.01 0.00 0.13 0.00 0.00 42.46 40.95 1ffv s ILE 514 CO -0.05 0.55 -0.02 0.00 -1.91 0.00 0.00 174.94 173.52 1ffv s ALA 515 N -0.51 0.32 -0.03 1.50 0.00 0.49 -1.42 121.76 122.11 1ffv s ALA 515 Ca 0.07 0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.08 1ffv s ALA 515 Cb -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.80 1ffv s ALA 515 CO -0.00 -0.01 -0.10 1.03 0.00 0.00 0.00 175.76 176.68 1ffv s ARG 516 N 0.54 1.07 0.32 0.00 0.52 -0.50 -1.15 118.95 119.75 1ffv s ARG 516 Ca -0.05 -0.33 0.09 0.00 -0.52 0.00 0.00 55.73 54.91 1ffv s ARG 516 Cb -0.08 -0.98 -0.06 0.00 0.52 0.00 0.00 34.95 34.34 1ffv s ARG 516 CO -0.01 0.12 -0.10 -1.64 0.02 0.00 0.00 175.30 173.69 1ffv s MET 517 N 0.22 1.73 0.00 3.54 -1.94 -1.14 -0.92 119.30 120.79 1ffv s MET 517 Ca -0.04 -1.88 0.12 0.00 -1.71 0.00 0.00 55.69 52.18 1ffv s MET 517 Cb -0.09 -1.57 0.48 0.00 2.01 0.00 0.00 34.83 35.66 1ffv s MET 517 CO 0.01 0.14 1.34 0.41 -0.01 0.00 0.00 175.02 176.91 1ffv n GLY 518 N -0.72 -0.15 2.58 -0.03 0.00 -0.94 -4.51 105.19 101.41 1ffv n GLY 518 Ca -0.05 -0.25 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 1ffv n GLY 518 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ffv n THR 519 N -0.02 0.00 -3.27 2.61 -2.24 -1.26 -2.09 114.28 108.01 1ffv n THR 519 Ca 0.10 -1.11 0.00 0.00 -2.27 0.00 0.00 64.05 60.78 1ffv n THR 519 Cb 0.19 -0.95 -0.03 0.00 -2.10 0.00 0.00 70.33 67.43 1ffv n THR 519 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1ffv s ILE 520 N -1.80 -0.91 0.56 2.28 1.10 -1.26 -3.90 121.20 117.27 1ffv s ILE 520 Ca 0.43 -0.01 -0.19 0.00 -0.51 0.00 0.00 60.65 60.37 1ffv s ILE 520 Cb -0.03 -0.95 -0.05 0.00 0.15 0.00 0.00 42.46 41.58 1ffv s ILE 520 CO 0.28 -0.02 1.13 0.28 -2.11 0.00 0.00 174.94 174.50 1ffv s THR 521 N 2.79 3.14 -0.08 4.00 -1.32 -1.26 -4.34 115.64 118.58 1ffv s THR 521 Ca 0.15 0.69 0.16 0.00 -1.21 0.00 0.00 61.69 61.49 1ffv s THR 521 Cb -0.15 -3.27 0.33 0.00 -1.51 0.00 0.00 72.50 67.91 1ffv s THR 521 CO -0.19 -0.17 1.15 0.00 -2.21 0.00 0.00 174.62 173.19 1ffv n GLN 522 N -1.42 0.62 0.00 7.08 6.02 -1.26 -4.58 117.38 123.83 1ffv n GLN 522 Ca 0.12 -2.27 0.00 0.00 -0.01 0.00 0.00 57.00 54.84 1ffv n GLN 522 Cb 0.51 -0.74 0.00 0.00 1.02 0.00 0.00 30.24 31.03 1ffv n GLN 522 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ffv n GLY 523 N -0.30 1.27 0.00 1.08 0.00 -1.26 -3.01 105.19 102.98 1ffv n GLY 523 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 1ffv n GLY 523 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffv n GLN 524 N 0.00 0.80 -0.80 1.61 0.00 -1.26 -4.90 117.38 112.83 1ffv n GLN 524 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 1ffv n GLN 524 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 30.24 29.08 1ffv n GLN 524 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ffv n GLY 525 N 0.39 0.51 0.36 2.61 0.00 -1.26 -4.97 105.19 102.83 1ffv n GLY 525 Ca 0.06 -0.81 0.13 0.00 0.00 0.00 0.00 46.02 45.40 1ffv n GLY 525 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1ffv h HIS 526 N 0.00 1.06 0.00 1.61 3.86 -1.98 0.32 115.15 120.02 1ffv h HIS 526 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1ffv h HIS 526 Cb 0.00 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.15 1ffv h HIS 526 CO 0.00 0.23 0.00 1.96 0.86 0.00 0.00 177.93 180.98 1ffv h GLN 527 N 0.75 0.00 0.00 2.45 4.20 -1.94 -0.56 115.11 120.01 1ffv h GLN 527 Ca 0.58 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 59.23 1ffv h GLN 527 Cb 0.92 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1ffv h GLN 527 CO -0.38 0.00 -1.15 2.41 -0.67 0.00 0.00 178.83 179.04 1ffv n THR 528 N -2.55 1.47 -0.10 -0.54 -1.04 -0.01 -4.39 114.28 107.11 1ffv n THR 528 Ca -0.01 0.08 -0.07 0.00 -2.04 0.00 0.00 64.05 62.01 1ffv n THR 528 Cb 0.08 -2.23 0.01 0.00 -1.82 0.00 0.00 70.33 66.37 1ffv n THR 528 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1ffv h THR 529 N -0.92 0.98 -0.97 12.58 1.35 -1.18 -1.93 112.91 122.82 1ffv h THR 529 Ca -0.10 -0.12 0.09 0.00 -0.55 0.00 0.00 66.41 65.73 1ffv h THR 529 Cb 1.02 0.60 -0.07 0.00 -1.73 0.00 0.00 68.15 67.96 1ffv h THR 529 CO -0.06 0.07 0.62 1.88 -0.25 0.00 0.00 175.52 177.78 1ffv h TYR 530 N 0.36 1.11 -0.29 4.73 -1.99 -1.34 0.66 116.97 120.20 1ffv h TYR 530 Ca 0.15 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.83 1ffv h TYR 530 Cb 0.06 -0.36 -0.02 0.00 2.00 0.00 0.00 36.73 38.41 1ffv h TYR 530 CO -0.10 0.51 -0.13 0.00 -0.00 0.00 0.00 178.16 178.44 1ffv h ALA 531 N 1.51 1.24 -0.41 3.88 0.00 -1.54 -2.73 119.26 121.21 1ffv h ALA 531 Ca 0.45 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1ffv h ALA 531 Cb 0.34 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1ffv h ALA 531 CO -0.20 0.50 -0.24 1.96 0.00 0.00 0.00 179.25 181.26 1ffv h GLN 532 N 0.46 0.85 -0.17 0.00 4.20 -0.17 0.25 115.11 120.52 1ffv h GLN 532 Ca 0.08 -0.36 -0.00 0.00 0.06 0.00 0.00 58.65 58.43 1ffv h GLN 532 Cb 0.50 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1ffv h GLN 532 CO 0.03 1.00 0.09 0.82 -0.67 0.00 0.00 178.83 180.10 1ffv h ILE 533 N 0.73 1.10 -0.44 2.54 2.04 -1.07 -2.79 117.51 119.62 1ffv h ILE 533 Ca 0.09 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.60 1ffv h ILE 533 Cb 0.78 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1ffv h ILE 533 CO 0.06 0.09 -0.11 0.40 0.00 0.00 0.00 178.15 178.60 1ffv h ILE 534 N 0.17 1.26 -0.43 -0.67 2.04 -1.37 -2.57 117.51 115.94 1ffv h ILE 534 Ca 0.06 -1.17 0.08 0.00 1.00 0.00 0.00 64.86 64.83 1ffv h ILE 534 Cb 0.07 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.11 1ffv h ILE 534 CO -0.01 0.40 0.02 0.00 0.00 0.00 0.00 178.15 178.56 1ffv h ALA 535 N 1.16 0.41 -0.44 1.87 0.00 -0.69 -0.37 119.26 121.20 1ffv h ALA 535 Ca 0.12 0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 1ffv h ALA 535 Cb 0.59 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1ffv h ALA 535 CO 0.04 -0.37 -0.26 1.15 0.00 0.00 0.00 179.25 179.80 1ffv h THR 536 N 0.13 1.27 -0.25 0.00 2.02 -1.40 0.86 112.91 115.54 1ffv h THR 536 Ca 0.21 -1.43 -0.09 0.00 0.77 0.00 0.00 66.41 65.87 1ffv h THR 536 Cb 0.30 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1ffv h THR 536 CO -0.33 0.49 -0.22 -0.33 0.37 0.00 0.00 175.52 175.49 1ffv h GLU 537 N 0.80 0.46 -0.01 6.66 4.39 -1.02 -3.34 114.58 122.52 1ffv h GLU 537 Ca 0.09 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1ffv h GLU 537 Cb 0.85 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1ffv h GLU 537 CO 0.07 0.66 -0.00 1.28 -1.16 0.00 0.00 179.01 179.86 1ffv n LEU 538 N -4.14 1.33 -2.75 1.33 4.77 -0.19 -4.90 117.00 112.46 1ffv n LEU 538 Ca -0.00 -1.00 -0.18 0.00 -0.03 0.00 0.00 56.01 54.81 1ffv n LEU 538 Cb 0.38 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.53 1ffv n LEU 538 CO 0.41 0.29 0.17 0.61 -1.33 0.00 0.00 177.39 177.55 1ffv n GLY 539 N 0.24 -0.15 3.03 -0.72 0.00 0.28 -4.79 105.19 103.08 1ffv n GLY 539 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1ffv n GLY 539 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ffv s ILE 540 N -3.22 1.37 0.27 -0.61 1.01 -1.15 -4.76 121.20 114.11 1ffv s ILE 540 Ca 0.42 -0.57 -0.29 0.00 0.00 0.00 0.00 60.65 60.21 1ffv s ILE 540 Cb -0.19 -1.27 -0.14 0.00 0.01 0.00 0.00 42.46 40.87 1ffv s ILE 540 CO 0.52 0.42 1.17 -0.81 0.00 0.00 0.00 174.94 176.24 1ffv n PRO 541 N 4.26 1.61 0.30 2.79 -0.04 -1.26 -4.15 135.00 138.50 1ffv n PRO 541 Ca -0.19 0.57 0.16 0.00 -0.04 0.00 0.00 63.50 64.00 1ffv n PRO 541 Cb 0.51 -2.06 0.94 0.00 -0.04 0.00 0.00 33.50 32.85 1ffv n PRO 541 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ffv h SER 542 N 2.74 0.00 0.06 3.54 4.64 -1.47 -2.57 113.55 120.49 1ffv h SER 542 Ca -0.42 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1ffv h SER 542 Cb 1.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1ffv h SER 542 CO 0.65 0.01 -0.05 -0.08 -0.87 0.00 0.00 176.83 176.49 1ffv h GLU 543 N 0.00 0.00 -0.46 4.77 4.57 -1.88 -2.44 114.58 119.14 1ffv h GLU 543 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1ffv h GLU 543 Cb 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1ffv h GLU 543 CO 0.00 0.05 0.00 1.33 -1.18 0.00 0.00 179.01 179.21 1ffv n VAL 544 N -4.39 1.40 -3.48 0.32 0.24 -0.97 -4.79 118.33 106.65 1ffv n VAL 544 Ca -0.03 -1.19 -0.42 0.00 -2.04 0.00 0.00 64.34 60.66 1ffv n VAL 544 Cb 0.14 0.29 -0.07 0.00 -1.47 0.00 0.00 33.84 32.72 1ffv n VAL 544 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1ffv s ILE 545 N -1.49 4.51 -0.24 1.34 1.01 -0.92 -2.51 121.20 122.89 1ffv s ILE 545 Ca 0.36 -1.68 -0.25 0.00 0.00 0.00 0.00 60.65 59.08 1ffv s ILE 545 Cb 0.22 -3.94 -0.00 0.00 0.01 0.00 0.00 42.46 38.75 1ffv s ILE 545 CO 0.19 -0.79 0.84 -1.10 0.00 0.00 0.00 174.94 174.09 1ffv s GLN 546 N 1.44 4.18 -0.03 2.79 -1.52 -0.42 -4.78 119.66 121.32 1ffv s GLN 546 Ca 0.05 0.96 0.01 0.00 -1.95 0.00 0.00 55.36 54.43 1ffv s GLN 546 Cb -0.27 -3.65 -0.03 0.00 -0.22 0.00 0.00 33.01 28.84 1ffv s GLN 546 CO 0.01 -0.54 -0.04 0.14 -0.25 0.00 0.00 175.29 174.61 1ffv s VAL 547 N 2.88 3.91 0.04 1.09 -7.23 -1.26 -0.38 120.40 119.46 1ffv s VAL 547 Ca 0.35 -0.58 0.01 0.00 -1.81 0.00 0.00 61.98 59.95 1ffv s VAL 547 Cb -0.15 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 1ffv s VAL 547 CO 0.07 0.47 -0.05 -1.61 -0.31 0.00 0.00 175.10 173.68 1ffv s GLU 548 N -1.24 0.49 0.24 4.82 2.02 -0.30 -4.85 118.70 119.87 1ffv s GLU 548 Ca 0.16 -0.85 -0.06 0.00 0.02 0.00 0.00 54.97 54.24 1ffv s GLU 548 Cb -0.11 -0.01 -0.02 0.00 0.10 0.00 0.00 34.13 34.09 1ffv s GLU 548 CO 0.06 -0.03 0.32 -1.21 0.02 0.00 0.00 175.26 174.42 1ffv s GLU 549 N -2.26 1.45 0.00 1.61 2.02 -1.26 -2.90 118.70 117.36 1ffv s GLU 549 Ca -0.07 -1.49 0.00 0.00 0.02 0.00 0.00 54.97 53.43 1ffv s GLU 549 Cb -0.05 0.38 0.00 0.00 0.10 0.00 0.00 34.13 34.56 1ffv s GLU 549 CO -0.03 -0.55 0.00 0.41 0.02 0.00 0.00 175.26 175.11 1ffv n GLY 550 N -0.36 3.00 3.36 -1.39 0.00 -1.25 -4.88 105.19 103.67 1ffv n GLY 550 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1ffv n GLY 550 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ffv