#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 1.33 -0.05 -1.67 0.00 -1.99 0.64 119.26 117.51 1ffv h ALA 8 Ca 0.00 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 54.43 1ffv h ALA 8 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1ffv h ALA 8 CO 0.00 0.46 -0.79 0.93 0.00 0.00 0.00 179.25 179.85 1ffv h GLU 9 N 0.25 0.39 -0.40 0.00 5.08 -2.01 -2.25 114.58 115.65 1ffv h GLU 9 Ca 0.04 -0.35 -0.11 0.00 -1.00 0.00 0.00 59.36 57.95 1ffv h GLU 9 Cb 0.55 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1ffv h GLU 9 CO 0.04 1.00 -0.19 0.00 -1.00 0.00 0.00 179.01 178.85 1ffv h ALA 10 N 0.89 0.92 -0.34 3.43 0.00 -1.84 -1.00 119.26 121.32 1ffv h ALA 10 Ca -0.04 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 1ffv h ALA 10 Cb 1.39 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1ffv h ALA 10 CO 0.13 0.62 -0.35 0.00 0.00 0.00 0.00 179.25 179.66 1ffv h ARG 11 N 0.67 0.77 -0.42 0.00 3.08 -0.82 -1.63 114.38 116.03 1ffv h ARG 11 Ca 0.10 -0.37 -0.11 0.00 0.07 0.00 0.00 59.98 59.66 1ffv h ARG 11 Cb 0.69 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 1ffv h ARG 11 CO 0.05 1.00 -0.18 1.49 -1.07 0.00 0.00 179.97 181.26 1ffv h GLU 12 N 0.64 0.86 -0.67 0.04 4.81 -1.21 -2.95 114.58 116.10 1ffv h GLU 12 Ca 0.06 -0.36 -0.02 0.00 -0.13 0.00 0.00 59.36 58.91 1ffv h GLU 12 Cb 0.89 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.21 1ffv h GLU 12 CO 0.08 1.01 0.36 1.25 -0.73 0.00 0.00 179.01 180.97 1ffv h LEU 13 N 0.68 0.85 -2.50 1.64 6.46 -1.09 -2.32 115.31 119.04 1ffv h LEU 13 Ca 0.10 -0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1ffv h LEU 13 Cb 0.73 -0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1ffv h LEU 13 CO 0.06 0.71 -0.02 0.00 -0.62 0.00 0.00 178.44 178.57 1ffv h ALA 14 N 1.17 1.31 -0.15 1.25 0.00 -1.14 -2.54 119.26 119.17 1ffv h ALA 14 Ca 0.23 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1ffv h ALA 14 Cb 0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ffv h ALA 14 CO -0.04 0.03 -0.34 -0.07 0.00 0.00 0.00 179.25 178.83 1ffv h LEU 15 N 0.00 0.31 -1.76 0.00 3.38 -1.27 -3.46 115.31 112.52 1ffv h LEU 15 Ca -0.00 -0.12 -0.36 0.00 0.09 0.00 0.00 57.88 57.49 1ffv h LEU 15 Cb 0.07 -0.09 0.13 0.00 0.09 0.00 0.00 40.66 40.87 1ffv h LEU 15 CO 0.00 0.64 -0.80 0.00 0.09 0.00 0.00 178.44 178.37 1ffv n ALA 16 N -2.48 -2.05 -2.08 1.53 0.00 -0.96 -1.10 120.51 113.36 1ffv n ALA 16 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1ffv n ALA 16 Cb 0.44 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.46 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 -1.31 2.18 3.57 0.00 0.00 -1.26 -4.46 105.19 103.91 1ffv n GLY 17 Ca -0.28 -1.81 -0.55 0.00 0.00 0.00 0.00 46.02 43.38 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 0.75 0.00 1.61 2.81 -1.17 -2.15 117.12 118.97 1ffv n MET 18 Ca 0.00 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.16 1ffv n MET 18 Cb 0.00 -1.86 0.00 0.00 -0.71 0.00 0.00 33.22 30.65 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 2.26 3.13 3.78 3.03 0.00 0.15 -5.03 105.19 112.50 1ffv n GLY 19 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.95 3.14 -0.88 4.61 0.00 -0.91 -4.53 121.76 121.23 1ffv s ALA 20 Ca 0.00 0.60 -0.03 0.00 0.00 0.00 0.00 51.96 52.53 1ffv s ALA 20 Cb 0.00 -3.23 0.21 0.00 0.00 0.00 0.00 23.12 20.10 1ffv s ALA 20 CO 0.00 -0.02 2.29 0.43 0.00 0.00 0.00 175.76 178.45 1ffv n SER 21 N 0.15 7.31 -4.78 0.00 7.64 -1.26 -4.32 113.62 118.35 1ffv n SER 21 Ca 0.04 -3.46 -0.35 0.00 1.01 0.00 0.00 58.87 56.11 1ffv n SER 21 Cb 0.50 -1.21 0.00 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 -2.78 3.32 0.68 1.43 1.70 -1.26 -4.85 118.95 117.19 1ffv s ARG 22 Ca 0.52 1.56 -0.15 0.00 -0.47 0.00 0.00 55.73 57.19 1ffv s ARG 22 Cb 0.31 -2.01 0.01 0.00 -0.57 0.00 0.00 34.95 32.70 1ffv s ARG 22 CO -0.22 -0.86 1.12 -0.51 -1.08 0.00 0.00 175.30 173.74 1ffv s LEU 23 N -3.91 3.34 0.21 -1.89 1.43 -1.26 -4.92 118.68 111.69 1ffv s LEU 23 Ca 0.72 2.02 -0.30 0.00 -1.03 0.00 0.00 54.13 55.54 1ffv s LEU 23 Cb -0.23 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.36 1ffv s LEU 23 CO 0.28 -1.75 1.17 -0.13 0.23 0.00 0.00 176.35 176.15 1ffv s ARG 24 N -4.15 4.53 0.30 1.70 0.52 -1.26 -4.95 118.95 115.63 1ffv s ARG 24 Ca 0.67 1.86 0.14 0.00 -0.52 0.00 0.00 55.73 57.88 1ffv s ARG 24 Cb -0.21 -3.23 0.39 0.00 0.52 0.00 0.00 34.95 32.43 1ffv s ARG 24 CO 0.43 -0.01 1.60 0.87 0.02 0.00 0.00 175.30 178.22 1ffv h LYS 25 N 4.84 0.00 0.00 3.54 1.57 -1.94 -3.23 116.57 121.35 1ffv h LYS 25 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1ffv h LYS 25 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1ffv h LYS 25 CO 0.72 0.54 -0.16 -0.85 -0.57 0.00 0.00 179.45 179.13 1ffv n GLU 26 N -3.55 0.03 -0.22 3.15 0.00 -1.26 -4.23 120.64 114.56 1ffv n GLU 26 Ca -0.00 0.02 -0.04 0.00 0.00 0.00 0.00 57.16 57.14 1ffv n GLU 26 Cb 0.62 -1.53 0.07 0.00 0.00 0.00 0.00 31.44 30.60 1ffv n GLU 26 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1ffv h ASP 27 N 0.00 0.60 -0.93 -1.84 5.19 -1.98 -3.23 116.42 114.24 1ffv h ASP 27 Ca 0.00 0.01 0.12 0.00 -0.62 0.00 0.00 57.03 56.54 1ffv h ASP 27 Cb 0.53 -0.12 -0.14 0.00 0.18 0.00 0.00 39.33 39.78 1ffv h ASP 27 CO 0.00 0.42 -0.46 0.00 -3.12 0.00 0.00 179.24 176.07 1ffv h ALA 28 N 1.28 -0.16 -0.37 3.45 0.00 -1.82 -0.29 119.26 121.36 1ffv h ALA 28 Ca 0.26 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.34 1ffv h ALA 28 Cb 0.05 1.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1ffv h ALA 28 CO -0.12 -0.77 0.12 0.07 0.00 0.00 0.00 179.25 178.54 1ffv h ARG 29 N -0.04 0.57 -0.54 0.00 0.11 -1.87 -3.18 114.38 109.43 1ffv h ARG 29 Ca 0.26 -0.12 -0.06 0.00 0.10 0.00 0.00 59.98 60.15 1ffv h ARG 29 Cb 0.53 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.50 1ffv h ARG 29 CO -0.92 0.58 0.08 0.74 0.10 0.00 0.00 179.97 180.55 1ffv h PHE 30 N 0.44 0.90 0.00 4.08 0.04 -1.41 0.16 116.94 121.15 1ffv h PHE 30 Ca 0.12 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.78 1ffv h PHE 30 Cb 0.25 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.14 1ffv h PHE 30 CO 0.01 0.78 0.00 0.44 -0.60 0.00 0.00 178.31 178.94 1ffv n ILE 31 N -4.24 0.25 -0.12 -0.55 -5.35 -0.21 -2.73 119.36 106.41 1ffv n ILE 31 Ca 0.04 0.06 0.01 0.00 -0.27 0.00 0.00 62.75 62.59 1ffv n ILE 31 Cb 0.26 -0.69 0.02 0.00 -1.74 0.00 0.00 39.64 37.49 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 2.82 -1.64 6.28 6.02 -0.98 -4.99 117.38 123.65 1ffv n GLN 32 Ca 0.12 -1.62 -0.11 0.00 -0.01 0.00 0.00 57.00 55.37 1ffv n GLN 32 Cb 0.16 -1.06 -0.03 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 -0.59 0.78 1.48 1.08 0.00 -1.01 -4.91 105.19 102.01 1ffv n GLY 33 Ca 0.02 -0.47 0.06 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.47 3.91 -1.48 1.61 4.76 0.51 -4.97 118.16 120.04 1ffv n LYS 34 Ca -0.12 -3.04 -0.30 0.00 -2.87 0.00 0.00 58.31 51.98 1ffv n LYS 34 Cb 0.45 -2.08 0.08 0.00 -1.84 0.00 0.00 35.03 31.64 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 -1.33 1.65 -0.52 0.72 0.00 -1.23 -4.76 107.32 101.85 1ffv s GLY 35 Ca 0.50 -0.02 0.03 0.00 0.00 0.00 0.00 44.72 45.23 1ffv s GLY 35 CO 0.12 0.36 0.32 0.21 0.00 0.00 0.00 173.10 174.11 1ffv s ASN 36 N -3.74 3.84 0.41 1.64 2.47 -1.26 -5.04 114.94 113.26 1ffv s ASN 36 Ca 0.60 -3.06 0.01 0.00 0.42 0.00 0.00 52.86 50.84 1ffv s ASN 36 Cb -0.15 -1.25 -0.01 0.00 -1.45 0.00 0.00 41.25 38.39 1ffv s ASN 36 CO 0.55 -0.20 0.61 -0.31 -3.72 0.00 0.00 177.10 174.03 1ffv s TYR 37 N -0.26 3.28 0.25 0.43 2.02 -1.26 -1.15 117.35 120.66 1ffv s TYR 37 Ca 0.21 0.20 -0.06 0.00 -0.37 0.00 0.00 57.07 57.05 1ffv s TYR 37 Cb -0.17 -2.16 0.46 0.00 -0.40 0.00 0.00 41.96 39.69 1ffv s TYR 37 CO -0.06 -0.19 1.66 0.28 -1.57 0.00 0.00 175.55 175.67 1ffv h VAL 38 N 0.56 0.42 0.00 0.71 2.07 -1.95 -0.26 116.25 117.80 1ffv h VAL 38 Ca -0.47 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1ffv h VAL 38 Cb 1.24 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1ffv h VAL 38 CO 0.58 0.03 0.00 -0.67 0.02 0.00 0.00 177.57 177.53 1ffv n ASP 39 N -5.25 0.00 0.07 0.57 2.03 -1.26 -2.21 116.55 110.50 1ffv n ASP 39 Ca 0.14 -0.23 0.12 0.00 0.52 0.00 0.00 54.79 55.34 1ffv n ASP 39 Cb 0.48 -0.19 0.25 0.00 -0.72 0.00 0.00 41.12 40.93 1ffv n ASP 39 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1ffv n ASP 40 N -1.19 0.72 -4.73 1.67 8.00 -0.11 -4.89 116.55 116.02 1ffv n ASP 40 Ca 0.12 0.25 -0.41 0.00 0.71 0.00 0.00 54.79 55.46 1ffv n ASP 40 Cb 0.14 -0.12 -0.04 0.00 -0.02 0.00 0.00 41.12 41.07 1ffv n ASP 40 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ffv s ILE 41 N -3.14 3.91 -0.05 0.53 1.01 -0.94 -5.01 121.20 117.52 1ffv s ILE 41 Ca 0.08 1.61 -0.01 0.00 0.00 0.00 0.00 60.65 62.33 1ffv s ILE 41 Cb 0.13 -4.03 0.03 0.00 0.01 0.00 0.00 42.46 38.60 1ffv s ILE 41 CO 0.68 0.26 0.02 -0.54 0.00 0.00 0.00 174.94 175.36 1ffv s LYS 42 N -0.19 0.29 0.19 2.79 1.02 -1.26 -5.10 119.74 117.48 1ffv s LYS 42 Ca 0.50 0.19 0.11 0.00 0.02 0.00 0.00 55.97 56.79 1ffv s LYS 42 Cb -0.29 -0.68 -0.04 0.00 -0.52 0.00 0.00 37.83 36.30 1ffv s LYS 42 CO 0.34 -0.26 -0.22 -1.64 -0.92 0.00 0.00 175.35 172.65 1ffv s MET 43 N 1.76 1.61 0.17 1.68 -1.94 -1.26 -5.08 119.30 116.24 1ffv s MET 43 Ca 0.01 -1.47 -0.33 0.00 -1.71 0.00 0.00 55.69 52.19 1ffv s MET 43 Cb -0.13 -1.91 -0.13 0.00 2.01 0.00 0.00 34.83 34.67 1ffv s MET 43 CO -0.03 0.41 1.60 -2.30 -0.01 0.00 0.00 175.02 174.69 1ffv n PRO 44 N 0.27 2.27 -1.32 2.03 -0.02 -1.26 -1.85 135.00 135.12 1ffv n PRO 44 Ca -0.13 0.82 -0.11 0.00 -2.02 0.00 0.00 63.50 62.06 1ffv n PRO 44 Cb 0.56 -2.60 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 1ffv n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ffv n GLY 45 N 3.48 1.22 3.70 -1.23 0.00 -1.26 -4.57 105.19 106.52 1ffv n GLY 45 Ca 0.17 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.86 4.34 0.40 1.61 0.00 -0.77 -4.20 119.30 117.81 1ffv s MET 46 Ca 0.00 1.89 0.08 0.00 0.00 0.00 0.00 55.69 57.65 1ffv s MET 46 Cb 0.00 -3.45 -0.02 0.00 0.00 0.00 0.00 34.83 31.36 1ffv s MET 46 CO 0.00 -0.45 0.37 -0.51 0.00 0.00 0.00 175.02 174.43 1ffv s LEU 47 N 1.79 3.44 0.06 4.11 1.43 0.89 -4.93 118.68 125.47 1ffv s LEU 47 Ca 0.61 -0.68 0.08 0.00 -1.03 0.00 0.00 54.13 53.11 1ffv s LEU 47 Cb -0.31 -2.11 -0.03 0.00 0.03 0.00 0.00 46.19 43.77 1ffv s LEU 47 CO 0.27 -0.60 -0.21 -2.28 0.23 0.00 0.00 176.35 173.77 1ffv s HIS 48 N -2.44 2.48 0.01 0.29 2.46 0.13 -0.56 115.29 117.66 1ffv s HIS 48 Ca 0.47 -0.30 0.07 0.00 0.47 0.00 0.00 55.06 55.77 1ffv s HIS 48 Cb -0.04 -1.41 -0.03 0.00 -0.13 0.00 0.00 32.58 30.97 1ffv s HIS 48 CO 0.28 0.25 -0.22 1.41 -2.47 0.00 0.00 174.74 173.99 1ffv s MET 49 N -1.56 2.07 0.10 2.88 1.75 -0.03 -0.33 119.30 124.18 1ffv s MET 49 Ca 0.14 -0.96 0.03 0.00 -1.25 0.00 0.00 55.69 53.65 1ffv s MET 49 Cb -0.10 -2.12 -0.04 0.00 2.84 0.00 0.00 34.83 35.40 1ffv s MET 49 CO 0.05 0.55 -0.08 0.34 -0.65 0.00 0.00 175.02 175.23 1ffv s ASP 50 N -1.06 1.31 -0.10 1.11 -1.08 -0.59 -4.60 116.67 111.67 1ffv s ASP 50 Ca 0.12 -0.92 0.03 0.00 -0.52 0.00 0.00 52.55 51.26 1ffv s ASP 50 Cb -0.10 0.05 -0.01 0.00 -1.46 0.00 0.00 42.92 41.40 1ffv s ASP 50 CO 0.02 -0.37 -0.20 -0.63 0.52 0.00 0.00 175.17 174.51 1ffv s ILE 51 N -3.10 2.46 -0.32 4.11 1.01 -1.26 -1.14 121.20 122.96 1ffv s ILE 51 Ca 0.09 -0.89 -0.26 0.00 0.00 0.00 0.00 60.65 59.59 1ffv s ILE 51 Cb 0.02 -1.96 0.01 0.00 0.01 0.00 0.00 42.46 40.53 1ffv s ILE 51 CO -0.02 0.55 0.91 -0.69 0.00 0.00 0.00 174.94 175.70 1ffv s VAL 52 N 0.15 4.66 0.12 2.92 1.01 0.14 -4.96 120.40 124.45 1ffv s VAL 52 Ca -0.11 1.40 0.05 0.00 0.00 0.00 0.00 61.98 63.32 1ffv s VAL 52 Cb -0.16 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 1ffv s VAL 52 CO 0.06 -0.37 0.07 -0.13 0.00 0.00 0.00 175.10 174.74 1ffv s ARG 53 N 3.27 2.75 0.17 2.72 0.52 -1.26 -0.27 118.95 126.86 1ffv s ARG 53 Ca 0.38 -0.84 -0.31 0.00 -0.52 0.00 0.00 55.73 54.43 1ffv s ARG 53 Cb -0.13 -2.61 -0.10 0.00 0.52 0.00 0.00 34.95 32.64 1ffv s ARG 53 CO 0.14 0.52 1.51 0.00 0.02 0.00 0.00 175.30 177.49 1ffv s ALA 54 N -1.55 3.71 -0.96 2.13 0.00 0.39 -4.84 121.76 120.65 1ffv s ALA 54 Ca 0.29 1.32 0.26 0.00 0.00 0.00 0.00 51.96 53.83 1ffv s ALA 54 Cb -0.11 -3.59 0.73 0.00 0.00 0.00 0.00 23.12 20.15 1ffv s ALA 54 CO 0.21 -0.74 1.58 -0.35 0.00 0.00 0.00 175.76 176.46 1ffv n PRO 55 N 3.64 0.03 -4.33 0.00 -0.04 -1.26 -0.49 135.00 132.55 1ffv n PRO 55 Ca 0.12 0.01 -0.21 0.00 -0.04 0.00 0.00 63.50 63.38 1ffv n PRO 55 Cb 0.40 -1.52 -0.11 0.00 -0.04 0.00 0.00 33.50 32.22 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 -3.02 1.78 0.19 0.52 -4.36 -1.26 -4.91 121.20 110.14 1ffv s ILE 56 Ca 0.12 -1.95 0.05 0.00 -0.26 0.00 0.00 60.65 58.60 1ffv s ILE 56 Cb 0.17 -1.85 -0.12 0.00 1.25 0.00 0.00 42.46 41.91 1ffv s ILE 56 CO 0.64 -0.37 1.43 0.00 0.24 0.00 0.00 174.94 176.89 1ffv h ALA 57 N 3.16 0.63 -2.64 2.27 0.00 -1.82 -3.23 119.26 117.62 1ffv h ALA 57 Ca -0.41 -0.69 -0.11 0.00 0.00 0.00 0.00 54.91 53.69 1ffv h ALA 57 Cb 1.21 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 18.65 1ffv h ALA 57 CO 0.53 0.91 -0.28 -1.58 0.00 0.00 0.00 179.25 178.82 1ffv s HIS 58 N -3.29 -0.59 0.00 0.00 5.65 -1.26 -1.66 115.29 114.14 1ffv s HIS 58 Ca -0.02 1.28 0.00 0.00 0.25 0.00 0.00 55.06 56.57 1ffv s HIS 58 Cb 0.11 0.26 0.00 0.00 -1.18 0.00 0.00 32.58 31.77 1ffv s HIS 58 CO 0.81 -0.33 0.00 0.41 -0.65 0.00 0.00 174.74 174.98 1ffv n GLY 59 N 4.07 2.20 3.83 1.59 0.00 -1.07 -1.47 105.19 114.33 1ffv n GLY 59 Ca -0.22 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 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 4.14 -0.39 1.61 0.52 -0.46 -0.42 118.95 121.95 1ffv s ARG 60 Ca 0.00 0.89 -0.19 0.00 -0.52 0.00 0.00 55.73 55.91 1ffv s ARG 60 Cb 0.00 -2.39 0.01 0.00 0.52 0.00 0.00 34.95 33.09 1ffv s ARG 60 CO 0.00 0.11 0.55 0.42 0.02 0.00 0.00 175.30 176.40 1ffv s ILE 61 N -2.00 4.96 -0.11 1.52 1.01 -0.21 -1.82 121.20 124.55 1ffv s ILE 61 Ca 0.56 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 61.14 1ffv s ILE 61 Cb -0.11 -4.06 -0.20 0.00 0.01 0.00 0.00 42.46 38.10 1ffv s ILE 61 CO 0.16 -0.38 0.71 0.11 0.00 0.00 0.00 174.94 175.54 1ffv h LYS 62 N 8.64 -0.03 -1.84 2.79 1.57 -1.17 -3.47 116.57 123.06 1ffv h LYS 62 Ca -0.27 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1ffv h LYS 62 Cb 1.11 0.01 -0.22 0.00 0.08 0.00 0.00 32.23 33.21 1ffv h LYS 62 CO 0.82 0.68 0.29 0.21 -0.57 0.00 0.00 179.45 180.88 1ffv s LYS 63 N -2.48 0.81 -0.15 3.15 2.20 -1.17 -4.99 119.74 117.11 1ffv s LYS 63 Ca -0.15 0.49 0.01 0.00 -0.36 0.00 0.00 55.97 55.96 1ffv s LYS 63 Cb -0.02 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.70 1ffv s LYS 63 CO 0.55 -0.19 -0.18 0.42 -0.36 0.00 0.00 175.35 175.58 1ffv s ILE 64 N -0.52 2.38 -0.40 5.43 1.01 -1.26 -0.92 121.20 126.92 1ffv s ILE 64 Ca -0.04 -0.87 -0.18 0.00 0.00 0.00 0.00 60.65 59.57 1ffv s ILE 64 Cb -0.02 -1.98 0.01 0.00 0.01 0.00 0.00 42.46 40.48 1ffv s ILE 64 CO 0.03 0.53 0.49 -1.00 0.00 0.00 0.00 174.94 174.99 1ffv s HIS 65 N 0.83 3.15 -0.22 3.97 3.76 0.86 -4.94 115.29 122.71 1ffv s HIS 65 Ca -0.06 -0.17 0.21 0.00 -0.15 0.00 0.00 55.06 54.90 1ffv s HIS 65 Cb -0.15 -2.97 -0.31 0.00 1.11 0.00 0.00 32.58 30.25 1ffv s HIS 65 CO -0.01 -0.68 0.55 1.63 -0.85 0.00 0.00 174.74 175.38 1ffv n LYS 66 N 5.74 0.54 -0.10 1.40 5.02 -1.26 -3.27 118.16 126.24 1ffv n LYS 66 Ca -0.06 -0.16 -0.09 0.00 -2.02 0.00 0.00 58.31 55.99 1ffv n LYS 66 Cb 0.48 -1.51 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 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 0.37 -0.95 4.39 3.32 -1.94 -1.72 116.42 119.89 1ffv h ASP 67 Ca 0.00 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1ffv h ASP 67 Cb 0.89 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 40.30 1ffv h ASP 67 CO 0.00 0.27 0.58 0.00 -1.72 0.00 0.00 179.24 178.37 1ffv h ALA 68 N 1.13 1.21 -0.21 3.45 0.00 -1.84 -2.09 119.26 120.92 1ffv h ALA 68 Ca 0.13 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1ffv h ALA 68 Cb -0.04 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1ffv h ALA 68 CO -0.03 0.66 -0.11 0.00 0.00 0.00 0.00 179.25 179.77 1ffv h ALA 69 N 1.32 0.29 -0.89 0.00 0.00 -1.74 -3.12 119.26 115.12 1ffv h ALA 69 Ca 0.34 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ffv h ALA 69 Cb -0.07 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 1ffv h ALA 69 CO -0.07 0.13 0.59 -0.07 0.00 0.00 0.00 179.25 179.84 1ffv h LEU 70 N 0.13 1.01 -0.47 0.00 3.38 -1.07 -2.17 115.31 116.13 1ffv h LEU 70 Ca 0.05 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1ffv h LEU 70 Cb 0.60 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1ffv h LEU 70 CO 0.03 0.72 0.00 0.00 0.09 0.00 0.00 178.44 179.28 1ffv n ALA 71 N -2.35 1.83 -1.94 1.53 0.00 -0.80 -4.76 120.51 114.01 1ffv n ALA 71 Ca 0.10 0.04 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 1ffv n ALA 71 Cb 0.03 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 1ffv n ALA 71 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1ffv s MET 72 N -3.24 4.19 0.19 0.00 0.00 -0.82 -4.92 119.30 114.72 1ffv s MET 72 Ca 0.06 2.30 -0.33 0.00 0.00 0.00 0.00 55.69 57.72 1ffv s MET 72 Cb 0.10 -3.72 -0.13 0.00 0.00 0.00 0.00 34.83 31.08 1ffv s MET 72 CO 0.44 -0.76 1.58 -0.35 0.00 0.00 0.00 175.02 175.93 1ffv n PRO 73 N 6.05 2.31 0.00 4.11 -0.04 -1.26 -1.93 135.00 144.24 1ffv n PRO 73 Ca 0.16 0.83 0.00 0.00 -0.04 0.00 0.00 63.50 64.45 1ffv n PRO 73 Cb 0.41 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 1ffv n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ffv n GLY 74 N 3.22 0.38 3.68 0.55 0.00 -1.26 -4.99 105.19 106.76 1ffv n GLY 74 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.11 5.19 -0.14 1.61 1.01 -0.81 -1.01 120.40 124.14 1ffv s VAL 75 Ca 0.00 0.76 0.17 0.00 0.00 0.00 0.00 61.98 62.91 1ffv s VAL 75 Cb 0.00 -3.75 -0.24 0.00 0.00 0.00 0.00 36.38 32.39 1ffv s VAL 75 CO 0.00 0.26 0.31 1.41 0.00 0.00 0.00 175.10 177.08 1ffv n HIS 76 N 4.36 0.31 -3.53 5.22 8.25 0.10 -4.89 115.22 125.04 1ffv n HIS 76 Ca -0.08 0.11 -0.10 0.00 -0.26 0.00 0.00 57.72 57.39 1ffv n HIS 76 Cb 0.51 -1.00 -0.04 0.00 1.12 0.00 0.00 29.99 30.58 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 -2.65 -1.86 -0.16 -1.41 0.00 -1.16 -4.98 121.76 109.54 1ffv s ALA 77 Ca -0.08 1.25 -0.03 0.00 0.00 0.00 0.00 51.96 53.11 1ffv s ALA 77 Cb 0.07 -0.05 0.05 0.00 0.00 0.00 0.00 23.12 23.20 1ffv s ALA 77 CO 0.83 -0.51 0.03 0.08 0.00 0.00 0.00 175.76 176.19 1ffv s VAL 78 N -2.17 0.41 0.01 0.00 1.01 -1.26 -0.38 120.40 118.02 1ffv s VAL 78 Ca 0.01 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.69 1ffv s VAL 78 Cb -0.01 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1ffv s VAL 78 CO -0.03 -0.10 -0.08 -0.76 0.00 0.00 0.00 175.10 174.13 1ffv s LEU 79 N 1.92 3.08 0.00 3.92 1.43 -0.57 -4.97 118.68 123.50 1ffv s LEU 79 Ca 0.01 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1ffv s LEU 79 Cb -0.16 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 1ffv s LEU 79 CO -0.07 0.27 0.06 0.35 0.23 0.00 0.00 176.35 177.19 1ffv n THR 80 N 1.51 0.00 0.17 5.49 -2.24 -1.26 -1.32 114.28 116.62 1ffv n THR 80 Ca -0.15 -1.89 0.16 0.00 -2.27 0.00 0.00 64.05 59.89 1ffv n THR 80 Cb 0.52 0.52 0.75 0.00 -2.10 0.00 0.00 70.33 70.03 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 1.37 2.02 0.00 6.98 0.00 -1.79 -1.44 119.26 126.40 1ffv h ALA 81 Ca -0.29 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1ffv h ALA 81 Cb 0.99 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1ffv h ALA 81 CO 0.48 -0.31 -0.18 0.93 0.00 0.00 0.00 179.25 180.18 1ffv h GLU 82 N 0.00 0.00 0.00 0.00 4.39 -1.94 -1.40 114.58 115.63 1ffv h GLU 82 Ca 0.11 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 1ffv h GLU 82 Cb 0.49 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1ffv h GLU 82 CO -0.00 0.18 -0.15 -0.44 -1.16 0.00 0.00 179.01 177.44 1ffv h ASP 83 N 0.00 0.00 1.09 1.42 3.32 -1.66 -3.27 116.42 117.33 1ffv h ASP 83 Ca -0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 1ffv h ASP 83 Cb 0.32 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1ffv h ASP 83 CO 0.02 0.13 -0.95 -0.07 -1.72 0.00 0.00 179.24 176.65 1ffv h LEU 84 N 0.00 0.00 -0.43 1.55 4.07 -1.29 -3.40 115.31 115.82 1ffv h LEU 84 Ca -0.00 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.02 1ffv h LEU 84 Cb 1.10 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.79 1ffv h LEU 84 CO 0.02 0.36 0.12 0.11 -1.08 0.00 0.00 178.44 177.97 1ffv h LYS 85 N 0.00 0.26 -0.22 1.13 1.57 -1.42 -0.66 116.57 117.23 1ffv h LYS 85 Ca -0.07 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1ffv h LYS 85 Cb 1.34 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.58 1ffv h LYS 85 CO 0.04 0.17 0.17 -1.35 -0.57 0.00 0.00 179.45 177.90 1ffv h PRO 86 N 0.27 0.00 -0.08 3.15 0.11 -1.78 0.16 132.00 133.83 1ffv h PRO 86 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1ffv h PRO 86 Cb 0.