s ASP 551 N -1.29 6.00 0.43 1.61 -1.08 -1.26 -0.62 116.67 120.46 1ffv s ASP 551 Ca 0.00 -1.34 0.26 0.00 -0.52 0.00 0.00 52.55 50.95 1ffv s ASP 551 Cb 0.00 -2.13 1.44 0.00 -1.46 0.00 0.00 42.92 40.77 1ffv s ASP 551 CO 0.00 -0.60 1.79 0.71 0.52 0.00 0.00 175.17 177.60 1ffv h THR 552 N 5.84 0.00 0.00 1.71 1.35 -1.58 0.35 112.91 120.58 1ffv h THR 552 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1ffv h THR 552 Cb 1.10 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1ffv h THR 552 CO 0.83 0.00 -0.52 -1.20 -0.25 0.00 0.00 175.52 174.38 1ffv n SER 553 N -2.47 0.61 0.00 5.36 7.64 -1.26 -4.52 113.62 118.99 1ffv n SER 553 Ca -0.02 0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1ffv n SER 553 Cb 0.11 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 1ffv n SER 553 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ffv n THR 554 N -1.94 0.00 -2.71 0.44 -2.24 -0.07 -5.07 114.28 102.69 1ffv n THR 554 Ca 0.04 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.47 1ffv n THR 554 Cb 0.41 -0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 68.08 1ffv n THR 554 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffv s ALA 555 N -1.96 3.10 0.64 6.98 0.00 -0.13 -5.02 121.76 125.38 1ffv s ALA 555 Ca 0.00 0.54 -0.17 0.00 0.00 0.00 0.00 51.96 52.34 1ffv s ALA 555 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 1ffv s ALA 555 CO 0.00 0.02 1.16 -1.25 0.00 0.00 0.00 175.76 175.69 1ffv s PRO 556 N -2.58 2.77 0.24 0.00 0.04 -1.26 -4.80 135.00 129.41 1ffv s PRO 556 Ca 0.57 1.62 -0.31 0.00 0.04 0.00 0.00 61.00 62.92 1ffv s PRO 556 Cb -0.17 -1.93 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 1ffv s PRO 556 CO 0.22 -1.32 1.65 -0.47 0.04 0.00 0.00 177.00 177.12 1ffv s TYR 557 N -1.98 2.85 0.33 0.56 6.14 -1.26 -3.62 117.35 120.37 1ffv s TYR 557 Ca 0.72 0.57 -0.01 0.00 0.64 0.00 0.00 57.07 59.00 1ffv s TYR 557 Cb -0.25 -4.09 -0.01 0.00 0.42 0.00 0.00 41.96 38.03 1ffv s TYR 557 CO 0.38 -3.89 0.41 0.20 0.64 0.00 0.00 175.55 173.29 1ffv s GLY 558 N 0.86 1.64 0.00 8.97 0.00 -1.25 -4.15 107.32 113.39 1ffv s GLY 558 Ca 0.69 -1.63 0.20 0.00 0.00 0.00 0.00 44.72 43.98 1ffv s GLY 558 CO 0.39 -1.11 1.27 1.04 0.00 0.00 0.00 173.10 174.68 1ffv n LEU 559 N -0.56 3.07 0.00 0.66 7.99 -1.21 -4.48 117.00 122.47 1ffv n LEU 559 Ca 0.02 -1.34 0.00 0.00 -0.01 0.00 0.00 56.01 54.68 1ffv n LEU 559 Cb 0.62 -0.15 0.00 0.00 -0.11 0.00 0.00 43.42 43.78 1ffv n LEU 559 CO 0.30 0.63 0.00 0.61 -1.51 0.00 0.00 177.39 177.42 1ffv n GLY 560 N 1.24 -2.60 3.18 -0.72 0.00 -0.89 -4.69 105.19 100.72 1ffv n GLY 560 Ca 0.15 -1.77 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 1ffv n GLY 560 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ffv s THR 561 N -0.50 2.92 -0.01 2.61 2.01 -0.50 -4.64 115.64 117.53 1ffv s THR 561 Ca 0.00 -1.21 -0.30 0.00 0.31 0.00 0.00 61.69 60.49 1ffv s THR 561 Cb 0.00 -2.58 0.11 0.00 0.01 0.00 0.00 72.50 70.04 1ffv s THR 561 CO 0.00 0.04 1.15 -0.72 -0.69 0.00 0.00 174.62 174.40 1ffv s TYR 562 N 1.28 -0.12 -1.74 4.92 -0.85 -1.26 -4.88 117.35 114.71 1ffv s TYR 562 Ca -0.03 -0.02 0.00 0.00 -0.52 0.00 0.00 57.07 56.50 1ffv s TYR 562 Cb -0.18 0.56 0.00 0.00 0.38 0.00 0.00 41.96 42.72 1ffv s TYR 562 CO -0.03 -0.42 0.00 0.41 -1.52 0.00 0.00 175.55 173.99 1ffv n GLY 563 N -0.37 0.51 3.82 5.49 0.00 -1.26 -1.94 105.19 111.43 1ffv n GLY 563 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 1ffv n GLY 563 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ffv n SER 564 N -1.57 -3.50 0.14 1.61 7.64 -1.26 -3.37 113.62 113.32 1ffv n SER 564 Ca -0.20 -0.71 0.12 0.00 1.01 0.00 0.00 58.87 59.09 1ffv n SER 564 Cb 0.64 -2.88 0.22 0.00 -1.01 0.00 0.00 64.21 61.17 1ffv n SER 564 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1ffv h ARG 565 N -1.27 0.00 0.17 1.43 0.11 -1.75 -3.37 114.38 109.71 1ffv h ARG 565 Ca -0.51 0.00 0.01 0.00 0.10 0.00 0.00 59.98 59.59 1ffv h ARG 565 Cb 1.33 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.37 1ffv h ARG 565 CO 0.65 0.00 -0.44 0.77 0.10 0.00 0.00 179.97 181.06 1ffv h SER 566 N 0.00 -1.27 -0.23 0.08 0.02 -1.86 0.01 113.55 110.30 1ffv h SER 566 Ca 0.00 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1ffv h SER 566 Cb 0.88 0.47 -0.01 0.00 0.14 0.00 0.00 62.40 63.88 1ffv h SER 566 CO 0.00 -0.52 0.10 0.74 -1.14 0.00 0.00 176.83 176.02 1ffv h THR 567 N -0.70 1.15 0.13 -2.27 2.02 -1.93 0.48 112.91 111.78 1ffv h THR 567 Ca 0.01 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 1ffv h THR 567 Cb 0.71 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1ffv h THR 567 CO -0.22 0.15 -0.06 -0.65 0.37 0.00 0.00 175.52 175.11 1ffv h PRO 568 N 0.23 -0.16 0.00 6.66 0.11 -1.74 -2.25 132.00 134.84 1ffv h PRO 568 Ca 0.08 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1ffv h PRO 568 Cb 0.14 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.28 1ffv h PRO 568 CO -0.01 0.02 -0.35 0.28 -0.21 0.00 0.00 178.00 177.74 1ffv h VAL 569 N -0.32 0.00 -0.61 3.15 2.07 -1.06 -3.29 116.25 116.19 1ffv h VAL 569 Ca -0.02 -0.98 -0.10 0.00 0.82 0.00 0.00 66.70 66.43 1ffv h VAL 569 Cb 0.26 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1ffv h VAL 569 CO 0.03 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.63 1ffv h ALA 570 N -1.02 0.86 -0.72 1.67 0.00 -1.25 -1.82 119.26 116.98 1ffv h ALA 570 Ca 0.00 -0.31 0.11 0.00 0.00 0.00 0.00 54.91 54.71 1ffv h ALA 570 Cb 0.35 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1ffv h ALA 570 CO 0.00 0.67 0.47 0.78 0.00 0.00 0.00 179.25 181.17 1ffv h GLY 571 N 1.00 0.79 0.74 0.00 0.00 0.53 0.14 103.07 106.26 1ffv h GLY 571 Ca 0.17 -0.22 -0.11 0.00 0.00 0.00 0.00 47.33 47.18 1ffv h GLY 571 CO 0.03 0.11 -0.36 0.00 0.00 0.00 0.00 176.54 176.32 1ffv h ALA 572 N 1.65 0.15 -0.74 3.60 0.00 -1.50 -2.72 119.26 119.70 1ffv h ALA 572 Ca 0.34 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1ffv h ALA 572 Cb 0.60 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1ffv h ALA 572 CO -0.11 0.24 0.43 0.00 0.00 0.00 0.00 179.25 179.80 1ffv h ALA 573 N 0.44 1.37 -0.11 0.00 0.00 -0.46 -1.14 119.26 119.37 1ffv h ALA 573 Ca -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1ffv h ALA 573 Cb 1.01 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1ffv h ALA 573 CO 0.08 0.53 0.03 0.82 0.00 0.00 0.00 179.25 180.71 1ffv h ILE 574 N 1.02 1.17 -0.60 0.00 2.04 -0.79 -0.18 117.51 120.17 1ffv h ILE 574 Ca 0.26 -0.53 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 1ffv h ILE 574 Cb -0.02 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1ffv h ILE 574 CO -0.05 0.16 0.09 0.00 0.00 0.00 0.00 178.15 178.35 1ffv h ALA 575 N 0.85 0.80 -0.42 1.87 0.00 -1.22 -1.72 119.26 119.42 1ffv h ALA 575 Ca 0.04 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1ffv h ALA 575 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ffv h ALA 575 CO -0.00 0.56 -0.27 -0.07 0.00 0.00 0.00 179.25 179.47 1ffv h LEU 576 N 0.90 0.94 -0.63 0.00 3.38 -1.12 -0.36 115.31 118.43 1ffv h LEU 576 Ca 0.18 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1ffv h LEU 576 Cb 0.44 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1ffv h LEU 576 CO 0.01 1.15 0.22 0.00 0.09 0.00 0.00 178.44 179.91 1ffv h ALA 577 N 0.91 0.82 -0.62 1.53 0.00 -0.93 -0.95 119.26 120.01 1ffv h ALA 577 Ca 0.09 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1ffv h ALA 577 Cb 0.84 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1ffv h ALA 577 CO 0.07 0.47 0.07 0.00 0.00 0.00 0.00 179.25 179.86 1ffv h ALA 578 N 1.08 0.95 0.00 0.00 0.00 -1.13 -2.21 119.26 117.95 1ffv h ALA 578 Ca 0.20 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1ffv h ALA 578 Cb 0.26 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ffv h ALA 578 CO -0.01 0.65 -0.29 0.00 0.00 0.00 0.00 179.25 179.60 1ffv h ARG 579 N 0.97 0.00 -0.45 0.00 3.08 -0.60 0.11 114.38 117.48 1ffv h ARG 579 Ca 0.19 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.13 1ffv h ARG 579 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1ffv h ARG 579 CO 0.02 0.29 -0.14 0.87 -1.07 0.00 0.00 179.97 179.94 1ffv h LYS 580 N 0.00 0.85 -0.27 0.04 1.57 -0.58 -1.42 116.57 116.77 1ffv h LYS 580 Ca -0.00 -0.31 -0.17 0.00 -1.87 0.00 0.00 60.65 58.30 1ffv h LYS 580 Cb 0.59 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1ffv h LYS 580 CO 0.04 0.94 -0.50 0.82 -0.57 0.00 0.00 179.45 180.18 1ffv h ILE 581 N 0.76 1.29 -0.33 1.86 2.04 -0.95 -3.10 117.51 119.08 1ffv h ILE 581 Ca 0.12 -1.70 -0.07 0.00 1.00 0.00 0.00 64.86 64.21 1ffv h ILE 581 Cb 0.66 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1ffv h ILE 581 CO 0.05 0.55 -0.09 -0.74 0.00 0.00 0.00 178.15 177.91 1ffv h HIS 582 N 0.58 0.59 -0.53 1.37 2.76 -0.45 -0.08 115.15 119.39 1ffv h HIS 582 Ca 0.02 -0.08 -0.12 0.00 -2.20 0.00 0.00 60.37 57.99 1ffv h HIS 582 Cb 1.07 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.85 1ffv h HIS 582 CO 0.06 0.63 -0.15 0.00 -1.30 0.00 0.00 177.93 177.17 1ffv h ALA 583 N 1.40 0.73 -0.22 5.26 0.00 -1.27 -1.77 119.26 123.38 1ffv h ALA 583 Ca 0.10 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 1ffv h ALA 583 Cb 0.47 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ffv h ALA 583 CO 0.03 0.67 -0.48 -0.22 0.00 0.00 0.00 179.25 179.24 1ffv h LYS 584 N 0.90 0.60 -0.67 0.00 3.64 -1.40 -2.48 116.57 117.15 1ffv h LYS 584 Ca 0.13 -0.34 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1ffv h LYS 584 Cb 0.72 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 1ffv h LYS 584 CO 0.06 0.95 0.31 0.00 -2.27 0.00 0.00 179.45 178.50 1ffv h ALA 585 N 0.99 1.28 -0.23 5.00 0.00 -0.80 -0.78 119.26 124.73 1ffv h ALA 585 Ca 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1ffv h ALA 585 Cb 1.