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.34 1ffv h PRO 86 CO -0.24 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.83 1ffv n LEU 87 N -4.39 2.29 -3.69 2.35 4.77 -1.01 -4.94 117.00 112.38 1ffv n LEU 87 Ca 0.02 -0.82 -0.25 0.00 -0.03 0.00 0.00 56.01 54.94 1ffv n LEU 87 Cb 0.31 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.42 1ffv n LEU 87 CO 0.34 0.41 0.17 0.29 -1.33 0.00 0.00 177.39 177.27 1ffv n LYS 88 N 0.77 -6.86 -0.16 3.23 5.02 0.57 -4.93 118.16 115.80 1ffv n LYS 88 Ca 0.17 0.74 0.08 0.00 -2.02 0.00 0.00 58.31 57.28 1ffv n LYS 88 Cb 0.47 -5.71 0.15 0.00 -0.02 0.00 0.00 35.03 29.92 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 -4.76 2.72 0.00 -0.35 4.77 -0.30 -4.60 117.00 114.48 1ffv n LEU 89 Ca -0.04 -2.79 0.14 0.00 -0.03 0.00 0.00 56.01 53.30 1ffv n LEU 89 Cb 0.57 -0.37 0.68 0.00 -2.33 0.00 0.00 43.42 41.97 1ffv n LEU 89 CO 0.68 0.67 0.98 0.00 -1.33 0.00 0.00 177.39 178.39 1ffv n HIS 90 N -0.88 0.00 -4.03 -1.77 1.44 -1.25 -4.58 115.22 104.14 1ffv n HIS 90 Ca 0.14 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.77 1ffv n HIS 90 Cb 0.62 -0.41 -0.10 0.00 0.12 0.00 0.00 29.99 30.21 1ffv n HIS 90 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1ffv s TRP 91 N -2.82 0.38 -0.00 -1.40 0.52 -1.26 -0.15 118.94 114.21 1ffv s TRP 91 Ca 0.20 -0.79 -0.05 0.00 0.02 0.00 0.00 56.10 55.48 1ffv s TRP 91 Cb 0.19 -0.28 -0.00 0.00 -1.15 0.00 0.00 33.47 32.23 1ffv s TRP 91 CO 0.50 -0.29 0.09 0.00 0.02 0.00 0.00 176.95 177.27 1ffv s MET 92 N -2.73 0.36 0.58 4.98 0.23 0.14 -4.82 119.30 118.04 1ffv s MET 92 Ca -0.04 -0.31 -0.18 0.00 -1.03 0.00 0.00 55.69 54.13 1ffv s MET 92 Cb -0.01 0.15 -0.04 0.00 -1.53 0.00 0.00 34.83 33.40 1ffv s MET 92 CO -0.06 -0.08 1.13 -1.25 -2.03 0.00 0.00 175.02 172.74 1ffv s PRO 93 N -1.05 3.15 0.33 3.16 0.04 -1.26 -0.09 135.00 139.27 1ffv s PRO 93 Ca -0.11 1.56 0.09 0.00 0.04 0.00 0.00 61.00 62.57 1ffv s PRO 93 Cb -0.07 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.44 1ffv s PRO 93 CO 0.01 -1.00 0.01 0.95 0.04 0.00 0.00 177.00 177.00 1ffv s THR 94 N -1.94 2.74 0.52 1.26 -4.23 -0.51 -4.81 115.64 108.68 1ffv s THR 94 Ca 0.71 -1.96 0.32 0.00 -1.18 0.00 0.00 61.69 59.58 1ffv s THR 94 Cb -0.23 -2.79 0.35 0.00 1.34 0.00 0.00 72.50 71.17 1ffv s THR 94 CO 0.32 -0.23 2.20 -0.07 -0.54 0.00 0.00 174.62 176.30 1ffv h LEU 95 N 1.82 0.00 -0.86 4.79 3.38 -1.83 -1.57 115.31 121.04 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 0.65 0.04 0.00 0.00 0.09 0.00 0.00 178.44 179.23 1ffv n ALA 96 N -2.26 2.49 -0.96 1.53 0.00 -1.22 -4.59 120.51 115.50 1ffv n ALA 96 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1ffv n ALA 96 Cb 0.14 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.55 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 0.95 0.71 0.89 0.00 0.00 -0.59 -4.87 105.19 102.28 1ffv n GLY 97 Ca 0.11 0.00 -0.05 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 0.56 -4.27 1.61 -0.08 -1.26 -4.62 116.55 108.50 1ffv n ASP 98 Ca 0.00 -1.36 -0.24 0.00 -1.51 0.00 0.00 54.79 51.68 1ffv n ASP 98 Cb 0.00 -0.09 -0.13 0.00 2.34 0.00 0.00 41.12 43.24 1ffv n ASP 98 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1ffv s VAL 99 N 0.11 1.65 0.02 5.18 -7.23 -1.26 -1.42 120.40 117.45 1ffv s VAL 99 Ca 0.13 -1.44 0.06 0.00 -1.81 0.00 0.00 61.98 58.92 1ffv s VAL 99 Cb -0.01 -1.49 -0.02 0.00 0.56 0.00 0.00 36.38 35.42 1ffv s VAL 99 CO 0.08 -0.01 -0.17 0.00 -0.31 0.00 0.00 175.10 174.69 1ffv s ALA 100 N -1.09 1.42 0.11 1.32 0.00 0.87 -4.66 121.76 119.74 1ffv s ALA 100 Ca 0.06 -0.85 -0.30 0.00 0.00 0.00 0.00 51.96 50.86 1ffv s ALA 100 Cb -0.10 -0.29 -0.07 0.00 0.00 0.00 0.00 23.12 22.67 1ffv s ALA 100 CO 0.04 0.31 1.23 0.00 0.00 0.00 0.00 175.76 177.34 1ffv s ALA 101 N -0.66 3.44 -0.16 0.00 0.00 -1.26 0.26 121.76 123.37 1ffv s ALA 101 Ca 0.05 0.93 -0.26 0.00 0.00 0.00 0.00 51.96 52.69 1ffv s ALA 101 Cb -0.08 -3.45 -0.24 0.00 0.00 0.00 0.00 23.12 19.36 1ffv s ALA 101 CO 0.01 -0.44 0.56 0.28 0.00 0.00 0.00 175.76 176.17 1ffv h VAL 102 N 4.19 1.45 -3.30 0.00 2.07 -0.79 -3.45 116.25 116.41 1ffv h VAL 102 Ca -0.43 -2.29 -0.45 0.00 0.82 0.00 0.00 66.70 64.35 1ffv h VAL 102 Cb 1.21 2.95 -0.37 0.00 -1.52 0.00 0.00 31.29 33.56 1ffv h VAL 102 CO 0.80 0.50 -0.78 -0.76 0.02 0.00 0.00 177.57 177.36 1ffv s LEU 103 N -8.07 0.94 -0.03 2.57 1.43 -1.24 -4.72 118.68 109.56 1ffv s LEU 103 Ca -0.23 -0.14 -0.38 0.00 -1.03 0.00 0.00 54.13 52.35 1ffv s LEU 103 Cb 0.01 -0.53 -0.17 0.00 0.03 0.00 0.00 46.19 45.53 1ffv s LEU 103 CO 0.66 -0.13 1.44 0.00 0.23 0.00 0.00 176.35 178.54 1ffv n ALA 104 N 4.76 -0.96 -1.20 4.21 0.00 0.03 -4.59 120.51 122.75 1ffv n ALA 104 Ca -0.14 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1ffv n ALA 104 Cb 0.50 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.86 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 3.27 0.00 0.11 0.00 2.03 -1.26 -4.51 116.55 116.19 1ffv n ASP 105 Ca 0.21 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.56 1ffv n ASP 105 Cb 0.16 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 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 -2.99 -0.67 5.08 -1.92 -3.44 114.58 110.64 1ffv h GLU 106 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1ffv h GLU 106 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1ffv h GLU 106 CO 0.00 0.32 0.24 -1.59 -1.00 0.00 0.00 179.01 176.98 1ffv s LYS 107 N -3.03 1.83 -0.11 2.33 -2.85 -1.26 -1.05 119.74 115.60 1ffv s LYS 107 Ca 0.02 -1.04 -0.02 0.00 -1.00 0.00 0.00 55.97 53.93 1ffv s LYS 107 Cb 0.08 0.61 -0.03 0.00 -2.06 0.00 0.00 37.83 36.43 1ffv s LYS 107 CO 0.76 -0.84 -0.04 0.14 0.10 0.00 0.00 175.35 175.47 1ffv s VAL 108 N -3.73 3.95 -0.49 1.79 -7.23 0.44 -4.75 120.40 110.38 1ffv s VAL 108 Ca 0.12 -0.36 0.21 0.00 -1.81 0.00 0.00 61.98 60.14 1ffv s VAL 108 Cb -0.06 -2.68 -0.29 0.00 0.56 0.00 0.00 36.38 33.91 1ffv s VAL 108 CO 0.07 0.55 0.68 1.41 -0.31 0.00 0.00 175.10 177.51 1ffv n HIS 109 N 2.82 0.00 -3.62 2.82 -0.00 -1.26 -2.60 115.22 113.37 1ffv n HIS 109 Ca -0.18 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.38 1ffv n HIS 109 Cb 0.53 -0.26 -0.07 0.00 -0.00 0.00 0.00 29.99 30.19 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 -3.27 -0.49 0.39 4.41 -0.71 -0.66 -3.88 117.98 113.76 1ffv s PHE 110 Ca -0.00 0.89 -0.27 0.00 -1.04 0.00 0.00 56.93 56.51 1ffv s PHE 110 Cb 0.15 0.28 -0.09 0.00 -1.21 0.00 0.00 43.02 42.14 1ffv s PHE 110 CO 0.89 -0.49 1.33 -1.14 -1.34 0.00 0.00 175.22 174.46 1ffv s GLN 111 N -1.04 4.06 0.00 1.99 0.74 -1.22 -2.43 119.66 121.76 1ffv s GLN 111 Ca -0.10 2.23 0.00 0.00 0.05 0.00 0.00 55.36 57.53 1ffv s GLN 111 Cb -0.02 -2.85 0.00 0.00 1.10 0.00 0.00 33.01 31.24 1ffv s GLN 111 CO 0.07 -0.44 0.00 -1.33 -0.55 0.00 0.00 175.29 173.04 1ffv n MET 112 N 0.30 0.00 -2.18 1.67 2.81 0.36 -4.86 117.12 115.22 1ffv n MET 112 Ca 0.03 0.00 -0.35 0.00 -1.81 0.00 0.00 57.70 55.56 1ffv n MET 112 Cb 0.43 -2.67 0.01 0.00 -0.71 0.00 0.00 33.22 30.28 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 -0.08 3.26 -0.15 0.03 0.74 -1.02 -4.48 119.66 117.97 1ffv s GLN 113 Ca 0.00 1.69 -0.29 0.00 0.05 0.00 0.00 55.36 56.81 1ffv s GLN 113 Cb 0.00 -2.01 -0.03 0.00 1.10 0.00 0.00 33.01 32.07 1ffv s GLN 113 CO 0.00 -0.94 1.46 -1.21 -0.55 0.00 0.00 175.29 174.05 1ffv s GLU 114 N -3.26 4.10 -0.14 1.67 8.01 -1.26 -0.46 118.70 127.36 1ffv s GLU 114 Ca 0.74 1.79 0.04 0.00 0.01 0.00 0.00 54.97 57.55 1ffv s GLU 114 Cb -0.26 -3.90 -0.11 0.00 -4.31 0.00 0.00 34.13 25.55 1ffv s GLU 114 CO 0.29 -0.90 -0.08 0.28 0.01 0.00 0.00 175.26 174.86 1ffv n VAL 115 N 5.68 0.83 -3.77 2.63 0.31 0.63 -0.79 118.33 123.85 1ffv n VAL 115 Ca 0.16 -0.37 -0.09 0.00 -0.01 0.00 0.00 64.34 64.03 1ffv n VAL 115 Cb 0.44 -0.92 -0.03 0.00 -0.91 0.00 0.00 33.84 32.42 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 -2.29 -1.15 0.11 3.52 0.00 -0.99 -4.42 121.76 116.54 1ffv s ALA 116 Ca -0.16 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 51.65 1ffv s ALA 116 Cb 0.05 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 24.01 1ffv s ALA 116 CO 0.38 -0.92 -0.10 0.96 0.00 0.00 0.00 175.76 176.08 1ffv s ILE 117 N -3.89 0.98 0.00 0.00 -4.36 -0.43 0.29 121.20 113.79 1ffv s ILE 117 Ca 0.10 -1.74 0.04 0.00 -0.26 0.00 0.00 60.65 58.79 1ffv s ILE 117 Cb -0.04 -1.48 -0.01 0.00 1.25 0.00 0.00 42.46 42.18 1ffv s ILE 117 CO 0.01 -0.61 -0.12 0.68 0.24 0.00 0.00 174.94 175.15 1ffv s VAL 118 N -2.68 0.93 -0.19 8.37 -7.23 -0.29 -1.51 120.40 117.81 1ffv s VAL 118 Ca 0.08 -0.63 -0.02 0.00 -1.81 0.00 0.00 61.98 59.60 1ffv s VAL 118 Cb -0.01 -0.80 -0.00 0.00 0.56 0.00 0.00 36.38 36.12 1ffv s VAL 118 CO -0.00 0.17 -0.10 -0.63 -0.31 0.00 0.00 175.10 174.23 1ffv s ILE 119 N -0.45 3.03 0.39 -0.62 -1.09 0.49 -1.53 121.20 121.41 1ffv s ILE 119 Ca 0.03 -0.62 0.05 0.00 -2.23 0.00 0.00 60.65 57.88 1ffv s ILE 119 Cb -0.05 -2.34 -0.02 0.00 -1.58 0.00 0.00 42.46 38.47 1ffv s ILE 119 CO 0.00 0.47 0.18 0.00 -1.23 0.00 0.00 174.94 174.36 1ffv s ALA 120 N 1.18 2.65 0.34 9.38 0.00 0.54 0.02 121.76 135.87 1ffv s ALA 120 Ca 0.02 -1.44 0.09 0.00 0.00 0.00 0.00 51.96 50.64 1ffv s ALA 120 Cb -0.14 0.97 0.61 0.00 0.00 0.00 0.00 23.12 24.55 1ffv s ALA 120 CO -0.03 -0.43 1.78 -0.44 0.00 0.00 0.00 175.76 176.64 1ffv h ASP 121 N 1.87 0.15 -5.22 0.00 3.32 -1.36 0.40 116.42 115.58 1ffv h ASP 121 Ca -0.32 -0.05 -0.11 0.00 0.02 0.00 0.00 57.03 56.56 1ffv h ASP 121 Cb 1.26 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 1ffv h ASP 121 CO 0.50 0.50 0.06 1.51 -1.72 0.00 0.00 179.24 180.09 1ffv s ASP 122 N -6.90 0.32 0.49 6.45 1.47 -1.26 -4.45 116.67 112.79 1ffv s ASP 122 Ca -0.04 -1.22 0.27 0.00 1.18 0.00 0.00 52.55 52.74 1ffv s ASP 122 Cb 0.14 0.75 1.20 0.00 -0.34 0.00 0.00 42.92 44.67 1ffv s ASP 122 CO 0.75 -1.47 1.94 0.08 0.68 0.00 0.00 175.17 177.15 1ffv h ARG 123 N 2.06 0.00 0.14 2.11 0.11 -1.91 -1.50 114.38 115.39 1ffv h ARG 123 Ca -0.29 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.78 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 0.38 0.16 -0.07 1.88 0.10 0.00 0.00 179.97 182.42 1ffv h TYR 124 N 0.00 -0.17 -0.44 4.08 -1.99 -2.00 -1.90 116.97 114.56 1ffv h TYR 124 Ca -0.00 -0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.70 1ffv h TYR 124 Cb 0.56 0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.33 1ffv h TYR 124 CO 0.00 0.30 0.15 0.82 -0.00 0.00 0.00 178.16 179.43 1ffv h ILE 125 N -0.83 1.17 -0.60 -2.88 2.04 -1.96 -2.27 117.51 112.18 1ffv h ILE 125 Ca -0.02 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 1ffv h ILE 125 Cb 0.54 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1ffv h ILE 125 CO 0.03 0.22 0.34 0.00 0.00 0.00 0.00 178.15 178.73 1ffv h ALA 126 N 1.55 0.76 -0.71 1.87 0.00 -1.28 -0.26 119.26 121.18 1ffv h ALA 126 Ca 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ffv h ALA 126 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1ffv h ALA 126 CO -0.01 0.27 0.35 0.00 0.00 0.00 0.00 179.25 179.86 1ffv h ALA 127 N 1.16 0.92 -0.74 0.00 0.00 -0.79 -2.26 119.26 117.55 1ffv h ALA 127 Ca 0.21 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1ffv h ALA 127 Cb 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1ffv h ALA 127 CO -0.04 0.48 0.28 -0.44 0.00 0.00 0.00 179.25 179.54 1ffv h ASP 128 N 1.00 1.03 -0.67 0.00 3.32 -0.93 -2.78 116.42 117.38 1ffv h ASP 128 Ca 0.25 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1ffv h ASP 128 Cb 0.11 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 1ffv h ASP 128 CO -0.03 0.92 0.31 0.00 -1.72 0.00 0.00 179.24 178.72 1ffv h ALA 129 N 1.22 1.23 -0.63 3.45 0.00 -0.56 -2.41 119.26 121.57 1ffv h ALA 129 Ca 0.25 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ffv h ALA 129 Cb 0.22 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1ffv h ALA 129 CO -0.02 0.58 0.27 0.28 0.00 0.00 0.00 179.25 180.36 1ffv h VAL 130 N 0.99 1.23 0.00 0.00 2.07 -1.15 -2.35 116.25 117.04 1ffv h VAL 130 Ca 0.24 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1ffv h VAL 130 Cb 0.14 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1ffv h VAL 130 CO -0.03 0.27 -0.22 -0.33 0.02 0.00 0.00 177.57 177.28 1ffv h GLU 131 N 0.87 0.00 0.00 1.57 4.39 -1.28 -2.59 114.58 117.54 1ffv h GLU 131 Ca 0.21 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.91 1ffv h GLU 131 Cb 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1ffv h GLU 131 CO -0.02 0.22 0.00 0.00 -1.16 0.00 0.00 179.01 178.05 1ffv h ALA 132 N 1.78 1.00 -1.91 3.43 0.00 -0.95 -3.43 119.26 119.17 1ffv h ALA 132 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 1ffv h ALA 132 Cb 0.43 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 1ffv h ALA 132 CO 0.03 0.00 0.74 0.08 0.00 0.00 0.00 179.25 180.10 1ffv s VAL 133 N -3.19 4.44 -0.07 0.00 1.01 -0.98 -4.38 120.40 117.23 1ffv s VAL 133 Ca 0.08 1.23 -0.10 0.00 0.00 0.00 0.00 61.98 63.19 1ffv s VAL 133 Cb 0.09 -4.44 -0.05 0.00 0.00 0.00 0.00 36.38 31.98 1ffv s VAL 133 CO 0.62 -0.71 0.25 -0.54 0.00 0.00 0.00 175.10 174.71 1ffv s LYS 134 N 3.83 3.62 -0.03 2.72 1.02 -1.20 -4.94 119.74 124.76 1ffv s LYS 134 Ca 0.42 0.07 0.02 0.00 0.02 0.00 0.00 55.97 56.50 1ffv s LYS 134 Cb -0.10 -3.19 0.01 0.00 -0.52 0.00 0.00 37.83 34.02 1ffv s LYS 134 CO 0.23 0.74 -0.08 0.08 -0.92 0.00 0.00 175.35 175.40 1ffv s VAL 135 N -1.07 0.71 -0.14 3.17 1.01 -1.26 -0.10 120.40 122.72 1ffv s VAL 135 Ca 0.19 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 1ffv s VAL 135 Cb -0.14 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 1ffv s VAL 135 CO 0.08 0.24 0.00 -1.61 0.00 0.00 0.00 175.10 173.81 1ffv s GLU 136 N 0.35 3.54 0.24 2.72 2.02 -0.10 -5.00 118.70 122.48 1ffv s GLU 136 Ca -0.05 -0.43 0.06 0.00 0.02 0.00 0.00 54.97 54.57 1ffv s GLU 136 Cb -0.10 -2.96 -0.05 0.00 0.10 0.00 0.00 34.13 31.12 1ffv s GLU 136 CO 0.01 0.41 -0.06 0.71 0.02 0.00 0.00 175.26 176.34 1ffv s TYR 137 N -0.05 1.76 -0.32 1.61 2.02 -1.26 -0.59 117.35 120.52 1ffv s TYR 137 Ca 0.04 -0.74 0.02 0.00 -0.37 0.00 0.00 57.07 56.02 1ffv s TYR 137 Cb -0.13 -0.97 0.09 0.00 -0.40 0.00 0.00 41.96 40.56 1ffv s TYR 137 CO 0.02 0.20 0.04 -0.51 -1.57 0.00 0.00 175.55 173.72 1ffv s ASP 138 N -3.36 4.48 0.47 2.29 1.01 -0.75 -4.89 116.67 115.91 1ffv s ASP 138 Ca 0.27 -1.88 -0.24 0.00 0.71 0.00 0.00 52.55 51.41 1ffv s ASP 138 Cb 0.03 -1.40 -0.08 0.00 1.01 0.00 0.00 42.92 42.48 1ffv s ASP 138 CO 0.09 -0.36 1.33 -0.62 0.21 0.00 0.00 175.17 175.83 1ffv n GLU 139 N 4.45 1.95 -4.40 8.23 1.02 -1.26 -1.36 120.64 129.27 1ffv n GLU 139 Ca -0.00 0.70 -0.24 0.00 -0.02 0.00 0.00 57.16 57.59 1ffv n GLU 139 Cb 0.42 -2.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.23 1ffv n GLU 139 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ffv s LEU 140 N -2.41 2.48 0.28 -4.62 1.43 -0.54 -4.87 118.68 110.43 1ffv s LEU 140 Ca 0.64 -0.91 -0.30 0.00 -1.03 0.00 0.00 54.13 52.52 1ffv s LEU 140 Cb -0.46 -1.02 -0.12 0.00 0.03 0.00 0.00 46.19 44.62 1ffv s LEU 140 CO 0.56 0.04 1.63 -0.81 0.23 0.00 0.00 176.35 177.99 1ffv n PRO 141 N 0.03 2.75 -3.22 1.29 -0.04 -1.26 -4.64 135.00 129.91 1ffv n PRO 141 Ca -0.11 0.98 -0.39 0.00 -0.04 0.00 0.00 63.50 63.94 1ffv n PRO 141 Cb 0.57 -2.78 -0.06 0.00 -0.04 0.00 0.00 33.50 31.20 1ffv n PRO 141 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ffv s VAL 142 N 0.18 4.74 -0.30 0.52 1.01 -1.26 -4.91 120.40 120.38 1ffv s VAL 142 Ca 0.66 1.28 -0.08 0.00 0.00 0.00 0.00 61.98 63.84 1ffv s VAL 142 Cb -0.49 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1ffv s VAL 142 CO 0.46 0.52 0.10 -0.69 0.00 0.00 0.00 175.10 175.49 1ffv s VAL 143 N -0.88 4.15 -0.06 2.92 1.01 -1.26 -4.94 120.40 121.34 1ffv s VAL 143 Ca 0.30 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1ffv s VAL 143 Cb -0.20 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 1ffv s VAL 143 CO 0.19 0.08 -0.03 -0.38 0.00 0.00 0.00 175.10 174.97 1ffv n ILE 144 N 4.90 0.37 -3.45 2.22 -0.00 -1.26 -1.20 119.36 120.94 1ffv n ILE 144 Ca -0.14 -0.18 -0.37 0.00 -0.00 0.00 0.00 62.75 62.06 1ffv n ILE 144 Cb 0.48 -0.79 -0.07 0.00 -0.00 0.00 0.00 39.64 39.27 1ffv n ILE 144 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1ffv s ASP 145 N -4.23 6.46 0.31 4.38 2.15 -1.26 -4.94 116.67 119.54 1ffv s ASP 145 Ca -0.06 0.54 0.02 0.00 0.43 0.00 0.00 52.55 53.48 1ffv s ASP 145 Cb 0.02 -2.21 0.59 0.00 -0.30 0.00 0.00 42.92 41.02 1ffv s ASP 145 CO 0.18 0.02 1.89 -0.65 -0.17 0.00 0.00 175.17 176.44 1ffv h PRO 146 N 6.96 0.93 -0.40 4.34 0.11 -1.94 -1.91 132.00 140.09 1ffv h PRO 146 Ca -0.39 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1ffv h PRO 146 Cb 1.17 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1ffv h PRO 146 CO 0.74 0.61 0.04 0.82 -0.21 0.00 0.00 178.00 180.01 1ffv h ILE 147 N 0.96 1.25 0.00 4.15 2.04 -1.99 -2.36 117.51 121.56 1ffv h ILE 147 Ca 0.41 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1ffv h ILE 147 Cb 0.34 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1ffv h ILE 147 CO -0.17 0.31 -0.11 0.44 0.00 0.00 0.00 178.15 178.62 1ffv h ASP 148 N 0.51 0.00 0.36 1.72 3.32 -1.88 -2.65 116.42 117.80 1ffv h ASP 148 Ca 0.12 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 1ffv h ASP 148 Cb 0.40 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1ffv h ASP 148 CO 0.01 0.11 -0.44 0.00 -1.72 0.00 0.00 179.24 177.19 1ffv h ALA 149 N 1.89 1.17 -0.00 3.45 0.00 -0.81 -3.03 119.26 121.92 1ffv h ALA 149 Ca -0.00 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1ffv h ALA 149 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ffv h ALA 149 CO 0.01 0.59 -0.19 1.28 0.00 0.00 0.00 179.25 180.94 1ffv n LEU 150 N -4.00 0.54 -4.76 0.00 4.77 -1.00 -4.62 117.00 107.93 1ffv n LEU 150 Ca -0.02 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.58 1ffv n LEU 150 Cb 0.49 -0.22 0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1ffv n LEU 150 CO 0.41 0.11 1.03 -0.54 -1.33 0.00 0.00 177.39 177.07 1ffv s LYS 151 N -2.63 3.47 0.27 3.23 1.02 -1.15 -4.91 119.74 119.04 1ffv s LYS 151 Ca 0.23 2.33 -0.01 0.00 0.02 0.00 0.00 55.97 58.55 1ffv s LYS 151 Cb 0.19 -2.49 0.59 0.00 -0.52 0.00 0.00 37.83 35.60 1ffv s LYS 151 CO 0.53 -0.96 1.69 -1.35 -0.92 0.00 0.00 175.35 174.33 1ffv h PRO 152 N 1.97 0.31 -0.07 -1.68 0.11 -1.91 -0.99 132.00 129.74 1ffv h PRO 152 Ca -0.51 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1ffv h PRO 152 Cb 1.28 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ffv h PRO 152 CO 0.60 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 178.19 1ffv n ASP 153 N -5.12 1.05 -4.73 -2.05 5.75 -1.26 -4.95 116.55 105.24 1ffv n ASP 153 Ca 0.18 -1.51 -0.42 0.00 -0.01 0.00 0.00 54.79 53.03 1ffv n ASP 153 Cb 0.56 -0.04 -0.01 0.00 -1.03 0.00 0.00 41.12 40.59 1ffv n ASP 153 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ffv n ALA 154 N -0.12 1.93 -1.73 2.12 0.00 -0.38 -4.94 120.51 117.39 1ffv n ALA 154 Ca 0.17 0.36 -0.37 0.00 0.00 0.00 0.00 53.44 53.61 1ffv n ALA 154 Cb 0.25 -2.36 0.06 0.00 0.00 0.00 0.00 19.45 17.40 1ffv n ALA 154 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ffv s PRO 155 N -1.47 2.63 -0.44 0.00 0.04 -1.26 -4.94 135.00 129.55 1ffv s PRO 155 Ca 0.58 2.02 -0.28 0.00 0.04 0.00 0.00 61.00 63.36 1ffv s PRO 155 Cb -0.53 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.18 1ffv s PRO 155 CO 0.58 -1.53 1.08 0.08 0.04 0.00 0.00 177.00 177.26 1ffv s VAL 156 N -1.43 4.32 -0.14 -0.36 1.01 -1.26 -4.90 120.40 117.64 1ffv s VAL 156 Ca 0.82 1.23 -0.24 0.00 0.00 0.00 0.00 61.98 63.78 1ffv s VAL 156 Cb -0.36 -4.53 -0.25 0.00 0.00 0.00 0.00 36.38 31.23 1ffv s VAL 156 CO 0.38 -0.87 0.61 -0.07 0.00 0.00 0.00 175.10 175.15 1ffv h LEU 157 N 10.87 0.13 -7.38 3.92 3.38 -1.92 -3.40 115.31 120.91 1ffv h LEU 157 Ca -0.23 -0.85 -0.80 0.00 0.09 0.00 0.00 57.88 56.10 1ffv h LEU 157 Cb 1.06 -0.04 -0.27 0.00 0.09 0.00 0.00 40.66 41.50 1ffv h LEU 157 CO 1.09 1.28 0.64 0.54 0.09 0.00 0.00 178.44 182.08 1ffv n ARG 158 N -4.39 3.78 0.32 1.13 5.12 -1.26 -4.81 116.66 116.55 1ffv n ARG 158 Ca -0.19 -4.42 0.21 0.00 -1.93 0.00 0.00 57.85 51.52 1ffv n ARG 158 Cb 0.65 -2.58 1.03 0.00 -1.16 0.00 0.00 32.46 30.40 1ffv n ARG 158 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1ffv h GLU 159 N 6.34 0.00 0.00 5.56 5.08 -1.97 -1.20 114.58 128.39 1ffv h GLU 159 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1ffv h GLU 159 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1ffv h GLU 159 CO 1.13 0.00 0.00 0.38 -1.00 0.00 0.00 179.01 179.52 1ffv h ASP 160 N 0.00 0.00 -0.57 1.42 2.03 -1.98 -2.89 116.42 114.43 1ffv h ASP 160 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1ffv h ASP 160 Cb 0.