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1ffv h ALA 585 CO 0.09 0.55 0.02 -0.09 0.00 0.00 0.00 179.25 179.83 1ffv h ARG 586 N 0.95 0.39 -0.82 0.00 2.43 -1.10 0.14 114.38 116.37 1ffv h ARG 586 Ca 0.23 -0.11 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1ffv h ARG 586 Cb 0.11 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 1ffv h ARG 586 CO -0.03 0.55 0.52 -0.22 -1.51 0.00 0.00 179.97 179.27 1ffv h LYS 587 N 0.18 0.96 -0.16 0.20 3.64 -1.07 0.62 116.57 120.94 1ffv h LYS 587 Ca 0.07 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1ffv h LYS 587 Cb 0.35 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ffv h LYS 587 CO 0.01 0.63 -0.13 0.82 -2.27 0.00 0.00 179.45 178.51 1ffv h ILE 588 N 0.98 1.33 -0.91 2.00 2.04 -0.93 -2.74 117.51 119.28 1ffv h ILE 588 Ca 0.34 -1.25 0.06 0.00 1.00 0.00 0.00 64.86 65.01 1ffv h ILE 588 Cb 0.07 1.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 1ffv h ILE 588 CO -0.14 0.37 0.59 0.00 0.00 0.00 0.00 178.15 178.98 1ffv h ALA 589 N 0.64 1.50 -0.67 1.87 0.00 -0.12 -1.12 119.26 121.36 1ffv h ALA 589 Ca 0.03 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1ffv h ALA 589 Cb 0.64 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1ffv h ALA 589 CO 0.03 0.37 0.16 0.00 0.00 0.00 0.00 179.25 179.81 1ffv h ALA 590 N 1.50 1.01 -0.38 0.00 0.00 -0.84 -0.64 119.26 119.91 1ffv h ALA 590 Ca 0.39 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1ffv h ALA 590 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ffv h ALA 590 CO -0.15 0.64 0.02 1.25 0.00 0.00 0.00 179.25 181.02 1ffv h HIS 591 N 1.01 0.72 -0.57 0.00 6.17 -0.93 0.05 115.15 121.60 1ffv h HIS 591 Ca 0.21 -0.12 -0.09 0.00 0.71 0.00 0.00 60.37 61.09 1ffv h HIS 591 Cb 0.36 -0.19 -0.02 0.00 2.52 0.00 0.00 27.41 30.08 1ffv h HIS 591 CO 0.03 0.74 0.01 0.52 0.71 0.00 0.00 177.93 179.94 1ffv h MET 592 N 0.50 1.00 -0.01 5.26 2.86 -1.16 -2.80 114.93 120.58 1ffv h MET 592 Ca 0.11 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1ffv h MET 592 Cb 0.44 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1ffv h MET 592 CO 0.02 0.99 -0.03 1.28 1.06 0.00 0.00 176.91 180.22 1ffv n LEU 593 N -4.25 0.54 -3.85 1.22 4.77 -0.26 -4.94 117.00 110.23 1ffv n LEU 593 Ca 0.02 -0.12 -0.27 0.00 -0.03 0.00 0.00 56.01 55.61 1ffv n LEU 593 Cb 0.33 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.38 1ffv n LEU 593 CO 0.43 0.09 0.05 -0.62 -1.33 0.00 0.00 177.39 176.02 1ffv n GLU 594 N -0.69 -5.38 -4.26 3.23 1.02 -0.10 -4.99 120.64 109.47 1ffv n GLU 594 Ca 0.19 0.61 -0.14 0.00 -0.02 0.00 0.00 57.16 57.80 1ffv n GLU 594 Cb 0.23 -5.39 -0.10 0.00 -0.02 0.00 0.00 31.44 26.16 1ffv n GLU 594 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1ffv s VAL 595 N -3.42 0.29 0.49 2.62 -7.23 -0.58 -5.04 120.40 107.52 1ffv s VAL 595 Ca 0.46 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.43 1ffv s VAL 595 Cb -0.23 -2.55 -0.08 0.00 0.56 0.00 0.00 36.38 34.08 1ffv s VAL 595 CO 0.82 -0.02 1.05 0.21 -0.31 0.00 0.00 175.10 176.85 1ffv s ASN 596 N -3.23 6.25 0.28 4.85 2.47 -1.26 -4.48 114.94 119.82 1ffv s ASN 596 Ca 0.38 1.96 0.02 0.00 0.42 0.00 0.00 52.86 55.64 1ffv s ASN 596 Cb 0.07 -2.56 0.65 0.00 -1.45 0.00 0.00 41.25 37.97 1ffv s ASN 596 CO 0.12 -0.84 1.71 -0.33 -3.72 0.00 0.00 177.10 174.04 1ffv h GLU 597 N 1.50 0.42 -0.87 0.43 5.08 -1.91 -2.38 114.58 116.85 1ffv h GLU 597 Ca -0.50 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 57.65 1ffv h GLU 597 Cb 1.23 -0.10 -0.11 0.00 0.50 0.00 0.00 28.75 30.27 1ffv h GLU 597 CO 0.59 0.28 0.24 0.09 -1.00 0.00 0.00 179.01 179.21 1ffv n ASN 598 N -5.02 3.84 -0.60 1.42 4.13 -1.26 -2.37 115.26 115.40 1ffv n ASN 598 Ca 0.20 -2.88 0.09 0.00 1.68 0.00 0.00 54.58 53.67 1ffv n ASN 598 Cb 0.58 -0.68 0.04 0.00 -1.54 0.00 0.00 39.78 38.18 1ffv n ASN 598 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1ffv n ASP 599 N -0.14 2.21 -4.82 6.41 8.00 -0.90 -4.93 116.55 122.39 1ffv n ASP 599 Ca 0.31 -1.60 -0.36 0.00 0.71 0.00 0.00 54.79 53.84 1ffv n ASP 599 Cb 1.12 0.21 -0.07 0.00 -0.02 0.00 0.00 41.12 42.36 1ffv n ASP 599 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ffv s LEU 600 N -1.84 4.12 -0.03 0.64 1.43 -1.00 0.06 118.68 122.06 1ffv s LEU 600 Ca 0.19 0.34 0.08 0.00 -1.03 0.00 0.00 54.13 53.71 1ffv s LEU 600 Cb 0.15 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1ffv s LEU 600 CO 0.33 0.38 -0.26 -1.81 0.23 0.00 0.00 176.35 175.23 1ffv s ASP 601 N -1.10 3.04 -0.22 2.29 1.01 0.71 -4.90 116.67 117.49 1ffv s ASP 601 Ca 0.16 -0.48 -0.15 0.00 0.71 0.00 0.00 52.55 52.79 1ffv s ASP 601 Cb -0.12 -0.44 -0.04 0.00 1.01 0.00 0.00 42.92 43.33 1ffv s ASP 601 CO 0.05 0.30 0.38 0.86 0.21 0.00 0.00 175.17 176.97 1ffv s TRP 602 N -0.51 3.33 -0.40 4.23 -0.11 -1.26 -0.94 118.94 123.28 1ffv s TRP 602 Ca 0.07 0.53 0.02 0.00 1.22 0.00 0.00 56.10 57.94 1ffv s TRP 602 Cb -0.11 -2.52 0.12 0.00 -1.50 0.00 0.00 33.47 29.46 1ffv s TRP 602 CO -0.00 -0.07 0.18 -2.00 -4.62 0.00 0.00 176.95 170.44 1ffv s GLU 603 N 1.53 1.19 0.00 5.86 2.12 -0.61 -4.98 118.70 123.81 1ffv s GLU 603 Ca 0.17 -1.77 0.00 0.00 0.36 0.00 0.00 54.97 53.74 1ffv s GLU 603 Cb -0.15 -2.40 0.00 0.00 0.26 0.00 0.00 34.13 31.84 1ffv s GLU 603 CO 0.08 -1.08 0.00 0.28 -0.54 0.00 0.00 175.26 174.00 1ffv n VAL 604 N 3.97 0.00 -2.14 3.70 0.31 -1.26 -3.23 118.33 119.67 1ffv n VAL 604 Ca 0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.37 1ffv n VAL 604 Cb 0.37 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.29 1ffv n VAL 604 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1ffv n ASP 605 N 0.92 0.01 -3.46 4.52 5.75 -1.26 -3.86 116.55 119.18 1ffv n ASP 605 Ca 0.00 -1.78 -0.13 0.00 -0.01 0.00 0.00 54.79 52.88 1ffv n ASP 605 Cb 0.00 -0.05 -0.03 0.00 -1.03 0.00 0.00 41.12 40.01 1ffv n ASP 605 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ffv s ARG 606 N 0.00 1.14 -0.24 0.11 1.70 -1.20 -2.87 118.95 117.59 1ffv s ARG 606 Ca 0.09 -0.28 -0.07 0.00 -0.47 0.00 0.00 55.73 55.01 1ffv s ARG 606 Cb 0.11 0.53 -0.03 0.00 -0.57 0.00 0.00 34.95 34.99 1ffv s ARG 606 CO -0.05 -0.47 0.07 -0.06 -1.08 0.00 0.00 175.30 173.71 1ffv s PHE 607 N -3.04 3.09 0.14 5.89 0.08 0.07 -1.57 117.98 122.63 1ffv s PHE 607 Ca -0.01 -0.38 0.11 0.00 0.12 0.00 0.00 56.93 56.77 1ffv s PHE 607 Cb -0.01 -2.22 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 1ffv s PHE 607 CO -0.07 -0.32 -0.27 -1.59 -0.10 0.00 0.00 175.22 172.87 1ffv s LYS 608 N 1.52 1.41 0.02 0.44 -2.85 -0.11 -1.08 119.74 119.09 1ffv s LYS 608 Ca 0.06 -1.37 -0.30 0.00 -1.00 0.00 0.00 55.97 53.36 1ffv s LYS 608 Cb -0.15 -1.90 -0.05 0.00 -2.06 0.00 0.00 37.83 33.67 1ffv s LYS 608 CO 0.04 0.45 1.24 0.08 0.10 0.00 0.00 175.35 177.25 1ffv s VAL 609 N -1.12 4.00 0.15 1.79 1.01 -0.16 -0.21 120.40 125.88 1ffv s VAL 609 Ca 0.15 1.41 -0.33 0.00 0.00 0.00 0.00 61.98 63.20 1ffv s VAL 609 Cb -0.10 -3.90 -0.13 0.00 0.00 0.00 0.00 36.38 32.25 1ffv s VAL 609 CO 0.06 0.06 1.67 0.29 0.00 0.00 0.00 175.10 177.19 1ffv n LYS 610 N 4.48 2.41 -0.05 2.72 5.02 0.11 -1.14 118.16 131.71 1ffv n LYS 610 Ca 0.10 0.87 0.00 0.00 -2.02 0.00 0.00 58.31 57.26 1ffv n LYS 610 Cb 0.46 -2.68 0.00 0.00 -0.02 0.00 0.00 35.03 32.78 1ffv n LYS 610 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ffv n GLY 611 N 3.74 2.00 2.50 0.72 0.00 -1.26 -4.96 105.19 107.93 1ffv n GLY 611 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1ffv n GLY 611 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ffv s ASP 612 N -3.36 3.09 0.60 1.61 -1.08 -0.29 -4.99 116.67 112.24 1ffv s ASP 612 Ca 0.00 -2.18 0.33 0.00 -0.52 0.00 0.00 52.55 50.18 1ffv s ASP 612 Cb 0.00 -0.47 1.91 0.00 -1.46 0.00 0.00 42.92 42.90 1ffv s ASP 612 CO 0.00 -0.31 2.26 0.44 0.52 0.00 0.00 175.17 178.08 1ffv h ASP 613 N 7.08 0.00 1.54 -0.34 5.19 -1.93 -2.63 116.42 125.33 1ffv h ASP 613 Ca 0.03 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1ffv h ASP 613 Cb 0.97 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.48 1ffv h ASP 613 CO 0.30 0.01 -0.01 0.77 -3.12 0.00 0.00 179.24 177.19 1ffv h SER 614 N 0.00 0.00 -3.29 6.45 4.64 -1.94 -3.41 113.55 116.00 1ffv h SER 614 Ca -0.00 0.00 -0.74 0.00 -0.47 0.00 0.00 61.79 60.58 1ffv h SER 614 Cb 0.04 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 61.90 1ffv h SER 614 CO 0.00 0.01 -0.33 -0.54 -0.87 0.00 0.00 176.83 175.11 1ffv s LYS 615 N -3.42 2.96 0.23 4.77 1.02 -0.99 -5.03 119.74 119.30 1ffv s LYS 615 Ca 0.04 -1.39 -0.16 0.00 0.02 0.00 0.00 55.97 54.49 1ffv s LYS 615 Cb 0.07 -4.13 0.01 0.00 -0.52 0.00 0.00 37.83 33.25 1ffv s LYS 615 CO 0.62 -1.05 0.53 -0.59 -0.92 0.00 0.00 175.35 173.93 1ffv s PHE 616 N 1.63 0.12 -0.05 3.18 -0.71 -1.26 -0.99 117.98 119.91 1ffv s PHE 616 Ca 0.04 -0.50 -0.02 0.00 -1.04 0.00 0.00 56.93 55.42 1ffv s PHE 616 Cb -0.25 0.34 0.04 0.00 -1.21 0.00 0.00 43.02 41.93 1ffv s PHE 616 CO 0.06 -1.01 0.09 0.15 -1.34 0.00 0.00 175.22 173.18 1ffv s LYS 617 N -3.96 0.03 0.68 1.99 -0.14 -0.24 -4.98 119.74 113.11 1ffv s LYS 617 Ca 0.16 0.31 -0.06 0.00 -1.36 0.00 0.00 55.97 55.02 1ffv s LYS 617 Cb -0.02 -0.23 0.05 0.00 -1.68 0.00 0.00 37.83 35.95 1ffv s LYS 617 CO 0.05 -0.18 0.98 0.95 -0.76 0.00 0.00 175.35 176.39 1ffv s THR 618 N 1.24 2.58 0.49 2.17 -4.23 -1.26 -0.76 115.64 115.87 1ffv s THR 618 Ca -0.08 -0.22 0.16 0.00 -1.18 0.00 0.00 61.69 60.37 1ffv s THR 618 Cb -0.12 -3.10 0.23 0.00 1.34 0.00 0.00 72.50 70.85 1ffv s THR 618 CO -0.05 -0.10 2.08 -0.03 -0.54 0.00 0.00 174.62 175.98 1ffv h MET 619 N -0.49 0.00 -0.24 3.99 4.05 -1.83 -0.57 114.93 119.84 1ffv h MET 619 Ca -0.44 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 58.91 1ffv h MET 619 Cb 1.30 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.10 1ffv h MET 619 CO 0.60 0.09 -0.12 0.00 0.23 0.00 0.00 176.91 177.70 1ffv h ALA 620 N 1.91 0.34 -0.57 0.39 0.00 -1.90 0.80 119.26 120.23 1ffv h ALA 620 Ca -0.00 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.63 1ffv h ALA 620 Cb 0.15 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1ffv h ALA 620 CO 0.01 0.20 0.34 -0.44 0.00 0.00 0.00 179.25 179.37 1ffv h ASP 621 N 0.23 0.55 -0.28 0.00 3.32 -1.64 -2.05 116.42 116.55 1ffv h ASP 621 Ca 0.05 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 1ffv h ASP 621 Cb 0.63 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1ffv h ASP 621 CO 