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.68 1ffv h ASP 160 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 178.39 1ffv n LEU 161 N -2.70 3.60 -4.70 0.15 4.77 -0.45 -5.01 117.00 112.65 1ffv n LEU 161 Ca 0.03 -1.88 -0.44 0.00 -0.03 0.00 0.00 56.01 53.69 1ffv n LEU 161 Cb 0.36 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 1ffv n LEU 161 CO 0.27 0.87 1.15 0.00 -1.33 0.00 0.00 177.39 178.36 1ffv n ALA 162 N 1.36 1.74 0.00 -1.18 0.00 -1.09 -2.00 120.51 119.34 1ffv n ALA 162 Ca 0.20 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1ffv n ALA 162 Cb 0.57 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1ffv n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffv n GLY 163 N 2.61 2.04 3.79 0.00 0.00 -1.26 -5.04 105.19 107.33 1ffv n GLY 163 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.45 4.47 0.00 1.61 1.02 -0.84 -4.97 119.74 120.57 1ffv s LYS 164 Ca 0.00 1.27 0.00 0.00 0.02 0.00 0.00 55.97 57.26 1ffv s LYS 164 Cb 0.00 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 1ffv s LYS 164 CO 0.00 0.18 0.31 0.25 -0.92 0.00 0.00 175.35 175.17 1ffv n THR 165 N 0.19 0.00 -3.98 2.17 -2.24 -1.26 -4.96 114.28 104.20 1ffv n THR 165 Ca 0.04 -0.50 -0.08 0.00 -2.27 0.00 0.00 64.05 61.24 1ffv n THR 165 Cb 0.51 1.00 -0.09 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.38 0.29 0.00 3.42 1.04 -1.26 -0.71 113.70 116.10 1ffv s SER 166 Ca 0.00 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.59 1ffv s SER 166 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1ffv s SER 166 CO 0.00 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.15 1ffv n GLY 167 N 0.01 6.03 0.07 7.32 0.00 0.10 -4.83 105.19 113.88 1ffv n GLY 167 Ca -0.14 -1.65 0.13 0.00 0.00 0.00 0.00 46.02 44.36 1ffv n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffv n ALA 168 N -3.00 2.40 -1.94 4.61 0.00 -1.26 -3.87 120.51 117.45 1ffv n ALA 168 Ca 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 53.44 53.32 1ffv n ALA 168 Cb 0.00 -1.43 0.11 0.00 0.00 0.00 0.00 19.45 18.13 1ffv n ALA 168 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ffv n HIS 169 N -1.99 0.96 0.00 0.00 8.25 -1.26 -5.05 115.22 116.13 1ffv n HIS 169 Ca 0.06 -1.65 0.00 0.00 -0.26 0.00 0.00 57.72 55.86 1ffv n HIS 169 Cb 0.40 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.25 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 -0.75 -1.19 3.75 -1.41 0.00 -1.25 -4.52 105.19 99.82 1ffv n GLY 170 Ca 0.24 -2.20 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.43 2.55 -0.15 1.61 0.04 -1.26 -0.72 135.00 136.63 1ffv s PRO 171 Ca 0.00 1.55 0.02 0.00 0.04 0.00 0.00 61.00 62.61 1ffv s PRO 171 Cb 0.00 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.65 1ffv s PRO 171 CO 0.00 -1.48 -0.21 1.03 0.04 0.00 0.00 177.00 176.38 1ffv s ARG 172 N -3.99 2.99 0.00 4.56 0.52 0.11 -4.61 118.95 118.53 1ffv s ARG 172 Ca 0.70 -0.84 0.27 0.00 -0.52 0.00 0.00 55.73 55.34 1ffv s ARG 172 Cb -0.24 -2.45 0.89 0.00 0.52 0.00 0.00 34.95 33.66 1ffv s ARG 172 CO 0.42 -0.07 1.65 -0.85 0.02 0.00 0.00 175.30 176.48 1ffv n GLU 173 N 4.21 0.70 -3.70 3.54 0.28 -1.26 -4.70 120.64 119.71 1ffv n GLU 173 Ca -0.20 -0.36 -0.09 0.00 -0.16 0.00 0.00 57.16 56.34 1ffv n GLU 173 Cb 0.51 -1.49 -0.03 0.00 1.43 0.00 0.00 31.44 31.86 1ffv n GLU 173 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1ffv s HIS 174 N -2.55 -0.23 0.06 -1.84 5.04 -1.26 -5.02 115.29 109.49 1ffv s HIS 174 Ca 0.24 -0.11 0.25 0.00 -1.54 0.00 0.00 55.06 53.90 1ffv s HIS 174 Cb 0.19 0.53 0.89 0.00 0.04 0.00 0.00 32.58 34.23 1ffv s HIS 174 CO 0.52 -1.00 1.81 1.12 -2.34 0.00 0.00 174.74 174.85 1ffv h HIS 175 N 2.09 0.00 -0.13 3.88 2.07 -1.93 -3.00 115.15 118.13 1ffv h HIS 175 Ca -0.27 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.25 1ffv h HIS 175 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 1ffv h HIS 175 CO 0.35 0.19 0.00 0.09 -3.07 0.00 0.00 177.93 175.48 1ffv n ASN 176 N -3.30 2.97 -4.69 3.10 3.02 -1.26 -4.68 115.26 110.42 1ffv n ASN 176 Ca 0.01 -1.92 -0.40 0.00 -0.03 0.00 0.00 54.58 52.24 1ffv n ASN 176 Cb 0.44 -0.07 -0.05 0.00 -0.61 0.00 0.00 39.78 39.48 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 -1.68 3.46 -0.20 3.10 2.46 -1.13 -0.67 115.29 120.63 1ffv s HIS 177 Ca 0.29 1.09 -0.16 0.00 0.47 0.00 0.00 55.06 56.74 1ffv s HIS 177 Cb 0.19 -2.82 -0.20 0.00 -0.13 0.00 0.00 32.58 29.62 1ffv s HIS 177 CO 0.28 -0.07 0.17 -0.89 -2.47 0.00 0.00 174.74 171.76 1ffv n ILE 178 N 4.30 1.60 -3.66 0.89 5.41 -0.15 -4.72 119.36 123.02 1ffv n ILE 178 Ca -0.01 -0.25 -0.01 0.00 1.00 0.00 0.00 62.75 63.49 1ffv n ILE 178 Cb 0.50 -1.92 -0.01 0.00 -0.71 0.00 0.00 39.64 37.50 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 -2.44 -0.08 -0.03 1.39 -0.12 -1.24 -4.75 117.98 110.71 1ffv s PHE 179 Ca -0.29 -0.09 -0.00 0.00 -0.05 0.00 0.00 56.93 56.50 1ffv s PHE 179 Cb 0.07 0.58 0.03 0.00 -0.63 0.00 0.00 43.02 43.07 1ffv s PHE 179 CO 0.63 -0.47 0.01 0.99 -0.05 0.00 0.00 175.22 176.32 1ffv s THR 180 N -2.75 0.13 0.00 -4.49 2.01 -1.26 -0.90 115.64 108.39 1ffv s THR 180 Ca 0.13 0.15 0.03 0.00 0.31 0.00 0.00 61.69 62.31 1ffv s THR 180 Cb 0.02 -0.26 -0.01 0.00 0.01 0.00 0.00 72.50 72.26 1ffv s THR 180 CO -0.02 0.15 -0.10 0.86 -0.69 0.00 0.00 174.62 174.82 1ffv s TRP 181 N 1.28 0.93 0.12 4.92 -0.00 0.43 -4.94 118.94 121.69 1ffv s TRP 181 Ca -0.06 -0.21 -0.01 0.00 -0.00 0.00 0.00 56.10 55.82 1ffv s TRP 181 Cb -0.13 -0.59 -0.04 0.00 -0.00 0.00 0.00 33.47 32.71 1ffv s TRP 181 CO -0.02 -0.01 0.03 0.20 -0.00 0.00 0.00 176.95 177.15 1ffv s GLY 182 N -0.41 0.93 0.01 5.86 0.00 -1.26 -0.05 107.32 112.41 1ffv s GLY 182 Ca 0.03 -1.44 -0.20 0.00 0.00 0.00 0.00 44.72 43.11 1ffv s GLY 182 CO -0.00 -1.38 0.44 0.00 0.00 0.00 0.00 173.10 172.16 1ffv s ALA 183 N -3.96 -1.11 0.00 3.20 0.00 -0.89 -5.00 121.76 114.00 1ffv s ALA 183 Ca 0.21 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1ffv s ALA 183 Cb 0.07 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.42 1ffv s ALA 183 CO -0.00 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.77 1ffv n GLY 184 N 0.76 -3.19 3.32 0.00 0.00 -1.26 -1.99 105.19 102.84 1ffv n GLY 184 Ca -0.19 -2.04 -0.44 0.00 0.00 0.00 0.00 46.02 43.35 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 -1.76 6.01 0.16 1.61 -1.08 -0.65 -4.92 116.67 116.04 1ffv s ASP 185 Ca 0.00 -1.56 -0.11 0.00 -0.52 0.00 0.00 52.55 50.36 1ffv s ASP 185 Cb 0.00 -2.13 0.01 0.00 -1.46 0.00 0.00 42.92 39.34 1ffv s ASP 185 CO 0.00 -0.69 1.57 0.50 0.52 0.00 0.00 175.17 177.06 1ffv h LYS 186 N 8.69 0.96 -0.12 4.34 3.64 -1.89 -1.88 116.57 130.30 1ffv h LYS 186 Ca -0.27 -0.37 -0.01 0.00 -1.27 0.00 0.00 60.65 58.73 1ffv h LYS 186 Cb 1.10 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1ffv h LYS 186 CO 0.90 1.04 0.05 0.00 -2.27 0.00 0.00 179.45 179.17 1ffv h ALA 187 N 0.89 0.16 -0.23 5.00 0.00 -1.97 -0.27 119.26 122.84 1ffv h ALA 187 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ffv h ALA 187 Cb 0.69 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1ffv h ALA 187 CO 0.05 -0.26 0.10 0.00 0.00 0.00 0.00 179.25 179.14 1ffv h ALA 188 N 0.91 0.30 -0.45 0.00 0.00 -1.97 -2.13 119.26 115.91 1ffv h ALA 188 Ca 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1ffv h ALA 188 Cb 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ffv h ALA 188 CO -0.00 -0.11 0.25 1.15 0.00 0.00 0.00 179.25 180.53 1ffv h THR 189 N 0.23 1.16 -0.99 0.00 2.02 -1.27 -1.53 112.91 112.53 1ffv h THR 189 Ca 0.08 -0.40 0.03 0.00 0.77 0.00 0.00 66.41 66.89 1ffv h THR 189 Cb 0.16 0.60 -0.06 0.00 -1.74 0.00 0.00 68.15 67.11 1ffv h THR 189 CO -0.01 0.17 0.65 0.44 0.37 0.00 0.00 175.52 177.14 1ffv h ASP 190 N 0.60 1.09 -0.63 4.18 3.32 -0.94 -1.86 116.42 122.17 1ffv h ASP 190 Ca 0.16 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 1ffv h ASP 190 Cb 0.04 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 1ffv h ASP 190 CO -0.03 0.76 0.11 0.00 -1.72 0.00 0.00 179.24 178.36 1ffv h ALA 191 N 1.39 0.96 -0.25 3.45 0.00 -0.85 -1.77 119.26 122.19 1ffv h ALA 191 Ca 0.38 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1ffv h ALA 191 Cb -0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1ffv h ALA 191 CO -0.11 0.65 0.06 0.28 0.00 0.00 0.00 179.25 180.13 1ffv h VAL 192 N 1.00 1.21 -0.19 0.00 2.07 -0.68 -2.79 116.25 116.87 1ffv h VAL 192 Ca 0.20 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.99 1ffv h VAL 192 Cb 0.42 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1ffv h VAL 192 CO 0.01 0.22 -0.06 -0.26 0.02 0.00 0.00 177.57 177.50 1ffv h PHE 193 N 0.23 0.29 -0.12 1.57 0.04 -1.22 0.28 116.94 118.01 1ffv h PHE 193 Ca 0.08 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.73 1ffv h PHE 193 Cb 0.28 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 1ffv h PHE 193 CO 0.01 0.35 -0.33 0.00 -0.60 0.00 0.00 178.31 177.75 1ffv h ALA 194 N 1.67 1.23 -0.01 2.45 0.00 -1.12 -3.23 119.26 120.24 1ffv h ALA 194 Ca 0.06 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ffv h ALA 194 Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ffv h ALA 194 CO 0.01 0.52 -0.34 0.09 0.00 0.00 0.00 179.25 179.53 1ffv n ASN 195 N -4.10 1.31 -4.75 0.00 3.02 -0.94 -5.02 115.26 104.79 1ffv n ASN 195 Ca -0.01 -1.16 -0.41 0.00 -0.03 0.00 0.00 54.58 52.97 1ffv n ASN 195 Cb 0.42 0.56 -0.02 0.00 -0.61 0.00 0.00 39.78 40.13 1ffv n ASN 195 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ffv s ALA 196 N -1.78 3.69 0.17 5.41 0.00 0.95 -4.94 121.76 125.25 1ffv s ALA 196 Ca 0.10 1.46 -0.06 0.00 0.00 0.00 0.00 51.96 53.46 1ffv s ALA 196 Cb 0.11 -3.61 0.04 0.00 0.00 0.00 0.00 23.12 19.66 1ffv s ALA 196 CO 0.38 -0.88 1.47 -1.00 0.00 0.00 0.00 175.76 175.73 1ffv h PRO 197 N 4.84 0.68 -6.45 0.00 0.13 -1.90 -3.44 132.00 125.87 1ffv h PRO 197 Ca -0.47 -0.43 -0.70 0.00 -0.87 0.00 0.00 66.00 63.54 1ffv h PRO 197 Cb 1.22 0.05 -0.30 0.00 0.13 0.00 0.00 31.00 32.10 1ffv h PRO 197 CO 0.78 1.05 -0.88 0.08 -0.23 0.00 0.00 178.00 178.80 1ffv s VAL 198 N -4.05 2.09 -0.01 1.56 1.01 -0.47 -4.98 120.40 115.55 1ffv s VAL 198 Ca -0.09 -1.08 -0.10 0.00 0.00 0.00 0.00 61.98 60.71 1ffv s VAL 198 Cb 0.11 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.77 1ffv s VAL 198 CO 0.86 0.58 0.21 -0.89 0.00 0.00 0.00 175.10 175.86 1ffv s THR 199 N -0.50 0.07 0.04 3.92 2.01 -1.26 -0.64 115.64 119.28 1ffv s THR 199 Ca 0.07 -0.56 -0.05 0.00 0.31 0.00 0.00 61.69 61.45 1ffv s THR 199 Cb -0.11 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 71.89 1ffv s THR 199 CO 0.00 -0.31 0.09 0.68 -0.69 0.00 0.00 174.62 174.40 1ffv s VAL 200 N -1.26 0.14 -0.22 3.82 -7.23 -0.72 -5.01 120.40 109.92 1ffv s VAL 200 Ca -0.13 -1.15 -0.16 0.00 -1.81 0.00 0.00 61.98 58.72 1ffv s VAL 200 Cb -0.06 -0.97 0.06 0.00 0.56 0.00 0.00 36.38 35.97 1ffv s VAL 200 CO 0.03 -0.64 0.56 -0.94 -0.31 0.00 0.00 175.10 173.80 1ffv s SER 201 N -2.24 -0.68 -0.01 4.85 1.04 -1.26 -1.64 113.70 113.76 1ffv s SER 201 Ca -0.03 1.19 -0.01 0.00 0.48 0.00 0.00 55.95 57.57 1ffv s SER 201 Cb -0.00 1.12 0.00 0.00 0.10 0.00 0.00 66.02 67.25 1ffv s SER 201 CO -0.05 -0.21 0.03 -1.58 0.98 0.00 0.00 173.24 172.41 1ffv s GLN 202 N 0.98 0.06 -0.13 4.02 2.00 -0.11 -4.99 119.66 121.49 1ffv s GLN 202 Ca -0.05 0.02 -0.08 0.00 -2.00 0.00 0.00 55.36 53.25 1ffv s GLN 202 Cb -0.05 0.03 -0.04 0.00 0.80 0.00 0.00 33.01 33.74 1ffv s GLN 202 CO -0.09 -0.01 0.15 -1.58 -0.50 0.00 0.00 175.29 173.26 1ffv s HIS 203 N -0.04 3.58 -0.10 1.67 5.65 -1.26 -1.22 115.29 123.56 1ffv s HIS 203 Ca -0.01 0.52 -0.14 0.00 0.25 0.00 0.00 55.06 55.68 1ffv s HIS 203 Cb -0.01 -1.98 0.03 0.00 -1.18 0.00 0.00 32.58 29.45 1ffv s HIS 203 CO 0.00 0.68 0.36 