0.04 0.39 0.01 0.40 -1.72 0.00 0.00 179.24 178.36 1ffv h ILE 622 N 0.68 1.25 -0.40 0.35 2.04 -1.03 -2.39 117.51 118.00 1ffv h ILE 622 Ca 0.23 -0.89 0.06 0.00 1.00 0.00 0.00 64.86 65.27 1ffv h ILE 622 Cb 0.04 1.27 -0.05 0.00 -0.74 0.00 0.00 36.82 37.34 1ffv h ILE 622 CO -0.11 0.29 0.08 0.00 0.00 0.00 0.00 178.15 178.41 1ffv h ALA 623 N 0.84 0.44 -0.37 1.87 0.00 -0.57 -0.25 119.26 121.21 1ffv h ALA 623 Ca 0.08 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ffv h ALA 623 Cb 0.40 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1ffv h ALA 623 CO 0.01 -0.32 0.24 2.35 0.00 0.00 0.00 179.25 181.53 1ffv h TRP 624 N 0.21 0.45 -0.85 0.00 2.91 -1.28 -2.41 115.95 114.97 1ffv h TRP 624 Ca 0.20 0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.27 1ffv h TRP 624 Cb 0.24 -0.15 -0.05 0.00 -0.51 0.00 0.00 29.16 28.68 1ffv h TRP 624 CO -0.20 0.28 0.56 0.37 -1.03 0.00 0.00 178.44 178.42 1ffv h GLN 625 N 0.49 1.00 -0.24 2.65 5.75 -0.84 0.11 115.11 124.02 1ffv h GLN 625 Ca 0.14 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 1ffv h GLN 625 Cb -0.04 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.27 1ffv h GLN 625 CO -0.04 0.66 0.10 0.00 -2.65 0.00 0.00 178.83 176.90 1ffv h ALA 626 N 1.51 1.72 0.00 3.38 0.00 -0.56 -0.57 119.26 124.74 1ffv h ALA 626 Ca 0.35 -0.07 -0.27 0.00 0.00 0.00 0.00 54.91 54.92 1ffv h ALA 626 Cb 0.09 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1ffv h ALA 626 CO -0.11 0.23 -1.80 0.66 0.00 0.00 0.00 179.25 178.23 1ffv n TYR 627 N -4.44 0.76 -0.03 0.00 4.02 -0.77 -1.05 117.16 115.64 1ffv n TYR 627 Ca 0.01 0.27 -0.11 0.00 -0.01 0.00 0.00 57.90 58.05 1ffv n TYR 627 Cb 0.12 -1.11 -0.10 0.00 -0.02 0.00 0.00 39.34 38.23 1ffv n TYR 627 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1ffv h HIS 628 N 0.00 -0.04 -1.06 -0.72 2.76 -0.53 -3.46 115.15 112.10 1ffv h HIS 628 Ca -0.31 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 57.85 1ffv h HIS 628 Cb 1.94 0.01 -0.21 0.00 1.55 0.00 0.00 27.41 30.71 1ffv h HIS 628 CO 0.00 0.64 -0.41 -1.14 -1.30 0.00 0.00 177.93 175.72 1ffv s GLN 629 N -2.67 0.61 0.21 5.26 2.00 -0.25 -5.07 119.66 119.75 1ffv s GLN 629 Ca -0.15 0.32 -0.30 0.00 -2.00 0.00 0.00 55.36 53.23 1ffv s GLN 629 Cb -0.01 0.17 -0.09 0.00 0.80 0.00 0.00 33.01 33.87 1ffv s GLN 629 CO 0.55 -1.08 1.36 -1.25 -0.50 0.00 0.00 175.29 174.37 1ffv s PRO 630 N 2.57 4.34 0.55 1.67 0.04 -1.25 -4.70 135.00 138.23 1ffv s PRO 630 Ca 0.11 2.14 -0.21 0.00 0.04 0.00 0.00 61.00 63.08 1ffv s PRO 630 Cb -0.09 -3.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.23 1ffv s PRO 630 CO -0.22 -0.32 1.28 -2.30 0.04 0.00 0.00 177.00 175.49 1ffv n PRO 631 N 2.56 1.55 -1.54 0.56 -0.02 -1.26 -4.83 135.00 132.02 1ffv n PRO 631 Ca 0.06 0.57 -0.51 0.00 -2.02 0.00 0.00 63.50 61.60 1ffv n PRO 631 Cb 0.42 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.36 1ffv n PRO 631 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ffv n ALA 632 N -1.12 -1.68 -0.74 3.55 0.00 -1.26 -1.75 120.51 117.51 1ffv n ALA 632 Ca 0.11 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1ffv n ALA 632 Cb 0.45 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1ffv n ALA 632 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffv n GLY 633 N 1.96 0.65 3.18 0.00 0.00 -1.26 -5.04 105.19 104.68 1ffv n GLY 633 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1ffv n GLY 633 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ffv s LEU 634 N 0.00 2.13 0.54 0.99 1.43 -0.72 -5.13 118.68 117.92 1ffv s LEU 634 Ca 0.00 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 52.50 1ffv s LEU 634 Cb 0.00 -0.80 -0.07 0.00 0.03 0.00 0.00 46.19 45.35 1ffv s LEU 634 CO 0.00 0.13 1.01 -1.61 0.23 0.00 0.00 176.35 176.11 1ffv s GLU 635 N -0.93 3.75 1.14 1.70 2.02 -1.26 -4.70 118.70 120.41 1ffv s GLU 635 Ca 0.05 1.04 -0.15 0.00 0.02 0.00 0.00 54.97 55.93 1ffv s GLU 635 Cb -0.08 -2.10 0.26 0.00 0.10 0.00 0.00 34.13 32.31 1ffv s GLU 635 CO 0.01 -0.45 1.07 -2.14 0.02 0.00 0.00 175.26 173.77 1ffv s PRO 636 N -4.05 -0.68 0.00 0.39 0.02 -1.26 -4.88 135.00 124.53 1ffv s PRO 636 Ca 0.61 0.34 0.00 0.00 0.02 0.00 0.00 61.00 61.97 1ffv s PRO 636 Cb -0.12 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.78 1ffv s PRO 636 CO 0.33 -3.44 0.00 0.41 -0.33 0.00 0.00 177.00 173.97 1ffv n GLY 637 N -0.48 -0.88 3.03 0.52 0.00 -0.22 -4.96 105.19 102.20 1ffv n GLY 637 Ca 0.08 -1.68 -0.05 0.00 0.00 0.00 0.00 46.02 44.37 1ffv n GLY 637 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ffv s LEU 638 N -2.65 -1.01 0.23 0.99 2.96 -1.26 -4.80 118.68 113.15 1ffv s LEU 638 Ca 0.00 -0.91 -0.20 0.00 -0.22 0.00 0.00 54.13 52.80 1ffv s LEU 638 Cb 0.00 1.45 0.03 0.00 0.50 0.00 0.00 46.19 48.17 1ffv s LEU 638 CO 0.00 -0.23 0.62 -1.83 -1.32 0.00 0.00 176.35 173.59 1ffv s GLU 639 N 1.87 1.56 0.12 1.98 -1.05 -1.26 -1.25 118.70 120.67 1ffv s GLU 639 Ca 0.15 -0.88 -0.24 0.00 -0.15 0.00 0.00 54.97 53.85 1ffv s GLU 639 Cb -0.09 0.57 0.07 0.00 -0.44 0.00 0.00 34.13 34.24 1ffv s GLU 639 CO -0.10 -0.69 0.59 0.00 0.95 0.00 0.00 175.26 176.02 1ffv s ALA 640 N -3.88 -1.57 0.03 -0.84 0.00 -0.46 -4.81 121.76 110.24 1ffv s ALA 640 Ca 0.10 0.59 0.03 0.00 0.00 0.00 0.00 51.96 52.67 1ffv s ALA 640 Cb -0.03 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.78 1ffv s ALA 640 CO 0.01 -0.68 -0.09 0.54 0.00 0.00 0.00 175.76 175.54 1ffv s VAL 641 N -3.28 0.64 -0.15 0.00 0.11 -1.26 -0.75 120.40 115.71 1ffv s VAL 641 Ca -0.01 -0.85 -0.08 0.00 -2.93 0.00 0.00 61.98 58.11 1ffv s VAL 641 Cb -0.01 -0.64 0.06 0.00 -1.53 0.00 0.00 36.38 34.26 1ffv s VAL 641 CO -0.09 -0.17 0.35 -2.28 -3.33 0.00 0.00 175.10 169.58 1ffv s HIS 642 N -0.94 -0.51 -0.30 1.54 2.46 -0.22 -4.85 115.29 112.47 1ffv s HIS 642 Ca -0.04 1.11 -0.08 0.00 0.47 0.00 0.00 55.06 56.52 1ffv s HIS 642 Cb -0.07 0.18 0.00 0.00 -0.13 0.00 0.00 32.58 32.56 1ffv s HIS 642 CO 0.00 -0.31 0.11 0.71 -2.47 0.00 0.00 174.74 172.78 1ffv s TYR 643 N 1.43 3.15 -0.28 3.88 1.51 -1.26 -1.93 117.35 123.85 1ffv s TYR 643 Ca -0.09 -0.79 -0.10 0.00 -1.01 0.00 0.00 57.07 55.07 1ffv s TYR 643 Cb -0.09 -2.29 -0.05 0.00 -0.11 0.00 0.00 41.96 39.42 1ffv s TYR 643 CO -0.11 -0.52 0.17 -0.47 -1.11 0.00 0.00 175.55 173.51 1ffv s TYR 644 N 1.55 3.20 -0.44 2.71 5.04 0.95 -4.93 117.35 125.43 1ffv s TYR 644 Ca 0.04 0.03 -0.10 0.00 -2.44 0.00 0.00 57.07 54.59 1ffv s TYR 644 Cb -0.17 -2.36 0.08 0.00 0.35 0.00 0.00 41.96 39.87 1ffv s TYR 644 CO 0.04 -0.19 0.30 0.34 -1.34 0.00 0.00 175.55 174.69 1ffv s ASP 645 N 1.74 5.74 0.39 4.32 2.15 -1.26 -2.15 116.67 127.59 1ffv s ASP 645 Ca 0.07 -1.54 -0.27 0.00 0.43 0.00 0.00 52.55 51.23 1ffv s ASP 645 Cb -0.16 -2.03 -0.11 0.00 -0.30 0.00 0.00 42.92 40.33 1ffv s ASP 645 CO 0.10 -0.59 1.45 -0.81 -0.17 0.00 0.00 175.17 175.15 1ffv n PRO 646 N 4.97 2.51 0.20 4.34 -0.04 -1.26 -4.92 135.00 140.80 1ffv n PRO 646 Ca -0.10 0.88 0.09 0.00 -0.04 0.00 0.00 63.50 64.33 1ffv n PRO 646 Cb 0.43 -2.62 0.20 0.00 -0.04 0.00 0.00 33.50 31.46 1ffv n PRO 646 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1ffv h PRO 647 N 2.75 0.00 -2.64 0.54 0.13 -1.96 -3.21 132.00 127.60 1ffv h PRO 647 Ca -0.50 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.73 1ffv h PRO 647 Cb 1.25 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.30 1ffv h PRO 647 CO 0.63 0.21 0.36 1.21 -0.23 0.00 0.00 178.00 180.18 1ffv s ASN 648 N -6.26 -0.29 1.05 1.44 2.47 -1.26 -4.91 114.94 107.18 1ffv s ASN 648 Ca 0.05 -0.36 -0.14 0.00 0.42 0.00 0.00 52.86 52.83 1ffv s ASN 648 Cb 0.07 0.57 0.19 0.00 -1.45 0.00 0.00 41.25 40.63 1ffv s ASN 648 CO 0.68 -1.02 0.96 0.49 -3.72 0.00 0.00 177.10 174.50 1ffv n PHE 649 N -0.42 -3.91 -4.84 0.43 3.01 -1.26 -4.85 117.46 105.62 1ffv n PHE 649 Ca -0.07 -0.86 -0.31 0.00 1.01 0.00 0.00 57.45 57.22 1ffv n PHE 649 Cb 0.61 -0.81 -0.13 0.00 -0.01 0.00 0.00 39.48 39.14 1ffv n PHE 649 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 1ffv s THR 650 N -3.02 2.74 -0.65 4.37 -1.32 0.46 -4.78 115.64 113.43 1ffv s THR 650 Ca 0.56 -1.04 0.05 0.00 -1.21 0.00 0.00 61.69 60.05 1ffv s THR 650 Cb -0.03 -2.10 0.17 0.00 -1.51 0.00 0.00 72.50 69.04 1ffv s THR 650 CO 0.41 0.45 0.48 -1.22 -2.21 0.00 0.00 174.62 172.53 1ffv n TYR 651 N 1.92 2.50 -1.55 9.09 4.02 -1.26 -1.05 117.16 130.82 1ffv n TYR 651 Ca -0.16 -4.12 -0.31 0.00 -0.01 0.00 0.00 57.90 53.30 1ffv n TYR 651 Cb 0.52 -0.46 0.07 0.00 -0.02 0.00 0.00 39.34 39.44 1ffv n TYR 651 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1ffv s PRO 652 N -1.24 2.60 0.30 -0.72 0.04 -1.25 -4.73 135.00 129.99 1ffv s PRO 652 Ca 0.27 0.85 0.05 0.00 0.04 0.00 0.00 61.00 62.20 1ffv s PRO 652 Cb -0.02 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 1ffv s PRO 652 CO -0.17 -1.31 0.22 -0.59 0.04 0.00 0.00 177.00 175.19 1ffv s PHE 653 N -3.08 1.59 -0.05 0.56 -0.71 -0.85 -0.45 117.98 114.99 1ffv s PHE 653 Ca 0.59 -1.54 -0.29 0.00 -1.04 0.00 0.00 56.93 54.65 1ffv s PHE 653 Cb -0.14 -0.72 0.10 0.00 -1.21 0.00 0.00 43.02 41.05 1ffv s PHE 653 CO 0.55 -0.74 0.86 0.20 -1.34 0.00 0.00 175.22 174.75 1ffv s GLY 654 N -3.33 -0.43 -0.20 1.99 0.00 -0.76 -0.89 107.32 103.70 1ffv s GLY 654 Ca 0.39 1.37 0.01 0.00 0.00 0.00 0.00 44.72 46.49 1ffv s GLY 654 CO 0.22 0.67 -0.10 -0.42 0.00 0.00 0.00 173.10 173.47 1ffv s ILE 655 N -2.14 1.67 -0.09 0.90 1.09 -0.37 -1.77 121.20 120.49 1ffv s ILE 655 Ca -0.01 -1.05 0.03 0.00 -1.10 0.00 0.00 60.65 58.52 1ffv s ILE 655 Cb -0.01 -1.75 -0.01 0.00 -1.06 0.00 0.00 42.46 39.63 1ffv s ILE 655 CO -0.02 0.16 -0.18 -0.31 -0.10 0.00 0.00 174.94 174.49 1ffv s TYR 656 N 1.38 2.67 -0.03 3.97 1.51 0.68 -1.57 117.35 125.95 1ffv s TYR 656 Ca -0.02 -0.61 0.03 0.00 -1.01 0.00 0.00 57.07 55.46 1ffv s TYR 656 Cb -0.16 -1.72 0.00 0.00 -0.11 0.00 0.00 41.96 39.97 1ffv s TYR 656 CO -0.08 -0.15 -0.10 -1.17 -1.11 0.00 0.00 175.55 172.93 1ffv s LEU 657 N -0.00 1.76 -0.01 -1.29 0.20 -0.16 -0.59 118.68 118.58 1ffv s LEU 657 Ca -0.06 -0.22 0.02 0.00 0.69 0.00 0.00 54.13 54.56 1ffv s LEU 657 Cb -0.15 -0.63 0.00 0.00 -0.43 0.00 0.00 46.19 44.99 