0.00 -0.65 0.00 0.00 174.74 175.13 1ffv s MET 204 N -0.85 0.51 -0.16 2.88 0.23 0.22 -5.01 119.30 117.11 1ffv s MET 204 Ca 0.14 0.32 -0.05 0.00 -1.03 0.00 0.00 55.69 55.07 1ffv s MET 204 Cb -0.12 0.24 -0.03 0.00 -1.53 0.00 0.00 34.83 33.39 1ffv s MET 204 CO 0.03 -0.09 0.00 -0.47 -2.03 0.00 0.00 175.02 172.47 1ffv s TYR 205 N -0.24 3.12 -0.70 3.16 5.04 -1.26 -0.75 117.35 125.72 1ffv s TYR 205 Ca -0.04 -0.13 -0.10 0.00 -2.44 0.00 0.00 57.07 54.36 1ffv s TYR 205 Cb -0.03 -2.00 0.18 0.00 0.35 0.00 0.00 41.96 40.46 1ffv s TYR 205 CO 0.02 0.06 0.60 -0.47 -1.34 0.00 0.00 175.55 174.41 1ffv s TYR 206 N 0.33 3.58 0.55 4.97 6.14 0.31 -4.40 117.35 128.82 1ffv s TYR 206 Ca -0.01 -2.13 -0.20 0.00 0.64 0.00 0.00 57.07 55.37 1ffv s TYR 206 Cb -0.13 -3.60 -0.06 0.00 0.42 0.00 0.00 41.96 38.58 1ffv s TYR 206 CO 0.02 -0.95 1.02 -0.35 0.64 0.00 0.00 175.55 175.93 1ffv n PRO 207 N 4.05 1.13 -1.92 4.97 -0.04 -1.26 -0.70 135.00 141.23 1ffv n PRO 207 Ca 0.07 0.42 -0.42 0.00 -0.04 0.00 0.00 63.50 63.53 1ffv n PRO 207 Cb 0.43 -2.19 -0.03 0.00 -0.04 0.00 0.00 33.50 31.67 1ffv n PRO 207 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1ffv s ARG 208 N -2.58 4.19 0.33 0.54 3.52 -1.26 -3.78 118.95 119.92 1ffv s ARG 208 Ca 0.72 2.33 0.03 0.00 -0.13 0.00 0.00 55.73 58.68 1ffv s ARG 208 Cb -0.45 -3.69 -0.04 0.00 -1.56 0.00 0.00 34.95 29.22 1ffv s ARG 208 CO 0.50 -0.76 0.13 0.14 -0.81 0.00 0.00 175.30 174.50 1ffv s VAL 209 N 2.94 0.55 -0.03 7.11 -7.23 -0.42 -2.79 120.40 120.52 1ffv s VAL 209 Ca 0.75 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.95 1ffv s VAL 209 Cb -0.39 -2.52 -0.00 0.00 0.56 0.00 0.00 36.38 34.02 1ffv s VAL 209 CO 0.33 0.00 -0.13 -2.28 -0.31 0.00 0.00 175.10 172.70 1ffv s HIS 210 N -3.46 1.33 0.46 2.82 2.46 -1.26 -0.00 115.29 117.63 1ffv s HIS 210 Ca 0.33 -0.35 0.15 0.00 0.47 0.00 0.00 55.06 55.66 1ffv s HIS 210 Cb 0.05 -0.91 1.11 0.00 -0.13 0.00 0.00 32.58 32.70 1ffv s HIS 210 CO 0.16 -0.12 2.02 -1.00 -2.47 0.00 0.00 174.74 173.33 1ffv h PRO 211 N 6.27 0.28 -6.95 2.88 0.13 -1.88 -3.47 132.00 129.26 1ffv h PRO 211 Ca -0.33 -0.02 -0.57 0.00 -0.87 0.00 0.00 66.00 64.21 1ffv h PRO 211 Cb 1.17 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1ffv h PRO 211 CO 0.48 0.19 -1.00 0.00 -0.23 0.00 0.00 178.00 177.44 1ffv s PRO 213 N -7.01 3.72 0.25 0.00 0.04 -1.26 -4.89 135.00 125.85 1ffv s PRO 213 Ca 0.40 2.17 -0.04 0.00 0.04 0.00 0.00 61.00 63.57 1ffv s PRO 213 Cb -0.22 -2.59 0.42 0.00 0.04 0.00 0.00 34.50 32.14 1ffv s PRO 213 CO 0.93 -0.70 1.79 1.25 0.04 0.00 0.00 177.00 180.31 1ffv h LEU 214 N 2.29 0.58 -9.20 -3.56 5.85 -1.88 -3.35 115.31 106.03 1ffv h LEU 214 Ca -0.50 0.06 -0.58 0.00 0.84 0.00 0.00 57.88 57.70 1ffv h LEU 214 Cb 1.26 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.17 1ffv h LEU 214 CO 0.61 0.31 0.10 -0.70 -0.34 0.00 0.00 178.44 178.42 1ffv s GLU 215 N -6.02 4.28 0.77 1.25 2.12 -1.10 -5.06 118.70 114.94 1ffv s GLU 215 Ca -0.12 0.68 -0.13 0.00 0.36 0.00 0.00 54.97 55.76 1ffv s GLU 215 Cb 0.20 -3.53 0.18 0.00 0.26 0.00 0.00 34.13 31.24 1ffv s GLU 215 CO 0.78 -0.14 0.90 0.25 -0.54 0.00 0.00 175.26 176.50 1ffv n THR 216 N 4.39 0.00 -2.84 -1.70 -2.24 -1.26 -4.85 114.28 105.78 1ffv n THR 216 Ca -0.02 -0.57 -0.33 0.00 -2.27 0.00 0.00 64.05 60.86 1ffv n THR 216 Cb 0.50 -1.47 -0.07 0.00 -2.10 0.00 0.00 70.33 67.19 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 -0.38 -0.00 0.00 0.00 -1.26 -2.13 107.32 101.43 1ffv s GLY 218 Ca 0.60 0.60 -0.28 0.00 0.00 0.00 0.00 44.72 45.63 1ffv s GLY 218 CO 0.15 0.31 0.82 0.00 0.00 0.00 0.00 173.10 174.38 1ffv s VAL 220 N -2.64 1.93 -0.18 0.00 1.01 -0.01 -0.58 120.40 119.94 1ffv s VAL 220 Ca 0.01 -1.80 -0.15 0.00 0.00 0.00 0.00 61.98 60.04 1ffv s VAL 220 Cb -0.01 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 1ffv s VAL 220 CO -0.05 -0.34 0.34 0.00 0.00 0.00 0.00 175.10 175.04 1ffv s ALA 221 N 1.14 3.57 -0.27 5.51 0.00 -0.01 -1.42 121.76 130.28 1ffv s ALA 221 Ca 0.02 -0.50 -0.02 0.00 0.00 0.00 0.00 51.96 51.45 1ffv s ALA 221 Cb -0.19 -2.51 0.09 0.00 0.00 0.00 0.00 23.12 20.51 1ffv s ALA 221 CO -0.09 -0.11 0.09 0.45 0.00 0.00 0.00 175.76 176.11 1ffv s SER 222 N 0.78 3.54 -0.23 0.00 0.15 0.43 -0.82 113.70 117.55 1ffv s SER 222 Ca 0.18 -1.29 -0.14 0.00 0.70 0.00 0.00 55.95 55.39 1ffv s SER 222 Cb -0.14 -0.63 -0.04 0.00 -1.71 0.00 0.00 66.02 63.50 1ffv s SER 222 CO 0.06 -0.39 0.33 0.12 1.20 0.00 0.00 173.24 174.56 1ffv s PHE 223 N 1.83 3.33 -0.47 3.44 5.36 -1.26 -0.83 117.98 129.38 1ffv s PHE 223 Ca 0.06 0.46 -0.14 0.00 -0.96 0.00 0.00 56.93 56.35 1ffv s PHE 223 Cb -0.17 -2.47 0.08 0.00 -0.34 0.00 0.00 43.02 40.12 1ffv s PHE 223 CO -0.23 -0.04 0.38 0.34 -1.46 0.00 0.00 175.22 174.20 1ffv s ASP 224 N 1.20 6.06 0.60 6.13 2.15 0.32 -4.13 116.67 129.00 1ffv s ASP 224 Ca 0.15 -1.39 0.35 0.00 0.43 0.00 0.00 52.55 52.09 1ffv s ASP 224 Cb -0.15 -2.15 1.93 0.00 -0.30 0.00 0.00 42.92 42.25 1ffv s ASP 224 CO 0.08 -0.64 2.23 1.55 -0.17 0.00 0.00 175.17 178.22 1ffv h PRO 225 N 8.70 0.00 -0.00 4.34 0.13 -1.86 0.48 132.00 143.80 1ffv h PRO 225 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 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 0.87 0.03 -0.00 0.82 -0.23 0.00 0.00 178.00 179.48 1ffv h ILE 226 N 0.00 1.45 0.00 -3.56 2.04 -1.96 -3.27 117.51 112.21 1ffv h ILE 226 Ca -0.00 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.53 1ffv h ILE 226 Cb 0.13 2.35 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1ffv h ILE 226 CO 0.00 0.35 -0.57 0.11 0.00 0.00 0.00 178.15 178.03 1ffv h LYS 227 N -0.56 0.00 -0.15 2.37 1.57 -1.93 -3.47 116.57 114.39 1ffv h LYS 227 Ca 0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1ffv h LYS 227 Cb 0.57 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.85 1ffv h LYS 227 CO 0.00 0.00 -0.06 0.41 -0.57 0.00 0.00 179.45 179.23 1ffv n GLY 228 N 1.26 0.63 3.42 3.86 0.00 0.17 -5.04 105.19 109.49 1ffv n GLY 228 Ca 0.03 -0.91 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.94 2.98 -0.12 1.61 1.47 -1.11 -4.95 116.67 113.61 1ffv s ASP 229 Ca 0.00 -1.11 0.01 0.00 1.18 0.00 0.00 52.55 52.63 1ffv s ASP 229 Cb 0.00 -0.20 -0.01 0.00 -0.34 0.00 0.00 42.92 42.36 1ffv s ASP 229 CO 0.00 -0.20 -0.16 -0.22 0.68 0.00 0.00 175.17 175.27 1ffv s LEU 230 N -3.44 2.53 -0.13 2.11 2.96 -0.57 -0.52 118.68 121.62 1ffv s LEU 230 Ca 0.28 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.81 1ffv s LEU 230 Cb 0.01 -1.55 0.02 0.00 0.50 0.00 0.00 46.19 45.16 1ffv s LEU 230 CO 0.11 0.16 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.25 1ffv s THR 231 N 0.34 1.66 -0.14 3.68 2.01 -0.01 0.05 115.64 123.23 1ffv s THR 231 Ca -0.13 -0.73 -0.00 0.00 0.31 0.00 0.00 61.69 61.13 1ffv s THR 231 Cb -0.17 -1.51 0.03 0.00 0.01 0.00 0.00 72.50 70.86 1ffv s THR 231 CO 0.07 0.47 -0.07 -0.89 -0.69 0.00 0.00 174.62 173.51 1ffv s THR 232 N 1.05 1.10 -0.17 -0.82 2.01 -0.02 -0.43 115.64 118.36 1ffv s THR 232 Ca -0.04 -0.45 -0.20 0.00 0.31 0.00 0.00 61.69 61.31 1ffv s THR 232 Cb -0.15 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 1ffv s THR 232 CO -0.04 0.28 0.60 -0.31 -0.69 0.00 0.00 174.62 174.46 1ffv s TYR 233 N 1.66 3.41 0.02 4.92 1.51 -0.51 -0.73 117.35 127.64 1ffv s TYR 233 Ca 0.03 0.93 -0.10 0.00 -1.01 0.00 0.00 57.07 56.93 1ffv s TYR 233 Cb -0.14 -2.75 0.01 0.00 -0.11 0.00 0.00 41.96 38.97 1ffv s TYR 233 CO -0.08 -0.09 0.19 -1.50 -1.11 0.00 0.00 175.55 172.96 1ffv s ILE 234 N 1.58 0.09 -1.29 2.71 2.07 -0.30 -0.83 121.20 125.24 1ffv s ILE 234 Ca 0.29 -0.77 -0.15 0.00 -1.41 0.00 0.00 60.65 58.60 1ffv s ILE 234 Cb -0.16 -0.71 0.11 0.00 0.13 0.00 0.00 42.46 41.83 1ffv s ILE 234 CO 0.11 -0.42 1.70 0.35 -1.91 0.00 0.00 174.94 174.77 1ffv n THR 235 N 1.02 4.03 -5.26 4.00 -2.24 -0.87 -4.18 114.28 110.78 1ffv n THR 235 Ca -0.21 -4.22 -0.31 0.00 -2.27 0.00 0.00 64.05 57.04 1ffv n THR 235 Cb 0.57 -2.42 -0.16 0.00 -2.10 0.00 0.00 70.33 66.22 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 3.40 3.02 0.00 3.42 0.15 -1.26 -4.80 113.70 117.62 1ffv s SER 236 Ca 0.48 -0.49 0.22 0.00 0.70 0.00 0.00 55.95 56.87 1ffv s SER 236 Cb 0.03 -0.68 0.70 0.00 -1.71 0.00 0.00 66.02 64.36 1ffv s SER 236 CO 0.03 0.26 1.53 0.00 1.20 0.00 0.00 173.24 176.27 1ffv n GLN 237 N 2.81 1.88 -2.84 5.44 6.02 0.26 -4.37 117.38 126.58 1ffv n GLN 237 Ca -0.17 -1.32 -0.11 0.00 -0.01 0.00 0.00 57.00 55.39 1ffv n GLN 237 Cb 0.52 -1.43 0.04 0.00 1.02 0.00 0.00 30.24 30.39 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 0.55 -0.45 -0.18 -1.58 0.00 -1.26 -1.35 120.51 116.23 1ffv n ALA 238 Ca 0.17 -1.84 0.05 0.00 0.00 0.00 0.00 53.44 51.82 1ffv n ALA 238 Cb 0.39 -1.18 0.33 0.00 0.00 0.00 0.00 19.45 18.99 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 3.63 0.78 -0.27 0.00 0.13 -1.90 -2.09 132.00 132.28 1ffv h PRO 239 Ca -0.09 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.95 1ffv h PRO 239 Cb 1.03 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1ffv h PRO 239 CO 0.30 0.52 -0.01 0.45 -0.23 0.00 0.00 178.00 179.03 1ffv h HIS 240 N 0.80 0.52 -0.11 1.56 3.86 -1.91 0.10 115.15 119.97 1ffv h HIS 240 Ca 0.30 -0.09 -0.11 0.00 -1.16 0.00 0.00 60.37 59.30 1ffv h HIS 240 Cb 0.17 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 1ffv h HIS 240 CO -0.00 0.64 -0.43 -0.39 0.86 0.00 0.00 177.93 178.61 1ffv h VAL 241 N 0.26 1.32 -0.46 2.45 -1.51 -1.74 -2.01 116.25 114.55 1ffv h VAL 241 Ca 0.07 -1.58 0.02 0.00 -1.23 0.00 0.00 66.70 63.98 1ffv h VAL 241 Cb 0.44 1.71 -0.03 0.00 -2.13 0.00 0.00 31.29 31.28 1ffv h VAL 241 CO 0.02 0.47 0.28 0.58 -1.23 0.00 0.00 177.57 177.69 1ffv h VAL 242 N 0.22 1.06 -0.38 7.19 2.07 -1.14 0.16 116.25 125.42 1ffv h VAL 242 Ca 0.02 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1ffv h VAL 242 Cb 0.86 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1ffv h VAL 242 CO 0.07 0.10 0.15 -0.09 0.02 0.00 0.00 177.57 177.82 1ffv h ARG 243 N 0.56 0.31 -0.53 1.57 2.43 -0.56 0.27 114.38 118.43 1ffv h ARG 243 Ca 0.18 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1ffv h ARG 243 Cb 0.00 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1ffv h ARG 243 CO -0.08 0.21 0.32 1.15 -1.51 0.00 0.00 179.97 180.06 1ffv h THR 244 N 0.32 1.16 -0.13 0.20 2.02 -0.60 -0.91 112.91 114.97 1ffv h THR 244 Ca 0.17 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1ffv h THR 244 Cb 0.13 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1ffv h THR 244 CO -0.16 0.17 0.00 0.58 0.37 0.00 0.00 175.52 176.48 1ffv h VAL 245 N 0.72 1.25 -0.56 3.16 2.07 -0.20 -2.24 116.25 120.45 1ffv h VAL 245 Ca 0.19 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1ffv h VAL 245 Cb -0.01 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 1ffv h VAL 245 CO -0.04 0.24 0.36 0.58 0.02 0.00 0.00 177.57 178.73 1ffv h VAL 246 N -0.03 1.15 -0.20 2.57 2.07 -0.35 -0.85 116.25 120.61 1ffv h VAL 246 Ca 0.04 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1ffv h VAL 246 Cb 0.36 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1ffv h VAL 246 CO 0.01 0.15 0.03 -1.28 0.02 0.00 0.00 177.57 176.49 1ffv h SER 247 N 0.76 0.32 -0.03 0.57 0.87 -1.02 -1.52 113.55 113.50 1ffv h SER 247 Ca 0.20 -0.27 0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1ffv h SER 247 Cb -0.07 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 1ffv h SER 247 CO -0.04 0.51 -0.01 0.24 -0.53 0.00 0.00 176.83 176.99 1ffv h MET 248 N 0.12 -0.01 0.00 2.24 2.86 -0.89 -0.26 114.93 118.99 1ffv h MET 248 Ca 0.06 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.62 1ffv h MET 248 Cb 0.33 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1ffv h MET 248 CO 0.00 -0.00 -0.39 -0.07 1.06 0.00 0.00 176.91 177.51 1ffv h LEU 249 N -0.01 0.00 0.00 1.22 3.38 -1.16 -3.30 115.31 115.45 1ffv h LEU 249 Ca 0.02 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1ffv h LEU 249 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1ffv h LEU 249 CO -0.04 0.39 -1.83 -1.54 0.09 0.00 0.00 178.44 175.51 1ffv n SER 250 N -3.74 0.21 0.00 -0.43 3.41 -0.58 -4.97 113.62 107.52 1ffv n SER 250 Ca -0.01 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1ffv n SER 250 Cb 0.47 1.48 0.00 0.00 -0.26 0.00 0.00 64.21 65.90 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 1.32 1.65 3.69 5.00 0.00 -0.12 -5.01 105.19 111.73 1ffv n GLY 251 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.86 4.23 0.26 -0.61 1.01 -1.22 -4.96 121.20 117.05 1ffv s ILE 252 Ca 0.00 1.57 -0.31 0.00 0.00 0.00 0.00 60.65 61.91 1ffv s ILE 252 Cb 0.00 -4.01 -0.13 0.00 0.01 0.00 0.00 42.46 38.33 1ffv s ILE 252 CO 0.00 0.02 1.41 -0.81 0.00 0.00 0.00 174.94 175.56 1ffv n PRO 253 N 5.00 2.11 -0.35 2.79 -0.04 -1.26 -4.59 135.00 138.66 1ffv n PRO 253 Ca 0.11 0.75 0.23 0.00 -0.04 0.00 0.00 63.50 64.55 1ffv n PRO 253 Cb 0.46 -2.41 0.49 0.00 -0.04 0.00 0.00 33.50 32.01 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 4.04 0.38 0.00 0.54 4.81 -1.92 0.51 114.58 122.94 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 1.27 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1ffv h GLU 254 CO 0.74 0.25 0.00 0.66 -0.73 0.00 0.00 179.01 179.93 1ffv h SER 255 N 0.39 0.00 -0.58 1.04 4.64 -1.99 -1.43 113.55 115.62 1ffv h SER 255 Ca 0.65 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 1ffv h SER 255 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1ffv h SER 255 CO -0.39 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.86 1ffv n LYS 256 N -2.78 2.63 -4.59 4.77 5.02 0.17 -4.85 118.16 118.53 1ffv n LYS 256 Ca -0.00 -2.50 -0.33 0.00 -2.02 0.00 0.00 58.31 53.46 1ffv n LYS 256 Cb 0.19 -1.54 -0.15 0.00 -0.02 0.00 0.00 35.03 33.51 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 -1.20 2.89 -0.16 -0.18 1.01 -0.54 -1.52 120.40 120.70 1ffv s VAL 257 Ca 0.44 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1ffv s VAL 257 Cb 0.24 -2.23 0.04 0.00 0.00 0.00 0.00 36.38 34.43 1ffv s VAL 257 CO 0.32 0.51 -0.09 -0.60 0.00 0.00 0.00 175.10 175.25 1ffv s ARG 258 N 0.66 1.80 -0.16 2.72 3.52 0.11 -4.90 118.95 122.70 1ffv s ARG 258 Ca -0.07 -0.58 -0.04 0.00 -0.13 0.00 0.00 55.73 54.91 1ffv s ARG 258 Cb -0.15 -2.08 -0.03 0.00 -1.56 0.00 0.00 34.95 31.13 1ffv s ARG 258 CO 0.02 -0.37 -0.03 0.42 -0.81 0.00 0.00 175.30 174.54 1ffv s ILE 259 N 1.55 3.93 -0.10 4.11 1.09 -1.26 -0.84 121.20 129.68 1ffv s ILE 259 Ca 0.02 -0.34 -0.00 0.00 -1.10 0.00 0.00 60.65 59.22 1ffv s ILE 259 Cb -0.15 -2.73 0.02 0.00 -1.06 0.00 0.00 42.46 38.55 1ffv s ILE 259 CO -0.09 0.49 -0.06 0.54 -0.10 0.00 0.00 174.94 175.72 1ffv s VAL 260 N 0.43 0.89 -0.43 2.92 0.11 0.09 -1.88 120.40 122.53 1ffv s VAL 260 Ca -0.03 -0.22 -0.20 0.00 -2.93 0.00 0.00 61.98 58.59 1ffv s VAL 260 Cb -0.14 -0.93 0.02 0.00 -1.53 0.00 0.00 36.38 33.80 1ffv s VAL 260 CO 0.03 0.34 0.62 -0.44 -3.33 0.00 0.00 175.10 172.32 1ffv s SER 261 N 1.62 6.32 0.00 3.54 0.01 -0.18 -1.15 113.70 123.85 1ffv s SER 261 Ca 0.02 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 56.94 1ffv s SER 261 Cb -0.13 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.79 1ffv s SER 261 CO -0.06 -0.75 0.00 -0.81 0.41 0.00 0.00 173.24 172.03 1ffv n PRO 262 N 6.18 3.52 -2.42 12.44 -0.04 -1.26 -4.53 135.00 148.90 1ffv n PRO 262 Ca -0.02 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.03 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 7.14 -0.16 3.54 1.01 -0.30 -5.01 116.67 121.89 1ffv s ASP 263 Ca 0.00 2.16 0.01 0.00 0.71 0.00 0.00 52.55 55.43 1ffv s ASP 263 Cb 0.00 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.34 1ffv s ASP 263 CO 0.00 -0.34 -0.19 -0.63 0.21 0.00 0.00 175.17 174.22 1ffv s ILE 264 N 0.04 2.23 -1.02 0.77 1.01 -1.26 -4.06 121.20 118.91 1ffv s ILE 264 Ca 0.53 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 60.20 1ffv s ILE 264 Cb -0.31 -1.92 -0.09 0.00 0.01 0.00 0.00 42.46 40.15 1ffv s ILE 264 CO 0.35 0.53 2.50 0.61 0.00 0.00 0.00 174.94 178.94 1ffv n GLY 265 N 4.27 3.40 0.00 6.18 0.00 -1.26 -4.43 105.19 113.35 1ffv n GLY 265 Ca -0.20 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.75 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 3.53 -0.62 1.05 -0.02 0.00 -1.16 -2.72 105.19 105.24 1ffv n GLY 266 Ca 0.54 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.48 -0.03 2.93 -0.02 0.00 -1.26 -4.74 105.19 102.54 1ffv n GLY 267 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.40 -1.68 0.00 1.61 3.72 -1.26 -1.23 117.46 115.22 1ffv n PHE 268 Ca 0.00 0.32 0.00 0.00 -0.05 0.00 0.00 57.45 57.72 1ffv n PHE 268 Cb 0.10 -3.51 0.00 0.00 -0.94 0.00 0.00 39.48 35.13 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 -1.18 2.44 0.20 1.37 0.00 -1.26 0.41 105.19 107.18 1ffv n GLY 269 Ca -0.10 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.52 1.61 -1.24 -1.48 -3.28 115.58 110.67 1ffv h ASN 270 Ca 0.00 0.00 -0.25 0.00 0.71 0.00 0.00 56.30 56.76 1ffv h ASN 270 Cb 0.00 0.00 -0.15 0.00 0.73 0.00 0.00 38.32 38.90 1ffv h ASN 270 CO 0.00 0.29 0.12 0.29 -1.29 0.00 0.00 177.43 176.84 1ffv n LYS 271 N -3.42 2.09 -0.03 6.67 5.02 -1.25 -4.56 118.16 122.68 1ffv n LYS 271 Ca 0.00 -3.12 -0.17 0.00 -2.02 0.00 0.00 58.31 53.00 1ffv n LYS 271 Cb 0.48 -1.92 -0.14 0.00 -0.02 0.00 0.00 35.03 33.43 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 1.12 1.63 -3.73 -0.18 2.07 -1.88 0.76 116.25 116.04 1ffv h VAL 272 Ca 0.31 -2.41 -0.45 0.00 0.82 0.00 0.00 66.70 64.97 1ffv h VAL 272 Cb 1.97 3.25 0.13 0.00 -1.52 0.00 0.00 31.29 35.12 1ffv h VAL 272 CO 0.57 0.64 0.34 -0.83 0.02 0.00 0.00 177.57 178.31 1ffv s GLY 273 N -4.35 1.74 -0.23 2.17 0.00 -1.26 -4.53 107.32 100.85 1ffv s GLY 273 Ca -0.18 -1.20 -0.12 0.00 0.00 0.00 0.00 44.72 43.23 1ffv s GLY 273 CO 0.74 -0.54 0.22 -0.42 0.00 0.00 0.00 173.10 173.09 1ffv s ILE 274 N -3.64 5.32 0.15 0.90 1.01 -1.26 -4.96 121.20 118.72 1ffv s ILE 274 Ca 0.70 0.31 0.03 0.00 0.00 0.00 0.00 60.65 61.68 1ffv s ILE 274 Cb -0.06 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1ffv s ILE 274 CO 0.50 0.32 0.26 -0.31 0.00 0.00 0.00 174.94 175.71 1ffv s TYR 275 N 1.12 3.44 0.45 3.97 2.02 -1.26 -5.00 117.35 122.08 1ffv s TYR 275 Ca 0.10 0.10 0.21 0.00 -0.37 0.00 0.00 57.07 57.11 1ffv s TYR 275 Cb -0.14 -1.65 1.18 0.00 -0.40 0.00 0.00 41.96 40.96 1ffv s TYR 275 CO 0.05 0.52 1.87 -1.00 -1.57 0.00 0.00 175.55 175.42 1ffv h PRO 276 N 2.19 0.29 -0.86 -1.71 0.13 -1.88 -1.18 132.00 128.98 1ffv h PRO 276 Ca -0.48 -0.02 0.07 0.00 -0.87 0.00 0.00 66.00 64.70 1ffv h PRO 276 Cb 1.19 -0.07 -0.07 0.00 0.13 0.00 0.00 31.00 32.19 1ffv h PRO 276 CO 0.68 0.19 0.52 0.78 -0.23 0.00 0.00 178.00 179.95 1ffv h GLY 277 N 0.30 1.31 0.81 1.56 0.00 -1.94 -1.05 103.07 104.06 1ffv h GLY 277 Ca 0.45 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 1ffv h GLY 277 CO -0.14 0.23 0.02 -0.97 0.00 0.00 0.00 176.54 175.68 1ffv h TYR 278 N 0.93 0.16 -0.63 5.60 0.05 -1.61 -2.01 116.97 119.46 1ffv h TYR 278 Ca 0.39 -0.02 0.01 0.00 0.05 0.00 0.00 58.73 59.16 1ffv h TYR 278 Cb 0.23 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 37.89 1ffv h TYR 278 CO -0.04 0.33 0.41 0.28 -1.05 0.00 0.00 178.16 178.09 1ffv h VAL 279 N -0.05 1.15 -0.69 -2.88 2.07 -1.41 -1.23 116.25 113.21 1ffv h VAL 279 Ca 0.03 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1ffv h VAL 279 Cb 0.25 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1ffv h VAL 279 CO 0.00 0.15 0.30 0.00 0.02 0.00 0.00 177.57 178.04 1ffv h ALA 281 N 1.14 0.96 0.02 0.00 0.00 -1.06 0.18 119.26 120.51 1ffv h ALA 281 Ca 0.23 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ffv h ALA 281 Cb 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ffv h ALA 281 CO -0.02 0.65 -0.01 0.82 0.00 0.00 0.00 179.25 180.68 1ffv h ILE 282 N 1.09 1.14 -0.21 0.00 2.04 -0.79 -0.83 117.51 119.95 1ffv h ILE 282 Ca 0.24 -0.47 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1ffv h ILE 282 Cb 0.31 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1ffv h ILE 282 CO -0.01 0.12 0.10 0.58 0.00 0.00 0.00 178.15 178.94 1ffv h VAL 283 N -0.23 0.99 -1.00 1.67 2.07 -0.66 -1.13 116.25 117.95 1ffv h VAL 283 Ca -0.00 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.51 1ffv h VAL 283 Cb 0.22 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 1ffv h VAL 283 CO 0.00 0.04 0.65 0.00 0.02 0.00 0.00 177.57 178.28 1ffv h ALA 284 N 1.11 1.40 -0.48 1.67 0.00 -0.56 -0.81 119.26 121.60 1ffv h ALA 284 Ca 0.09 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1ffv h ALA 284 Cb 0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1ffv h ALA 284 CO -0.06 0.45 -0.08 1.03 0.00 0.00 0.00 179.25 180.59 1ffv h SER 285 N 1.18 0.89 -0.76 0.00 0.87 -0.59 -0.47 113.55 114.67 1ffv h SER 285 Ca 0.43 -0.35 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 1ffv h SER 285 Cb 0.16 -0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 61.84 1ffv h SER 285 CO -0.17 1.03 0.38 0.40 -0.53 0.00 0.00 176.83 177.94 1ffv h ILE 286 N 0.74 1.24 -0.17 2.23 2.04 -0.52 0.13 117.51 123.20 1ffv h ILE 286 Ca 0.12 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.28 1ffv h ILE 286 Cb 0.62 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1ffv h ILE 286 CO 0.04 0.28 -0.13 0.58 0.00 0.00 0.00 178.15 178.91 1ffv h VAL 287 N 1.06 1.33 0.00 1.67 2.07 -1.01 -3.28 116.25 118.09 1ffv h VAL 287 Ca 0.26 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1ffv