1ffv s LEU 657 CO 0.05 0.07 -0.05 0.00 -0.29 0.00 0.00 176.35 176.12 1ffv s VAL 659 N 0.16 2.68 0.16 0.00 1.01 -0.09 0.17 120.40 124.48 1ffv s VAL 659 Ca -0.02 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.26 1ffv s VAL 659 Cb -0.06 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1ffv s VAL 659 CO -0.00 0.53 -0.19 0.68 0.00 0.00 0.00 175.10 176.12 1ffv s VAL 660 N 0.43 1.87 -0.16 2.92 -7.23 -0.21 -0.13 120.40 117.88 1ffv s VAL 660 Ca -0.12 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 1ffv s VAL 660 Cb -0.16 -1.83 0.04 0.00 0.56 0.00 0.00 36.38 34.98 1ffv s VAL 660 CO 0.06 -0.24 -0.08 -1.81 -0.31 0.00 0.00 175.10 172.71 1ffv s ASP 661 N -2.53 2.84 -0.21 4.85 1.01 -0.03 -1.80 116.67 120.81 1ffv s ASP 661 Ca 0.15 -0.63 -0.10 0.00 0.71 0.00 0.00 52.55 52.67 1ffv s ASP 661 Cb -0.07 -1.03 -0.05 0.00 1.01 0.00 0.00 42.92 42.78 1ffv s ASP 661 CO 0.07 -0.14 0.14 -0.63 0.21 0.00 0.00 175.17 174.82 1ffv s ILE 662 N 1.56 5.39 -0.37 0.77 1.01 0.47 -1.11 121.20 128.93 1ffv s ILE 662 Ca 0.02 0.19 -0.29 0.00 0.00 0.00 0.00 60.65 60.57 1ffv s ILE 662 Cb -0.15 -3.48 0.01 0.00 0.01 0.00 0.00 42.46 38.86 1ffv s ILE 662 CO -0.08 0.41 1.21 -0.62 0.00 0.00 0.00 174.94 175.86 1ffv s ASP 663 N 0.55 6.70 0.54 3.58 -1.08 -0.40 -0.77 116.67 125.78 1ffv s ASP 663 Ca 0.08 0.92 0.26 0.00 -0.52 0.00 0.00 52.55 53.29 1ffv s ASP 663 Cb -0.12 -2.54 1.54 0.00 -1.46 0.00 0.00 42.92 40.34 1ffv s ASP 663 CO -0.00 -1.11 2.15 0.03 0.52 0.00 0.00 175.17 176.75 1ffv h ARG 664 N 9.10 0.00 0.06 4.34 3.08 -1.68 0.36 114.38 129.64 1ffv h ARG 664 Ca -0.24 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.55 1ffv h ARG 664 Cb 1.08 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.11 1ffv h ARG 664 CO 1.07 0.07 -1.28 0.00 -1.07 0.00 0.00 179.97 178.76 1ffv h ALA 665 N 1.93 0.33 0.00 0.04 0.00 -1.87 0.34 119.26 120.03 1ffv h ALA 665 Ca -0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 54.91 53.87 1ffv h ALA 665 Cb 0.16 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ffv h ALA 665 CO 0.01 1.20 -1.36 0.25 0.00 0.00 0.00 179.25 179.35 1ffv n THR 666 N -3.38 0.05 -0.81 0.00 -2.24 -1.12 -4.77 114.28 102.01 1ffv n THR 666 Ca -0.08 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1ffv n THR 666 Cb 1.00 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.43 1ffv n THR 666 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffv n GLY 667 N 2.13 0.71 3.73 3.38 0.00 0.12 -4.65 105.19 110.61 1ffv n GLY 667 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1ffv n GLY 667 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ffv s GLU 668 N -0.19 4.49 -0.15 1.61 -1.05 -1.25 -4.15 118.70 118.01 1ffv s GLU 668 Ca 0.00 1.06 -0.12 0.00 -0.15 0.00 0.00 54.97 55.76 1ffv s GLU 668 Cb 0.00 -3.41 -0.05 0.00 -0.44 0.00 0.00 34.13 30.24 1ffv s GLU 668 CO 0.00 0.16 0.25 0.99 0.95 0.00 0.00 175.26 177.62 1ffv s THR 669 N 0.38 5.33 -0.18 1.83 2.01 -1.26 -1.28 115.64 122.47 1ffv s THR 669 Ca 0.40 0.47 -0.00 0.00 0.31 0.00 0.00 61.69 62.87 1ffv s THR 669 Cb -0.20 -3.58 0.01 0.00 0.01 0.00 0.00 72.50 68.74 1ffv s THR 669 CO 0.22 0.44 -0.15 -0.75 -0.69 0.00 0.00 174.62 173.69 1ffv s LYS 670 N 0.18 3.14 -0.35 4.92 2.47 -0.27 -4.97 119.74 124.87 1ffv s LYS 670 Ca 0.15 -0.76 -0.29 0.00 -1.56 0.00 0.00 55.97 53.51 1ffv s LYS 670 Cb -0.13 -2.68 0.01 0.00 -1.46 0.00 0.00 37.83 33.57 1ffv s LYS 670 CO 0.03 -0.14 1.29 0.08 0.16 0.00 0.00 175.35 176.78 1ffv s VAL 671 N 1.19 4.12 0.01 4.02 1.01 -1.26 -0.85 120.40 128.64 1ffv s VAL 671 Ca 0.02 1.23 -0.16 0.00 0.00 0.00 0.00 61.98 63.07 1ffv s VAL 671 Cb -0.14 -4.24 -0.35 0.00 0.00 0.00 0.00 36.38 31.65 1ffv s VAL 671 CO -0.07 -0.60 0.94 -0.09 0.00 0.00 0.00 175.10 175.28 1ffv h ARG 672 N 9.51 0.49 -2.40 2.72 2.43 -0.87 -3.48 114.38 122.78 1ffv h ARG 672 Ca -0.26 -0.84 -0.08 0.00 -0.81 0.00 0.00 59.98 57.99 1ffv h ARG 672 Cb 1.09 0.31 -0.20 0.00 -0.42 0.00 0.00 29.97 30.75 1ffv h ARG 672 CO 1.06 1.40 -0.02 0.50 -1.51 0.00 0.00 179.97 181.40 1ffv s ARG 673 N -2.57 0.82 -0.18 0.20 3.52 -1.10 -4.98 118.95 114.66 1ffv s ARG 673 Ca -0.11 0.33 -0.04 0.00 -0.13 0.00 0.00 55.73 55.78 1ffv s ARG 673 Cb 0.04 0.38 0.08 0.00 -1.56 0.00 0.00 34.95 33.89 1ffv s ARG 673 CO 0.92 -0.20 0.20 0.12 -0.81 0.00 0.00 175.30 175.52 1ffv s PHE 674 N -0.70 -0.21 -0.18 5.12 2.19 -1.26 -0.91 117.98 122.03 1ffv s PHE 674 Ca -0.08 0.22 -0.05 0.00 0.33 0.00 0.00 56.93 57.35 1ffv s PHE 674 Cb -0.03 -0.38 -0.03 0.00 -1.31 0.00 0.00 43.02 41.27 1ffv s PHE 674 CO 0.05 -0.54 0.00 -0.47 1.83 0.00 0.00 175.22 176.09 1ffv s TYR 675 N 2.30 3.07 -0.16 10.12 6.14 0.50 -1.80 117.35 137.53 1ffv s TYR 675 Ca 0.06 -0.31 -0.00 0.00 0.64 0.00 0.00 57.07 57.45 1ffv s TYR 675 Cb -0.15 -2.05 0.04 0.00 0.42 0.00 0.00 41.96 40.22 1ffv s TYR 675 CO -0.11 -0.11 -0.06 0.00 0.64 0.00 0.00 175.55 175.91 1ffv s ALA 676 N 0.71 1.49 -0.21 3.97 0.00 0.13 -0.99 121.76 126.86 1ffv s ALA 676 Ca 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.10 1ffv s ALA 676 Cb -0.14 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.86 1ffv s ALA 676 CO 0.02 -0.71 0.00 -1.17 0.00 0.00 0.00 175.76 173.90 1ffv s LEU 677 N 1.63 3.21 0.03 0.00 0.20 -0.61 0.32 118.68 123.46 1ffv s LEU 677 Ca 0.01 -0.24 0.08 0.00 0.69 0.00 0.00 54.13 54.68 1ffv s LEU 677 Cb -0.15 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.77 1ffv s LEU 677 CO -0.08 0.04 -0.24 -1.81 -0.29 0.00 0.00 176.35 173.97 1ffv s ASP 678 N 1.16 2.86 -0.26 3.68 1.01 -0.55 -1.24 116.67 123.33 1ffv s ASP 678 Ca 0.03 -0.53 -0.01 0.00 0.71 0.00 0.00 52.55 52.74 1ffv s ASP 678 Cb -0.14 -0.26 0.08 0.00 1.01 0.00 0.00 42.92 43.60 1ffv s ASP 678 CO 0.01 0.23 0.05 -0.62 0.21 0.00 0.00 175.17 175.06 1ffv s ASP 679 N -1.08 3.67 -0.31 0.27 -1.08 -0.07 -3.44 116.67 114.64 1ffv s ASP 679 Ca 0.10 -1.32 0.08 0.00 -0.52 0.00 0.00 52.55 50.88 1ffv s ASP 679 Cb -0.09 -0.84 0.46 0.00 -1.46 0.00 0.00 42.92 40.99 1ffv s ASP 679 CO 0.01 -0.35 1.35 0.00 0.52 0.00 0.00 175.17 176.70 1ffv n GLY 681 N -0.94 0.80 3.69 0.00 0.00 -1.24 -0.38 105.19 107.12 1ffv n GLY 681 Ca 0.37 -0.74 -0.44 0.00 0.00 0.00 0.00 46.02 45.21 1ffv n GLY 681 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ffv n THR 682 N 0.00 0.16 -3.43 2.61 -1.04 -0.92 -4.63 114.28 107.04 1ffv n THR 682 Ca 0.00 -0.03 -0.39 0.00 -2.04 0.00 0.00 64.05 61.59 1ffv n THR 682 Cb 0.00 -1.87 -0.09 0.00 -1.82 0.00 0.00 70.33 66.54 1ffv n THR 682 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1ffv s ARG 683 N 1.83 3.99 -0.06 -2.82 0.52 -1.26 -4.34 118.95 116.81 1ffv s ARG 683 Ca 0.80 -0.04 -0.25 0.00 -0.52 0.00 0.00 55.73 55.72 1ffv s ARG 683 Cb -0.57 -3.66 -0.21 0.00 0.52 0.00 0.00 34.95 31.03 1ffv s ARG 683 CO 0.37 -0.26 1.04 0.82 0.02 0.00 0.00 175.30 177.29 1ffv h ILE 684 N 5.39 1.37 -2.48 1.52 2.04 -1.94 -3.17 117.51 120.23 1ffv h ILE 684 Ca -0.32 -1.46 -0.41 0.00 1.00 0.00 0.00 64.86 63.67 1ffv h ILE 684 Cb 1.17 2.31 -0.37 0.00 -0.74 0.00 0.00 36.82 39.19 1ffv h ILE 684 CO 0.63 0.36 -0.70 0.21 0.00 0.00 0.00 178.15 178.65 1ffv s ASN 685 N -5.78 2.43 0.30 1.72 3.84 -1.26 -0.34 114.94 115.85 1ffv s ASN 685 Ca -0.16 -0.91 0.03 0.00 0.21 0.00 0.00 52.86 52.03 1ffv s ASN 685 Cb 0.00 0.12 0.63 0.00 -0.55 0.00 0.00 41.25 41.45 1ffv s ASN 685 CO 0.63 -0.40 1.84 -0.65 -2.79 0.00 0.00 177.10 175.73 1ffv h PRO 686 N 8.33 0.89 -0.61 0.43 0.10 -1.80 -1.36 132.00 137.98 1ffv h PRO 686 Ca -0.16 -0.05 -0.00 0.00 0.10 0.00 0.00 66.00 65.88 1ffv h PRO 686 Cb 1.06 -0.20 -0.03 0.00 0.10 0.00 0.00 31.00 31.93 1ffv h PRO 686 CO 0.37 0.59 0.37 1.98 0.10 0.00 0.00 178.00 181.41 1ffv h MET 687 N 0.91 0.83 -0.46 1.05 1.85 -1.88 -0.27 114.93 116.96 1ffv h MET 687 Ca 0.49 -0.07 -0.13 0.00 -0.61 0.00 0.00 59.70 59.38 1ffv h MET 687 Cb 0.57 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 32.42 1ffv h MET 687 CO -0.26 0.59 -0.23 0.82 -0.40 0.00 0.00 176.91 177.43 1ffv h ILE 688 N 0.83 1.27 -0.19 1.77 2.04 -1.77 -2.71 117.51 118.75 1ffv h ILE 688 Ca 0.22 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1ffv h ILE 688 Cb -0.03 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1ffv h ILE 688 CO -0.04 0.48 0.12 0.40 0.00 0.00 0.00 178.15 179.11 1ffv h ILE 689 N 0.82 1.05 -0.97 -0.67 2.04 -0.82 -2.20 117.51 116.75 1ffv h ILE 689 Ca 0.10 -0.09 0.11 0.00 1.00 0.00 0.00 64.86 65.99 1ffv h ILE 689 Cb 0.80 0.77 -0.08 0.00 -0.74 0.00 0.00 36.82 37.57 1ffv h ILE 689 CO 0.07 0.05 0.62 -0.08 0.00 0.00 0.00 178.15 178.80 1ffv h GLU 690 N 0.25 0.93 -0.57 2.37 4.81 -0.95 -1.27 114.58 120.15 1ffv h GLU 690 Ca 0.07 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1ffv h GLU 690 Cb -0.03 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 1ffv h GLU 690 CO -0.02 0.62 0.09 0.78 -0.73 0.00 0.00 179.01 179.76 1ffv h GLY 691 N 0.96 1.01 1.56 1.92 0.00 -1.10 -1.43 103.07 106.00 1ffv h GLY 691 Ca 0.47 -0.67 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 1ffv h GLY 691 CO -0.23 0.63 0.04 1.46 0.00 0.00 0.00 176.54 178.44 1ffv h GLN 692 N 0.84 0.55 -0.20 4.80 1.08 -0.69 -1.64 115.11 119.85 1ffv h GLN 692 Ca 0.17 -0.11 -0.06 0.00 -1.45 0.00 0.00 58.65 57.20 1ffv h GLN 692 Cb 0.41 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1ffv h GLN 692 CO 0.01 0.54 -0.12 0.82 -0.95 0.00 0.00 178.83 179.13 1ffv h ILE 693 N 0.53 1.32 -0.54 2.54 1.08 -1.00 -0.79 117.51 120.65 1ffv h ILE 693 Ca 0.12 -1.22 0.01 0.00 -0.39 0.00 0.00 64.86 63.38 1ffv h ILE 693 Cb 0.28 1.68 -0.03 0.00 -3.07 0.00 0.00 36.82 35.68 1ffv h ILE 693 CO 0.00 0.37 0.36 0.45 -0.69 0.00 0.00 178.15 178.64 1ffv h HIS 694 N 0.12 0.67 -0.53 1.37 3.86 -0.96 0.36 115.15 120.04 1ffv h HIS 694 Ca 0.04 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.20 1ffv h HIS 694 Cb 0.63 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.85 1ffv h HIS 694 CO 0.07 0.42 0.07 0.78 0.86 0.00 0.00 177.93 180.13 1ffv h GLY 695 N 0.73 0.96 0.92 2.45 0.00 -1.28 -2.04 103.07 104.80 1ffv h GLY 695 Ca 0.20 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 1ffv h GLY 695 CO -0.05 0.60 0.08 -1.33 0.00 0.00 0.00 176.54 175.84 1ffv h GLY 696 N 0.77 0.62 1.35 4.60 0.00 -0.75 -1.91 103.07 107.74 1ffv h GLY 696 Ca 0.16 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 47.03 1ffv h GLY 696 CO 0.01 0.37 0.07 1.41 0.00 0.00 0.00 176.54 178.41 1ffv h LEU 697 N 0.42 0.76 -0.75 3.11 3.38 -0.90 -1.69 115.31 119.64 1ffv h LEU 697 Ca 0.11 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1ffv h LEU 697 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1ffv h LEU 697 CO 0.00 0.78 0.01 0.74 0.09 0.00 0.00 178.44 180.07 1ffv h THR 698 N 0.77 1.26 -0.64 0.22 2.02 -1.18 -1.54 112.91 113.82 1ffv h THR 698 Ca 0.16 -1.09 -0.08 0.00 0.77 0.00 0.00 66.41 66.17 1ffv h THR 698 Cb 0.36 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 1ffv h THR 698 CO 0.01 0.39 0.10 -0.33 0.37 0.00 0.00 175.52 176.06 1ffv h GLU 699 N 0.89 1.06 -0.53 6.66 5.08 -0.95 -1.47 114.58 125.32 1ffv h GLU 699 Ca 0.16 -0.29 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1ffv h GLU 699 Cb 0.51 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1ffv h GLU 699 CO 0.02 0.98 0.35 0.78 -1.00 0.00 0.00 179.01 180.15 1ffv h GLY 700 N 0.97 0.74 1.11 -3.84 0.00 -0.92 0.55 103.07 101.68 1ffv h GLY 700 Ca 0.19 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 1ffv h GLY 700 CO 0.01 0.27 0.48 -1.82 0.00 0.00 0.00 176.54 175.48 1ffv h TYR 701 N 0.71 1.15 -0.34 5.60 5.03 -1.09 0.22 116.97 128.25 1ffv h TYR 701 Ca 0.19 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.47 1ffv h TYR 701 Cb -0.08 -0.37 -0.02 0.00 1.55 0.00 0.00 36.73 37.81 1ffv h TYR 701 CO -0.04 0.78 0.15 0.00 -1.32 0.00 0.00 178.16 177.73 1ffv h ALA 702 N 1.35 0.44 0.37 1.82 0.00 -0.17 -0.95 119.26 122.11 1ffv h ALA 702 Ca 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1ffv h ALA 702 Cb -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ffv h ALA 702 CO -0.05 0.02 -0.18 0.28 0.00 0.00 0.00 179.25 179.32 1ffv h VAL 703 N 0.40 0.54 -0.54 0.00 2.07 -0.53 0.74 116.25 118.94 1ffv h VAL 703 Ca 0.11 -0.60 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1ffv h VAL 703 Cb 0.16 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1ffv h VAL 703 CO -0.01 0.10 0.02 0.00 0.02 0.00 0.00 177.57 177.70 1ffv h ALA 704 N -0.47 1.03 0.00 1.67 0.00 -1.01 -3.31 119.26 117.17 1ffv h ALA 704 Ca -0.05 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1ffv h ALA 704 Cb 0.54 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1ffv h ALA 704 CO 0.08 0.61 -1.61 -1.33 0.00 0.00 0.00 179.25 177.00 1ffv n MET 705 N -4.21 0.64 0.00 0.00 2.00 -0.36 0.51 117.12 115.69 1ffv n MET 705 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 57.70 57.71 1ffv n MET 705 Cb 0.30 -1.66 0.00 0.00 0.00 0.00 0.00 33.22 31.86 1ffv n MET 705 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ffv n GLY 706 N 1.28 0.00 3.76 3.03 0.00 -0.82 -3.01 105.19 109.42 1ffv n GLY 706 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 1ffv n GLY 706 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ffv s GLN 707 N -0.23 4.81 -0.03 1.61 -0.21 0.19 -4.54 119.66 121.25 1ffv s GLN 707 Ca 0.00 1.46 -0.30 0.00 0.02 0.00 0.00 55.36 56.54 1ffv s GLN 707 Cb 0.00 -3.20 0.11 0.00 1.00 0.00 0.00 33.01 30.92 1ffv s GLN 707 CO 0.00 0.48 0.96 1.14 -2.12 0.00 0.00 175.29 175.75 1ffv s GLN 708 N -1.33 0.73 -0.48 2.91 -2.07 -1.26 -4.47 119.66 113.70 1ffv s GLN 708 Ca 0.42 -0.28 0.07 0.00 -1.82 0.00 0.00 55.36 53.75 1ffv s GLN 708 Cb -0.25 0.33 0.23 0.00 -1.09 0.00 0.00 33.01 32.23 1ffv s GLN 708 CO 0.30 -0.32 0.53 -1.33 -1.32 0.00 0.00 175.29 173.16 1ffv n MET 709 N -0.23 1.12 -2.37 9.60 2.81 -1.03 -4.92 117.12 122.10 1ffv n MET 709 Ca -0.07 -3.65 -0.38 0.00 -1.81 0.00 0.00 57.70 51.79 1ffv n MET 709 Cb 0.61 -1.63 -0.03 0.00 -0.71 0.00 0.00 33.22 31.46 1ffv n MET 709 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1ffv s PRO 710 N -1.26 4.19 0.02 0.03 0.04 -1.26 -4.88 135.00 131.89 1ffv s PRO 710 Ca 0.35 1.78 0.07 0.00 0.04 0.00 0.00 61.00 63.24 1ffv s PRO 710 Cb 0.12 -2.76 -0.03 0.00 0.04 0.00 0.00 34.50 31.87 1ffv s PRO 710 CO -0.11 -0.18 -0.20 -0.06 0.04 0.00 0.00 177.00 176.49 1ffv s PHE 711 N -1.40 2.51 0.82 0.56 0.40 -1.26 -0.55 117.98 119.05 1ffv s PHE 711 Ca 0.55 -0.29 -0.08 0.00 -0.60 0.00 0.00 56.93 56.50 1ffv s PHE 711 Cb -0.30 -1.49 0.15 0.00 0.51 0.00 0.00 43.02 41.90 1ffv s PHE 711 CO 0.37 0.17 1.14 0.16 0.70 0.00 0.00 175.22 177.76 1ffv s ASP 712 N -1.14 3.88 0.63 1.36 1.47 -0.62 -4.91 116.67 117.34 1ffv s ASP 712 Ca 0.13 0.01 0.36 0.00 1.18 0.00 0.00 52.55 54.23 1ffv s ASP 712 Cb -0.10 -0.28 2.04 0.00 -0.34 0.00 0.00 42.92 44.23 1ffv s ASP 712 CO 0.03 -2.20 2.25 0.00 0.68 0.00 0.00 175.17 175.93 1ffv h ALA 713 N -1.01 1.34 -0.00 2.11 0.00 -2.01 -0.17 119.26 119.51 1ffv h ALA 713 Ca -0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1ffv h ALA 713 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1ffv h ALA 713 CO 0.42 -0.09 -0.19 1.04 0.00 0.00 0.00 179.25 180.43 1ffv n GLN 714 N -3.42 0.67 -0.40 0.00 6.02 -1.26 -4.85 117.38 114.14 1ffv n GLN 714 Ca -0.02 -0.31 0.00 0.00 -0.01 0.00 0.00 57.00 56.66 1ffv n GLN 714 Cb 0.15 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.92 1ffv n GLN 714 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ffv n GLY 715 N 1.33 0.73 3.73 1.08 0.00 -0.08 -4.48 105.19 107.51 1ffv n GLY 715 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1ffv n GLY 715 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ffv s ASN 716 N -2.72 7.05 -0.13 1.61 0.01 -1.26 -4.68 114.94 114.83 1ffv s ASN 716 Ca 0.00 2.24 -0.29 0.00 -0.71 0.00 0.00 52.86 54.10 1ffv s ASN 716 Cb 0.00 -2.60 -0.01 0.00 0.41 0.00 0.00 41.25 39.05 1ffv s ASN 716 CO 0.00 -0.42 1.02 -0.22 -1.51 0.00 0.00 177.10 175.97 1ffv s LEU 717 N -0.04 4.22 0.08 0.60 0.20 -1.26 -1.59 118.68 120.87 1ffv s LEU 717 Ca 0.54 1.50 0.01 0.00 0.69 0.00 0.00 54.13 56.87 1ffv s LEU 717 Cb -0.33 -3.55 -0.04 0.00 -0.43 0.00 0.00 46.19 41.84 1ffv s LEU 717 CO 0.36 -0.50 0.21 -0.76 -0.29 0.00 0.00 176.35 175.37 1ffv s LEU 718 N 2.27 4.29 -1.26 -0.68 1.43 0.28 -4.61 118.68 120.41 1ffv s LEU 718 Ca 0.48 0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 53.78 1ffv s LEU 718 Cb -0.18 -2.90 -0.00 0.00 0.03 0.00 0.00 46.19 43.14 1ffv s LEU 718 CO 0.15 0.15 0.78 0.61 0.23 0.00 0.00 176.35 178.28 1ffv n GLY 719 N 0.16 -0.38 1.86 -3.19 0.00 -1.26 -4.24 105.19 98.13 1ffv n GLY 719 Ca -0.06 0.16 0.06 0.00 0.00 0.00 0.00 46.02 46.18 1ffv n GLY 719 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ffv n ASN 720 N -3.07 5.51 -4.20 1.61 2.04 -1.26 -3.69 115.26 112.20 1ffv n ASN 720 Ca -0.28 -2.92 -0.18 0.00 -0.44 0.00 0.00 54.58 50.77 1ffv n ASN 720 Cb 0.67 -0.69 -0.10 0.00 -2.53 0.00 0.00 39.78 37.14 1ffv n ASN 720 CO 0.00 0.00 0.00 0.42 -0.44 0.00 0.00 177.26 177.24 1ffv s THR 721 N -2.71 0.49 -1.90 5.53 -4.23 -1.26 -4.32 115.64 107.23 1ffv s THR 721 Ca 0.53 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.17 1ffv s THR 721 Cb 0.40 -2.59 0.35 0.00 1.34 0.00 0.00 72.50 72.00 1ffv s THR 721 CO 0.15 0.00 1.23 0.18 -0.54 0.00 0.00 174.62 175.64 1ffv n LEU 722 N -0.52 0.00 -0.21 4.79 4.77 -1.26 -0.61 117.00 123.96 1ffv n LEU 722 Ca 0.00 0.05 -0.08 0.00 -0.03 0.00 0.00 56.01 55.95 1ffv n LEU 722 Cb 0.66 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.72 1ffv n LEU 722 CO 0.37 -0.03 0.90 0.24 -1.33 0.00 0.00 177.39 177.54 1ffv h MET 723 N 0.00 0.95 0.00 3.23 2.86 -1.95 -3.38 114.93 116.63 1ffv h MET 723 Ca 0.00 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1ffv h MET 723 Cb 0.02 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.56 1ffv h MET 723 CO 0.00 0.89 -0.84 -0.25 1.06 0.00 0.00 176.91 177.77 1ffv n ASP 724 N -4.35 4.19 -4.62 1.22 8.00 -0.97 -4.99 116.55 115.03 1ffv n ASP 724 Ca 0.03 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.10 1ffv n ASP 724 Cb 0.25 0.54 -0.03 0.00 -0.02 0.00 0.00 41.12 41.86 1ffv n ASP 724 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1ffv s TYR 725 N -1.79 2.02 0.16 1.24 5.04 0.22 -4.93 117.35 119.31 1ffv s TYR 725 Ca 0.00 0.53 -0.31 0.00 -2.44 0.00 0.00 57.07 54.86 1ffv s TYR 725 Cb 0.00 -4.02 -0.09 0.00 0.35 0.00 0.00 41.96 38.20 1ffv s TYR 725 CO 0.00 -3.02 1.37 0.12 -1.34 0.00 0.00 175.55 172.68 1ffv s PHE 726 N 5.53 3.22 -0.15 4.97 5.36 -1.26 -4.60 117.98 131.05 1ffv s PHE 726 Ca 0.74 1.05 -0.06 0.00 -0.96 0.00 0.00 56.93 57.70 1ffv s PHE 726 Cb -0.25 -3.67 0.07 0.00 -0.34 0.00 0.00 43.02 38.83 1ffv s PHE 726 CO 0.30 -2.26 0.31 -0.51 -1.46 0.00 0.00 175.22 171.60 1ffv s LEU 727 N 0.49 -0.32 0.46 6.12 1.43 -1.26 -4.69 118.68 120.90 1ffv s LEU 727 Ca 0.61 0.70 -0.22 0.00 -1.03 0.00 0.00 54.13 54.19 1ffv s LEU 727 Cb -0.37 0.90 -0.08 0.00 0.03 0.00 0.00 46.19 46.66 1ffv s LEU 727 CO 0.35 -0.23 1.09 -2.16 0.23 0.00 0.00 176.35 175.63 1ffv s PRO 728 N 2.33 3.83 0.44 1.29 0.04 -1.26 -5.07 135.00 136.61 1ffv s PRO 728 Ca -0.01 1.57 0.07 0.00 0.04 0.00 0.00 61.00 62.67 1ffv s PRO 728 Cb -0.12 -2.31 0.07 0.00 0.04 0.00 0.00 34.50 32.18 1ffv s PRO 728 CO -0.10 -0.44 0.58 0.25 0.04 0.00 0.00 177.00 177.33 1ffv n THR 729 N -0.59 0.00 0.25 1.26 -2.24 -1.26 -4.92 114.28 106.77 1ffv n THR 729 Ca 0.08 -1.52 0.12 0.00 -2.27 0.00 0.00 64.05 60.46 1ffv n THR 729 Cb 0.50 -0.56 0.76 0.00 -2.10 0.00 0.00 70.33 68.94 1ffv n THR 729 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffv h ALA 730 N 0.27 1.84 -0.34 6.98 0.00 -1.97 -2.35 119.26 123.70 1ffv h ALA 730 Ca -0.22 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.54 1ffv h ALA 730 Cb 0.97 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1ffv h ALA 730 CO 0.32 -0.08 -0.39 0.28 0.00 0.00 0.00 179.25 179.38 1ffv h VAL 731 N 0.00 1.28 0.00 0.00 2.07 -2.02 -3.25 116.25 114.33 1ffv h VAL 731 Ca 0.03 -1.56 -0.16 0.00 0.82 0.00 0.00 66.70 65.83 1ffv h VAL 731 Cb 0.12 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1ffv h VAL 731 CO -0.00 0.51 -0.75 -0.33 0.02 0.00 0.00 177.57 177.02 1ffv h GLU 732 N 0.65 0.00 -6.20 1.57 3.07 -1.81 -3.45 114.58 108.40 1ffv h GLU 732 Ca 0.05 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.34 1ffv h GLU 732 Cb 0.98 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.85 1ffv h GLU 732 CO 0.09 0.75 0.94 0.99 -1.40 0.00 0.00 179.01 180.38 1ffv s THR 733 N -2.99 4.20 0.87 1.13 2.01 -0.98 -4.98 115.64 114.90 1ffv s THR 733 Ca 0.01 1.42 -0.11 0.00 0.31 0.00 0.00 61.69 63.33 1ffv s THR 733 Cb 0.10 -4.00 0.12 0.00 0.01 0.00 0.00 72.50 68.73 1ffv s THR 733 CO 0.78 -0.21 1.09 -2.16 -0.69 0.00 0.00 174.62 173.43 1ffv s PRO 734 N 3.72 1.42 -0.08 4.92 0.04 -1.26 -4.97 135.00 138.79 1ffv s PRO 734 Ca 0.56 0.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 1ffv s PRO 734 Cb -0.21 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1ffv s PRO 734 CO 0.18 -2.16 1.02 -1.58 0.04 0.00 0.00 177.00 174.50 1ffv s HIS 735 N -2.90 3.50 0.04 0.56 5.65 -1.26 -5.02 115.29 115.86 1ffv s HIS 735 Ca 0.63 1.57 -0.18 0.00 0.25 0.00 0.00 55.06 57.33 1ffv s HIS 735 Cb -0.18 -3.20 -0.06 0.00 -1.18 0.00 0.00 32.58 27.95 1ffv s HIS 735 CO 0.57 -0.31 0.51 -1.58 -0.65 0.00 0.00 174.74 173.27 1ffv s TRP 736 N 1.89 3.77 -0.19 3.88 0.52 -1.26 -4.51 118.94 123.04 1ffv s TRP 736 Ca 0.50 1.16 -0.02 0.00 0.02 0.00 0.00 56.10 57.76 1ffv s TRP 736 Cb -0.19 -2.42 -0.00 0.00 -1.15 0.00 0.00 33.47 29.70 1ffv s TRP 736 CO 0.20 0.60 -0.10 -1.21 0.02 0.00 0.00 176.95 176.46 1ffv s GLU 737 N -1.05 3.29 0.14 4.98 2.02 -0.74 -5.06 118.70 122.29 1ffv s GLU 737 Ca 0.27 -0.69 0.09 0.00 0.02 0.00 0.00 54.97 54.67 1ffv s GLU 737 Cb -0.18 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.19 1ffv s GLU 737 CO 0.17 -0.10 -0.17 0.95 0.02 0.00 0.00 175.26 176.13 1ffv s THR 738 N 1.15 2.82 0.29 3.63 -4.23 -1.26 0.19 115.64 118.23 1ffv s THR 738 Ca 0.01 -1.64 -0.08 0.00 -1.18 0.00 0.00 61.69 58.81 1ffv s THR 738 Cb -0.14 -2.32 -0.00 0.00 1.34 0.00 0.00 72.50 71.37 1ffv s THR 738 CO -0.03 0.02 0.45 -0.62 -0.54 0.00 0.00 174.62 173.90 1ffv s ASP 739 N -2.38 0.32 0.05 3.99 -1.08 0.15 -4.89 116.67 112.84 1ffv s ASP 739 Ca 0.20 -1.20 -0.27 0.00 -0.52 0.00 0.00 52.55 50.75 1ffv s ASP 739 Cb -0.10 0.61 0.09 0.00 -1.46 0.00 0.00 42.92 42.06 1ffv s ASP 739 CO 0.11 -1.19 0.89 -1.38 0.52 0.00 0.00 175.17 174.11 1ffv s HIS 740 N -3.58 -0.30 0.15 -5.34 -3.43 -1.26 -1.47 115.29 100.05 1ffv s HIS 740 Ca 0.27 0.11 0.01 0.00 -0.80 0.00 0.00 55.06 54.65 1ffv s HIS 740 Cb 0.00 0.57 -0.04 0.00 -1.43 0.00 0.00 32.58 31.68 1ffv s HIS 740 CO 0.14 -0.65 0.00 0.95 -2.00 0.00 0.00 174.74 173.18 1ffv s THR 741 N -3.22 0.54 -0.33 -5.38 -4.23 -1.22 -4.96 115.64 96.83 1ffv s THR 741 Ca 0.07 -1.95 0.03 0.00 -1.18 0.00 0.00 61.69 58.66 1ffv s THR 741 Cb -0.01 -2.02 0.10 0.00 1.34 0.00 0.00 72.50 71.91 1ffv s THR 741 CO -0.06 -0.55 0.05 -0.69 -0.54 0.00 0.00 174.62 172.83 1ffv s VAL 742 N -3.75 2.02 -0.51 2.29 1.01 -1.26 -4.43 120.40 115.78 1ffv s VAL 742 Ca 0.22 -2.16 0.03 0.00 0.00 0.00 0.00 61.98 60.07 1ffv s VAL 742 Cb 0.06 -2.49 0.13 0.00 0.00 0.00 0.00 36.38 34.08 1ffv s VAL 742 CO 0.02 -0.60 0.25 -0.89 0.00 0.00 0.00 175.10 173.88 1ffv s THR 743 N 1.04 2.64 0.82 3.92 2.01 -1.26 -4.94 115.64 119.87 1ffv s THR 743 Ca 0.10 -3.18 -0.13 0.00 0.31 0.00 0.00 61.69 58.78 1ffv s THR 743 Cb -0.19 -2.83 0.07 0.00 0.01 0.00 0.00 72.50 69.56 1ffv s THR 743 CO -0.11 -0.78 1.05 -2.65 -0.69 0.00 0.00 174.62 171.44 1ffv n PRO 744 N 3.27 0.11 -2.98 4.92 -0.02 -1.26 -3.59 135.00 135.45 1ffv n PRO 744 Ca 0.05 0.11 -0.42 0.00 -2.02 0.00 0.00 63.50 61.22 1ffv n PRO 744 Cb 0.34 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.45 1ffv n PRO 744 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ffv s SER 745 N -2.06 6.62 0.35 2.55 0.15 -0.47 -4.73 113.70 116.10 1ffv s SER 745 Ca 0.71 0.58 0.05 0.00 0.70 0.00 0.00 55.95 57.98 1ffv s SER 745 Cb -0.29 -2.39 0.70 0.00 -1.71 0.00 0.00 66.02 62.33 1ffv s SER 745 CO 0.54 -0.60 1.94 -0.65 1.20 0.00 0.00 173.24 175.66 1ffv h PRO 746 N 8.18 0.79 0.00 5.44 0.11 -1.89 -2.80 132.00 141.82 1ffv h PRO 746 Ca -0.25 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1ffv h PRO 746 Cb 1.10 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ffv h PRO 746 CO 0.87 0.52 -0.17 1.12 -0.21 0.00 0.00 178.00 180.13 1ffv h HIS 747 N 0.81 0.00 -3.46 0.65 2.07 -1.95 -3.46 115.15 109.81 1ffv h HIS 747 Ca 0.34 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 57.33 1ffv h HIS 747 Cb 0.29 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.25 1ffv h HIS 747 CO -0.00 0.00 0.33 -1.58 -3.07 0.00 0.00 177.93 173.61 1ffv s HIS 748 N -3.13 3.71 0.57 6.12 5.04 -1.06 -4.95 115.29 121.60 1ffv s HIS 748 Ca 0.09 1.68 0.35 0.00 -1.54 0.00 0.00 55.06 55.65 1ffv s HIS 748 Cb 0.12 -3.05 1.43 0.00 0.04 0.00 0.00 32.58 31.12 1ffv s HIS 748 CO 0.63 0.09 1.67 -1.35 -2.34 0.00 0.00 174.74 173.44 1ffv h PRO 749 N 6.31 0.00 0.00 2.88 0.11 -1.89 -0.09 132.00 139.33 1ffv h PRO 749 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1ffv h PRO 749 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ffv h PRO 749 CO 0.74 0.00 -0.02 0.44 -0.21 0.00 0.00 178.00 178.95 1ffv n ILE 750 N -3.82 0.59 -1.01 4.15 -5.35 -1.26 -5.01 119.36 107.66 1ffv n ILE 750 Ca 0.25 -0.61 -0.00 0.00 -0.27 0.00 0.00 62.75 62.12 1ffv n ILE 750 Cb 1.34 0.67 -0.00 0.00 -1.74 0.00 0.00 39.64 39.91 1ffv n ILE 750 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ffv n GLY 751 N -0.32 0.25 3.77 3.28 0.00 -0.05 -4.64 105.19 107.49 1ffv n GLY 751 Ca 0.01 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ffv n GLY 751 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffv s ALA 752 N -1.48 3.48 0.22 4.61 0.00 -1.26 -1.37 121.76 125.95 1ffv s ALA 752 Ca 0.00 0.13 0.08 0.00 0.00 0.00 0.00 51.96 52.17 1ffv s ALA 752 Cb 0.00 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.28 1ffv s ALA 752 CO 0.00 0.21 0.03 0.15 0.00 0.00 0.00 175.76 176.15 1ffv s LYS 753 N -0.48 2.45 0.93 0.00 1.02 0.49 -4.53 119.74 119.63 1ffv s LYS 753 Ca 0.33 -1.21 -0.12 0.00 0.02 0.00 0.00 55.97 55.00 1ffv s LYS 753 Cb -0.20 -2.32 0.15 0.00 -0.52 0.00 0.00 37.83 34.94 1ffv s LYS 753 CO 0.20 0.42 1.09 0.20 -0.92 0.00 0.00 175.35 176.33 1ffv s GLY 754 N -3.34 1.61 0.00 -3.33 0.00 -1.26 -4.78 107.32 96.22 1ffv s GLY 754 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.00 1ffv s GLY 754 CO 0.20 0.50 0.00 1.55 0.00 0.00 0.00 173.10 175.35 1ffv n VAL 755 N -4.06 0.00 -0.33 1.40 3.14 -1.26 -4.66 118.33 112.56 1ffv n VAL 755 Ca 0.07 0.00 0.23 0.00 -2.96 0.00 0.00 64.34 61.68 1ffv n VAL 755 Cb 0.55 0.00 0.45 0.00 -1.06 0.00 0.00 33.84 33.78 1ffv n VAL 755 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ffv h ALA 756 N 0.00 1.85 0.00 1.55 0.00 -1.93 -0.40 119.26 120.33 1ffv h ALA 756 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ffv h ALA 756 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ffv h ALA 756 CO 0.00 -0.60 -0.38 0.93 0.00 0.00 0.00 179.25 179.20 1ffv h GLU 757 N 0.26 0.00 -0.59 0.00 5.08 -1.93 -3.38 114.58 114.02 1ffv h GLU 757 Ca 0.72 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 59.19 1ffv h GLU 757 Cb 1.64 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.78 1ffv h GLU 757 CO -0.64 0.00 -0.20 0.77 -1.00 0.00 0.00 179.01 177.93 1ffv h SER 758 N 0.00 -0.73 -0.61 1.42 0.02 -1.44 -0.75 113.55 111.46 1ffv h SER 758 Ca 0.00 0.19 0.05 0.00 -0.84 0.00 0.00 61.79 61.20 1ffv h SER 758 Cb 0.97 0.43 -0.04 0.00 0.14 0.00 0.00 62.40 63.90 1ffv h SER 758 CO 0.00 -0.24 0.41 1.55 -1.14 0.00 0.00 176.83 177.41 1ffv h PRO 759 N -0.06 0.62 0.05 3.45 0.13 -1.74 0.34 132.00 134.79 1ffv h PRO 759 Ca 0.27 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.36 1ffv h PRO 759 Cb 0.48 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.47 1ffv h PRO 759 CO -0.63 0.41 -0.03 1.25 -0.23 0.00 0.00 178.00 178.77 1ffv h HIS 760 N 0.63 -0.07 -0.33 1.56 2.76 -1.26 -2.18 115.15 116.27 1ffv h HIS 760 Ca 0.26 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.46 1ffv h HIS 760 Cb 0.22 0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.17 1ffv h HIS 760 CO -0.00 0.52 0.11 0.28 -1.30 0.00 0.00 177.93 177.54 1ffv h VAL 761 N -0.73 0.91 0.15 5.26 2.07 -0.98 -3.21 116.25 119.71 1ffv h VAL 761 Ca -0.01 -0.09 -0.30 0.00 0.82 0.00 0.00 66.70 67.12 1ffv h VAL 761 Cb 0.61 0.63 0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1ffv h VAL 761 CO 0.01 0.05 -1.29 1.23 0.02 0.00 0.00 177.57 177.58 1ffv h GLY 762 N 0.26 0.60 1.54 2.17 0.00 -1.04 -3.37 103.07 103.22 1ffv h GLY 762 Ca 0.15 -1.35 -0.06 0.00 0.00 0.00 0.00 47.33 46.07 1ffv h GLY 762 CO -0.15 1.19 -0.03 1.48 0.00 0.00 0.00 176.54 179.03 1ffv h SER 763 N 0.20 0.54 0.34 0.19 4.64 -1.45 -3.12 113.55 114.89 1ffv h SER 763 Ca -0.19 -0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1ffv h SER 763 Cb 1.98 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.91 1ffv h SER 763 CO 0.24 0.63 -0.29 0.40 -0.87 0.00 0.00 176.83 176.94 1ffv h ILE 764 N 0.54 0.40 0.00 0.95 2.04 -1.72 -0.86 117.51 118.86 1ffv h ILE 764 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1ffv h ILE 764 Cb 0.39 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1ffv h ILE 764 CO 0.02 0.00 0.00 1.55 0.00 0.00 0.00 178.15 179.72 1ffv h PRO 765 N -0.64 0.00 -0.42 2.37 0.13 -1.77 -2.10 132.00 129.57 1ffv h PRO 765 Ca -0.02 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.96 1ffv h PRO 765 Cb 0.57 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1ffv h PRO 765 CO -0.03 0.00 -0.33 1.15 -0.23 0.00 0.00 178.00 178.56 1ffv h THR 766 N 0.00 1.27 -0.11 1.56 2.02 -1.24 0.23 112.91 116.64 1ffv h THR 766 Ca 0.00 -1.50 -0.03 0.00 0.77 0.00 0.00 66.41 65.65 1ffv h THR 766 Cb 0.37 1.29 -0.00 0.00 -1.74 0.00 0.00 68.15 68.07 1ffv h THR 766 CO 0.00 0.51 -0.05 -0.26 0.37 0.00 0.00 175.52 176.09 1ffv h PHE 767 N 0.79 0.26 -0.83 3.16 0.04 -0.55 -1.70 116.94 118.11 1ffv h PHE 767 Ca 0.08 -0.06 0.02 0.00 2.80 0.00 0.00 57.97 60.80 1ffv h PHE 767 Cb 0.91 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.96 1ffv h PHE 767 CO 0.06 0.57 0.55 1.15 -0.60 0.00 0.00 178.31 180.04 1ffv h THR 768 N -0.12 1.19 -1.01 -1.55 2.02 -1.36 -1.02 112.91 111.06 1ffv h THR 768 Ca 0.02 -0.38 0.06 0.00 0.77 0.00 0.00 66.41 66.88 1ffv h THR 768 Cb 0.50 -0.01 -0.06 0.00 -1.74 0.00 0.00 68.15 66.84 1ffv h THR 768 CO 0.02 0.20 0.65 0.00 0.37 0.00 0.00 175.52 176.76 1ffv h ALA 769 N 1.32 1.39 -0.21 6.16 0.00 -0.39 0.43 119.26 127.96 1ffv h ALA 769 Ca 0.31 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.05 1ffv h ALA 769 Cb -0.09 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.38 1ffv h ALA 769 CO -0.08 0.48 -0.45 0.00 0.00 0.00 0.00 179.25 179.20 1ffv h ALA 770 N 1.44 0.34 -0.13 0.00 0.00 -0.51 -0.12 119.26 120.27 1ffv h ALA 770 Ca 0.42 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1ffv h ALA 770 Cb 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ffv h ALA 770 CO -0.16 0.47 -0.01 0.28 0.00 0.00 0.00 179.25 179.83 1ffv h VAL 771 N 0.37 1.27 -0.69 0.00 2.07 -0.87 -2.54 116.25 115.86 1ffv h VAL 771 Ca 0.00 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1ffv h VAL 771 Cb 1.06 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.39 1ffv h VAL 771 CO 0.10 0.26 0.31 0.58 0.02 0.00 0.00 177.57 178.84 1ffv h VAL 772 N -0.04 1.24 0.00 2.57 2.07 -0.97 -1.69 116.25 119.43 1ffv h VAL 772 Ca 0.04 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1ffv h VAL 772 Cb 0.41 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1ffv h VAL 772 CO 0.01 0.28 -0.03 -0.78 0.02 0.00 0.00 177.57 177.08 1ffv h ASP 773 N 0.97 0.00 0.96 0.57 3.58 -0.95 0.35 116.42 121.90 1ffv h ASP 773 Ca 0.23 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.62 1ffv h ASP 773 Cb 0.15 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 1ffv h ASP 773 CO -0.03 0.03 -0.31 0.00 -2.88 0.00 0.00 179.24 176.05 1ffv h ALA 774 N 1.97 0.98 -0.01 -0.78 0.00 -0.86 -3.04 119.26 117.53 1ffv h ALA 774 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1ffv h ALA 774 Cb 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ffv h ALA 774 CO 0.00 0.38 -0.65 1.19 0.00 0.00 0.00 179.25 180.18 1ffv n PHE 775 N -3.43 0.00 -0.34 0.00 3.01 -0.08 -4.63 117.46 111.99 1ffv n PHE 775 Ca 0.00 0.00 0.20 0.00 1.01 0.00 0.00 57.45 58.66 1ffv n PHE 775 Cb 0.49 0.00 0.43 0.00 -0.01 0.00 0.00 39.48 40.39 1ffv n PHE 775 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ffv h ALA 776 N 2.79 1.93 0.00 4.37 0.00 -0.90 -0.60 119.26 126.84 1ffv h ALA 776 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ffv h ALA 776 Cb 0.50 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ffv h ALA 776 CO 0.00 -0.40 0.00 -2.39 0.00 0.00 0.00 179.25 176.46 1ffv n HIS 777 N -4.83 0.00 -0.97 0.00 1.44 -1.26 -1.12 115.22 108.48 1ffv n HIS 777 Ca 0.27 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 56.07 1ffv n HIS 777 Cb 0.81 -0.50 0.20 0.00 0.12 0.00 0.00 29.99 30.62 1ffv n HIS 777 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 1ffv n VAL 778 N -1.50 2.04 -0.66 0.61 0.24 -0.24 -4.98 118.33 113.85 1ffv n VAL 778 Ca 0.01 -1.99 0.00 0.00 -2.04 0.00 0.00 64.34 60.33 1ffv n VAL 778 Cb 0.07 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.24 1ffv n VAL 778 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ffv n GLY 779 N -0.86 0.73 3.68 7.63 0.00 -0.27 -5.03 105.19 111.07 1ffv n GLY 779 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1ffv n GLY 779 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ffv s VAL 780 N -2.52 3.93 -0.17 1.61 1.01 -1.19 -4.90 120.40 118.17 1ffv s VAL 780 Ca 0.00 1.26 0.18 0.00 0.00 0.00 0.00 61.98 63.42 1ffv s VAL 780 Cb 0.00 -3.81 -0.26 0.00 0.00 0.00 0.00 36.38 32.31 1ffv s VAL 780 CO 0.00 -0.03 0.17 0.35 0.00 0.00 0.00 175.10 175.59 1ffv n THR 781 N 4.83 1.20 -3.51 3.92 -2.24 -1.26 -4.18 114.28 113.04 1ffv n THR 781 Ca 0.13 -0.80 -0.17 0.00 -2.27 0.00 0.00 64.05 60.94 1ffv n THR 781 Cb 0.44 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 68.19 1ffv n THR 781 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1ffv s HIS 782 N -2.65 -0.64 -0.03 4.78 5.65 -1.26 -4.77 115.29 116.38 1ffv s HIS 782 Ca -0.09 1.03 -0.00 0.00 0.25 0.00 0.00 55.06 56.25 1ffv s HIS 782 Cb 0.07 0.43 0.03 0.00 -1.18 0.00 0.00 32.58 31.93 1ffv s HIS 782 CO 0.84 -0.62 0.02 -0.51 -0.65 0.00 0.00 174.74 173.83 1ffv s LEU 783 N -1.33 0.93 0.33 8.88 1.43 -1.26 -5.09 118.68 122.58 1ffv s LEU 783 Ca -0.09 0.02 -0.28 0.00 -1.03 0.00 0.00 54.13 52.75 1ffv s LEU 783 Cb -0.00 -0.14 -0.09 0.00 0.03 0.00 0.00 46.19 45.99 1ffv s LEU 783 CO 0.08 -0.14 1.13 -1.81 0.23 0.00 0.00 176.35 175.84 1ffv s ASP 784 N 1.27 6.96 0.69 2.29 1.01 -1.26 -5.00 116.67 122.62 1ffv s ASP 784 Ca -0.07 2.31 -0.11 0.00 0.71 0.00 0.00 52.55 55.39 1ffv s ASP 784 Cb -0.13 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.18 1ffv s ASP 784 CO -0.03 -0.37 1.06 -0.04 0.21 0.00 0.00 175.17 176.01 1ffv s MET 785 N -1.84 2.94 0.40 8.23 -1.94 -1.26 -4.52 119.30 121.31 1ffv s MET 785 Ca 0.50 1.01 -0.22 0.00 -1.71 0.00 0.00 55.69 55.27 1ffv s MET 785 Cb -0.31 -1.99 -0.11 0.00 2.01 0.00 0.00 34.83 34.43 1ffv s MET 785 CO 0.40 -1.10 0.94 -2.14 -0.01 0.00 0.00 175.02 173.11 1ffv s PRO 786 N -4.89 4.31 -1.25 2.03 0.02 -1.26 -4.76 135.00 129.20 1ffv s PRO 786 Ca 0.59 1.16 -0.06 0.00 0.02 0.00 0.00 61.00 62.71 1ffv s PRO 786 Cb -0.15 -2.35 0.18 0.00 0.02 0.00 0.00 34.50 32.21 1ffv s PRO 786 CO 0.52 0.05 2.06 0.72 -0.33 0.00 0.00 177.00 180.03 1ffv n HIS 787 N -0.33 2.68 -1.90 6.54 8.25 0.18 -4.80 115.22 125.86 1ffv n HIS 787 Ca 0.06 -2.76 -0.30 0.00 -0.26 0.00 0.00 57.72 54.46 1ffv n HIS 787 Cb 0.53 -1.75 0.05 0.00 1.12 0.00 0.00 29.99 29.94 1ffv n HIS 787 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ffv s THR 788 N -1.10 3.35 0.19 1.59 -4.23 -1.16 -4.70 115.64 109.58 1ffv s THR 788 Ca 0.45 0.43 -0.12 0.00 -1.18 0.00 0.00 61.69 61.27 1ffv s THR 788 Cb 0.14 -3.43 0.10 0.00 1.34 0.00 0.00 72.50 70.65 1ffv s THR 788 CO -0.04 -0.57 1.75 0.28 -0.54 0.00 0.00 174.62 175.50 1ffv h SER 789 N -0.68 0.21 0.04 3.99 0.02 -1.87 0.13 113.55 115.39 1ffv h SER 789 Ca -0.45 0.06 0.02 0.00 -0.84 0.00 0.00 61.79 60.58 1ffv h SER 789 Cb 1.26 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.81 1ffv h SER 789 CO 0.64 0.15 -0.16 0.22 -1.14 0.00 0.00 176.83 176.54 1ffv h TYR 790 N 0.38 -0.41 -0.29 3.45 3.20 -1.84 0.32 116.97 121.78 1ffv h TYR 790 Ca 0.26 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.07 1ffv h TYR 790 Cb 0.27 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1ffv h TYR 790 CO -0.16 -0.24 -0.09 0.00 -1.64 0.00 0.00 178.16 176.04 1ffv h ARG 791 N -0.29 0.57 -0.37 1.82 3.08 -1.77 -1.64 114.38 115.78 1ffv h ARG 791 Ca 0.04 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.83 1ffv h ARG 791 Cb 0.33 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1ffv h ARG 791 CO -0.12 0.78 0.10 0.28 -1.07 0.00 0.00 179.97 179.94 1ffv h VAL 792 N 0.33 1.16 -0.40 2.04 2.07 -0.63 -2.12 116.25 118.71 1ffv h VAL 792 Ca 0.07 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 1ffv h VAL 792 Cb 0.58 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1ffv h VAL 792 CO 0.03 0.20 -0.07 -0.25 0.02 0.00 0.00 177.57 177.51 1ffv h TRP 793 N 0.52 0.83 -0.59 1.57 7.01 -0.11 -0.43 115.95 124.77 1ffv h TRP 793 Ca 0.12 -0.17 0.09 0.00 2.11 0.00 0.00 58.89 61.04 1ffv h TRP 793 Cb 0.18 -0.21 -0.04 0.00 -2.10 0.00 0.00 29.16 26.99 1ffv h TRP 793 CO 0.01 0.87 0.39 0.87 -2.79 0.00 0.00 178.44 177.79 1ffv h LYS 794 N 0.56 0.42 0.05 2.65 1.79 -0.67 0.14 116.57 121.52 1ffv h LYS 794 Ca 0.10 -0.03 -0.25 0.00 -2.18 0.00 0.00 60.65 58.30 1ffv h LYS 794 Cb 0.58 -0.10 0.01 0.00 -1.58 0.00 0.00 32.23 31.15 1ffv h LYS 794 CO 0.03 0.28 -1.07 0.77 -1.08 0.00 0.00 179.45 178.39 1ffv h SER 795 N 0.43 0.57 -0.58 0.86 0.02 -0.91 -1.01 113.55 112.93 1ffv h SER 795 Ca 0.27 -0.50 -0.03 0.00 -0.84 0.00 0.00 61.79 60.69 1ffv h SER 795 Cb 0.48 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 1ffv h SER 795 CO -0.07 1.32 0.26 -0.07 -1.14 0.00 0.00 176.83 177.13 1ffv h LEU 796 N 0.20 0.78 -0.10 5.07 3.38 0.13 -1.72 115.31 123.04 1ffv h LEU 796 Ca -0.11 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1ffv h LEU 796 Cb 1.73 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1ffv h LEU 796 CO 0.19 0.70 0.04 0.50 0.09 0.00 0.00 178.44 179.97 1ffv h LYS 797 N 0.79 0.14 -0.24 1.13 3.64 -0.77 0.25 116.57 121.51 1ffv h LYS 797 Ca 0.20 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1ffv h LYS 797 Cb 0.15 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1ffv h LYS 797 CO -0.02 0.23 0.16 1.49 -2.27 0.00 0.00 179.45 179.03 1ffv h GLU 798 N 0.03 0.32 -0.46 1.90 4.81 -0.98 -2.42 114.58 117.77 1ffv h GLU 798 Ca 0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1ffv h GLU 798 Cb 0.13 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1ffv h GLU 798 CO -0.00 0.22 0.00 0.72 -0.73 0.00 0.00 179.01 179.21 1ffv n HIS 799 N -4.50 1.63 -3.38 0.92 8.25 -0.67 -4.95 115.22 112.52 1ffv n HIS 799 Ca 0.01 -0.78 -0.24 0.00 -0.26 0.00 0.00 57.72 56.45 1ffv n HIS 799 Cb 0.07 -0.42 0.01 0.00 1.12 0.00 0.00 29.99 30.77 1ffv n HIS 799 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ffv n ASN 800 N 0.23 -4.29 -0.36 0.41 5.03 -0.87 -4.85 115.26 110.56 1ffv n ASN 800 Ca 0.25 -0.43 0.07 0.00 0.87 0.00 0.00 54.58 55.35 1ffv n ASN 800 Cb 1.07 -3.51 0.01 0.00 -1.02 0.00 0.00 39.78 36.33 1ffv n ASN 800 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1ffv n LEU 801 N -3.91 1.61 -4.69 3.41 4.77 0.81 -5.00 117.00 114.01 1ffv n LEU 801 Ca -0.02 -0.81 -0.42 0.00 -0.03 0.00 0.00 56.01 54.73 1ffv n LEU 801 Cb 0.55 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.61 1ffv n LEU 801 CO 0.54 0.31 1.48 0.00 -1.33 0.00 0.00 177.39 178.38 1ffv s ALA 802 N -1.63 3.75 0.00 -1.18 0.00 -0.98 -4.82 121.76 116.91 1ffv s ALA 802 Ca 0.13 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1ffv s ALA 802 Cb 0.11 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1ffv s ALA 802 CO 0.32 -1.24 0.00 1.47 0.00 0.00 0.00 175.76 176.31