h VAL 287 Cb 0.09 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1ffv h VAL 287 CO -0.04 0.37 -0.32 0.18 0.02 0.00 0.00 177.57 177.79 1ffv n LEU 288 N -4.55 0.39 -1.96 2.57 4.77 -0.20 -4.95 117.00 113.06 1ffv n LEU 288 Ca -0.06 0.23 -0.17 0.00 -0.03 0.00 0.00 56.01 55.99 1ffv n LEU 288 Cb 0.35 -0.33 -0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1ffv n LEU 288 CO 0.39 0.04 -0.18 0.61 -1.33 0.00 0.00 177.39 176.92 1ffv n GLY 289 N 1.46 -0.30 3.48 -0.72 0.00 0.43 -4.99 105.19 104.55 1ffv n GLY 289 Ca 0.06 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 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 -4.91 1.33 0.28 1.61 1.70 -1.17 -4.77 118.95 113.02 1ffv s ARG 290 Ca 0.03 -0.76 -0.30 0.00 -0.47 0.00 0.00 55.73 54.23 1ffv s ARG 290 Cb -0.01 0.53 -0.12 0.00 -0.57 0.00 0.00 34.95 34.77 1ffv s ARG 290 CO 0.04 -0.57 1.49 -2.30 -1.08 0.00 0.00 175.30 172.88 1ffv n PRO 291 N -0.34 2.38 -4.02 3.89 -0.02 -1.26 -4.46 135.00 131.17 1ffv n PRO 291 Ca -0.12 0.84 -0.28 0.00 -2.02 0.00 0.00 63.50 61.92 1ffv n PRO 291 Cb 0.63 -2.55 -0.17 0.00 -0.02 0.00 0.00 33.50 31.39 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 -0.18 1.27 -0.18 -1.45 1.01 0.00 -0.07 120.40 120.79 1ffv s VAL 292 Ca 0.64 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 62.08 1ffv s VAL 292 Cb -0.56 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1ffv s VAL 292 CO 0.51 0.41 0.12 -0.75 0.00 0.00 0.00 175.10 175.38 1ffv s LYS 293 N 1.53 4.02 -0.09 2.72 2.20 0.27 -0.83 119.74 129.56 1ffv s LYS 293 Ca 0.03 -0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.42 1ffv s LYS 293 Cb -0.13 -3.34 0.02 0.00 -1.51 0.00 0.00 37.83 32.87 1ffv s LYS 293 CO -0.08 0.38 -0.09 -0.46 -0.36 0.00 0.00 175.35 174.74 1ffv s TRP 294 N 0.11 1.43 -0.16 4.03 -0.00 0.25 -0.85 118.94 123.76 1ffv s TRP 294 Ca 0.08 -0.64 -0.05 0.00 -0.00 0.00 0.00 56.10 55.49 1ffv s TRP 294 Cb -0.11 -1.15 0.06 0.00 -0.00 0.00 0.00 33.47 32.26 1ffv s TRP 294 CO -0.01 -0.42 0.08 0.08 -0.00 0.00 0.00 176.95 176.68 1ffv s VAL 295 N 1.34 -0.05 0.69 5.86 1.01 -1.26 -0.37 120.40 127.61 1ffv s VAL 295 Ca -0.02 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.72 1ffv s VAL 295 Cb -0.14 -0.55 0.01 0.00 0.00 0.00 0.00 36.38 35.70 1ffv s VAL 295 CO -0.04 -0.22 1.07 -1.83 0.00 0.00 0.00 175.10 174.07 1ffv s GLU 296 N 2.13 2.86 0.48 2.72 -1.05 -0.90 -5.03 118.70 119.91 1ffv s GLU 296 Ca 0.02 1.08 -0.01 0.00 -0.15 0.00 0.00 54.97 55.92 1ffv s GLU 296 Cb -0.16 -1.98 0.00 0.00 -0.44 0.00 0.00 34.13 31.56 1ffv s GLU 296 CO -0.08 -1.16 0.72 -0.51 0.95 0.00 0.00 175.26 175.17 1ffv s ASP 297 N -3.42 5.72 0.25 0.83 1.01 -1.26 -4.75 116.67 115.05 1ffv s ASP 297 Ca 0.60 0.32 -0.03 0.00 0.71 0.00 0.00 52.55 54.15 1ffv s ASP 297 Cb -0.15 -1.48 0.47 0.00 1.01 0.00 0.00 42.92 42.77 1ffv s ASP 297 CO 0.51 -0.81 1.75 -0.09 0.21 0.00 0.00 175.17 176.73 1ffv h ARG 298 N 0.27 0.52 -0.52 8.23 9.65 -1.97 -1.32 114.38 129.24 1ffv h ARG 298 Ca -0.45 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.37 1ffv h ARG 298 Cb 1.26 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 29.70 1ffv h ARG 298 CO 0.57 0.34 0.22 -0.24 2.80 0.00 0.00 179.97 183.67 1ffv h VAL 299 N 0.54 1.19 -0.22 0.20 3.04 -1.96 -1.88 116.25 117.15 1ffv h VAL 299 Ca 0.42 -0.56 -0.19 0.00 -1.01 0.00 0.00 66.70 65.36 1ffv h VAL 299 Cb 0.60 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1ffv h VAL 299 CO -0.37 0.22 -0.63 -0.33 -1.01 0.00 0.00 177.57 175.46 1ffv h GLU 300 N 0.74 0.78 0.43 4.17 5.08 -1.59 -2.00 114.58 122.19 1ffv h GLU 300 Ca 0.18 -0.54 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 1ffv h GLU 300 Cb 0.12 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1ffv h GLU 300 CO -0.02 1.17 -0.27 -0.97 -1.00 0.00 0.00 179.01 177.92 1ffv h ASN 301 N 0.58 -0.67 -0.63 1.42 -1.24 -0.85 -0.40 115.58 113.79 1ffv h ASN 301 Ca -0.01 0.04 -0.06 0.00 0.71 0.00 0.00 56.30 56.98 1ffv h ASN 301 Cb 1.23 0.20 -0.03 0.00 0.73 0.00 0.00 38.32 40.45 1ffv h ASN 301 CO 0.13 -0.42 0.16 0.40 -1.29 0.00 0.00 177.43 176.40 1ffv h ILE 302 N -0.67 1.25 -0.01 2.57 2.04 -1.42 -1.94 117.51 119.34 1ffv h ILE 302 Ca -0.05 -0.93 -0.18 0.00 1.00 0.00 0.00 64.86 64.70 1ffv h ILE 302 Cb 0.55 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1ffv h ILE 302 CO 0.05 0.35 -0.82 0.28 0.00 0.00 0.00 178.15 178.01 1ffv h SER 303 N 0.98 0.19 0.00 1.72 0.02 -1.24 -3.40 113.55 111.82 1ffv h SER 303 Ca 0.21 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1ffv h SER 303 Cb 0.35 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1ffv h SER 303 CO 0.00 0.93 0.00 0.35 -1.14 0.00 0.00 176.83 176.97 1ffv n THR 304 N -3.67 0.00 -2.45 -2.27 -2.24 -0.17 -4.57 114.28 98.91 1ffv n THR 304 Ca -0.03 -0.35 -0.23 0.00 -2.27 0.00 0.00 64.05 61.17 1ffv n THR 304 Cb 0.77 1.00 0.07 0.00 -2.10 0.00 0.00 70.33 70.07 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 -0.70 2.40 -0.13 4.28 -4.23 -0.73 -4.68 115.64 111.85 1ffv s THR 305 Ca 0.00 -0.49 -0.36 0.00 -1.18 0.00 0.00 61.69 59.66 1ffv s THR 305 Cb 0.00 -2.91 -0.14 0.00 1.34 0.00 0.00 72.50 70.79 1ffv s THR 305 CO 0.00 0.00 1.78 0.00 -0.54 0.00 0.00 174.62 175.86 1ffv n ALA 306 N -2.69 0.44 -1.99 3.99 0.00 -1.26 -4.87 120.51 114.14 1ffv n ALA 306 Ca 0.10 0.34 -0.21 0.00 0.00 0.00 0.00 53.44 53.67 1ffv n ALA 306 Cb 0.60 -2.37 0.05 0.00 0.00 0.00 0.00 19.45 17.73 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 3.46 2.43 0.20 0.00 -0.12 -1.25 -4.42 117.98 118.27 1ffv s PHE 307 Ca 0.93 -0.20 0.08 0.00 -0.05 0.00 0.00 56.93 57.70 1ffv s PHE 307 Cb -0.84 -2.70 -0.05 0.00 -0.63 0.00 0.00 43.02 38.81 1ffv s PHE 307 CO 0.55 -1.02 -0.16 0.00 -0.05 0.00 0.00 175.22 174.54 1ffv s ALA 308 N -2.78 2.09 0.00 1.99 0.00 0.99 0.04 121.76 124.10 1ffv s ALA 308 Ca 0.59 -1.64 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1ffv s ALA 308 Cb -0.09 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.90 1ffv s ALA 308 CO 0.39 0.13 0.00 0.54 0.00 0.00 0.00 175.76 176.82 1ffv n ARG 309 N -0.24 0.00 -2.73 0.00 5.12 -1.09 -1.30 116.66 116.41 1ffv n ARG 309 Ca -0.09 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.74 1ffv n ARG 309 Cb 0.59 0.00 0.05 0.00 -1.16 0.00 0.00 32.46 31.94 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 5.84 -2.13 -4.36 0.55 -0.08 0.13 -4.80 116.55 111.70 1ffv n ASP 310 Ca 0.00 -0.33 -0.33 0.00 -1.51 0.00 0.00 54.79 52.62 1ffv n ASP 310 Cb 0.00 -2.93 -0.14 0.00 2.34 0.00 0.00 41.12 40.39 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 -3.19 2.85 -0.41 -0.67 1.51 -0.84 -2.66 117.35 113.95 1ffv s TYR 311 Ca 0.01 -0.71 -0.11 0.00 -1.01 0.00 0.00 57.07 55.24 1ffv s TYR 311 Cb -0.00 -1.90 0.05 0.00 -0.11 0.00 0.00 41.96 40.00 1ffv s TYR 311 CO 0.38 -0.28 0.26 -1.01 -1.11 0.00 0.00 175.55 173.79 1ffv s HIS 312 N 0.59 3.27 -0.09 2.71 3.76 -0.52 -0.53 115.29 124.48 1ffv s HIS 312 Ca -0.07 -1.12 0.02 0.00 -0.15 0.00 0.00 55.06 53.74 1ffv s HIS 312 Cb -0.15 -2.73 -0.02 0.00 1.11 0.00 0.00 32.58 30.78 1ffv s HIS 312 CO 0.03 -0.74 -0.13 -1.64 -0.85 0.00 0.00 174.74 171.41 1ffv s MET 313 N 1.53 2.92 -0.36 1.40 1.00 0.07 -1.47 119.30 124.40 1ffv s MET 313 Ca 0.03 -0.68 -0.01 0.00 0.00 0.00 0.00 55.69 55.02 1ffv s MET 313 Cb -0.21 -2.51 0.09 0.00 0.00 0.00 0.00 34.83 32.20 1ffv s MET 313 CO 0.05 0.44 0.10 -0.51 0.00 0.00 0.00 175.02 175.11 1ffv s ASP 314 N -0.24 5.04 -0.03 3.03 1.01 0.10 -0.61 116.67 124.97 1ffv s ASP 314 Ca 0.01 -1.77 -0.01 0.00 0.71 0.00 0.00 52.55 51.49 1ffv s ASP 314 Cb -0.13 -1.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.01 1ffv s ASP 314 CO 0.03 -0.41 0.06 -0.83 0.21 0.00 0.00 175.17 174.23 1ffv s GLY 315 N 1.47 1.98 0.01 0.21 0.00 -0.36 -1.34 107.32 109.29 1ffv s GLY 315 Ca 0.04 -0.84 0.02 0.00 0.00 0.00 0.00 44.72 43.93 1ffv s GLY 315 CO -0.04 -0.69 -0.06 -0.54 0.00 0.00 0.00 173.10 171.78 1ffv s GLU 316 N -1.49 0.43 -0.04 2.90 2.02 0.55 -0.93 118.70 122.13 1ffv s GLU 316 Ca 0.20 -0.38 0.01 0.00 0.02 0.00 0.00 54.97 54.82 1ffv s GLU 316 Cb -0.12 -0.32 0.02 0.00 0.10 0.00 0.00 34.13 33.81 1ffv s GLU 316 CO 0.10 0.08 -0.05 -1.17 0.02 0.00 0.00 175.26 174.24 1ffv s LEU 317 N -0.66 1.40 -0.10 1.80 2.96 -0.65 -1.59 118.68 121.83 1ffv s LEU 317 Ca -0.03 -0.13 -0.04 0.00 -0.22 0.00 0.00 54.13 53.71 1ffv s LEU 317 Cb -0.05 -0.45 -0.04 0.00 0.50 0.00 0.00 46.19 46.16 1ffv s LEU 317 CO -0.00 -0.04 0.04 0.00 -1.32 0.00 0.00 176.35 175.03 1ffv s ALA 318 N 0.81 3.44 0.33 5.97 0.00 -0.53 -1.76 121.76 130.03 1ffv s ALA 318 Ca -0.11 -0.76 -0.14 0.00 0.00 0.00 0.00 51.96 50.95 1ffv s ALA 318 Cb -0.14 -1.65 0.03 0.00 0.00 0.00 0.00 23.12 21.36 1ffv s ALA 318 CO 0.00 0.55 0.67 0.00 0.00 0.00 0.00 175.76 176.98 1ffv s ALA 319 N -0.78 -0.50 0.28 0.00 0.00 0.19 0.33 121.76 121.27 1ffv s ALA 319 Ca 0.12 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.34 1ffv s ALA 319 Cb -0.12 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 1ffv s ALA 319 CO 0.03 -0.94 0.35 0.95 0.00 0.00 0.00 175.76 176.14 1ffv s THR 320 N -3.10 4.60 0.55 0.00 -4.23 -0.77 -1.36 115.64 111.33 1ffv s THR 320 Ca 0.18 -1.12 0.28 0.00 -1.18 0.00 0.00 61.69 59.85 1ffv s THR 320 Cb -0.04 -3.58 0.42 0.00 1.34 0.00 0.00 72.50 70.64 1ffv s THR 320 CO 0.12 -0.27 1.95 -0.65 -0.54 0.00 0.00 174.62 175.22 1ffv h PRO 321 N 1.17 0.00 -0.00 3.99 0.11 -1.93 -0.31 132.00 135.03 1ffv h PRO 321 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ffv h PRO 321 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ffv h PRO 321 CO 0.59 0.00 -0.01 -0.40 -0.21 0.00 0.00 178.00 177.96 1ffv n ASP 322 N -4.18 0.40 0.00 -2.05 5.75 -1.26 -4.92 116.55 110.28 1ffv n ASP 322 Ca 0.12 -1.01 0.00 0.00 -0.01 0.00 0.00 54.79 53.88 1ffv n ASP 322 Cb 0.71 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.78 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 1.09 0.36 3.67 6.12 0.00 -0.13 -5.04 105.19 111.27 1ffv n GLY 323 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1ffv n GLY 323 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ffv s LYS 324 N -0.96 4.26 -0.06 1.61 -2.85 -1.25 -4.80 119.74 115.70 1ffv s LYS 324 Ca 0.00 1.77 -0.30 0.00 -1.00 0.00 0.00 55.97 56.44 1ffv s LYS 324 Cb 0.00 -3.71 -0.05 0.00 -2.06 0.00 0.00 37.83 32.01 1ffv s LYS 324 CO 0.00 -0.64 1.51 0.42 0.10 0.00 0.00 175.35 176.74 1ffv s ILE 325 N 3.07 3.72 -0.16 3.79 1.01 -1.26 -1.85 121.20 129.52 1ffv s ILE 325 Ca 0.59 0.96 0.05 0.00 0.00 0.00 0.00 60.65 62.24 1ffv s ILE 325 Cb -0.25 -3.62 -0.23 0.00 0.01 0.00 0.00 42.46 38.37 1ffv s ILE 325 CO 0.20 -0.06 0.20 0.18 0.00 0.00 0.00 174.94 175.46 1ffv n LEU 326 N 6.50 1.82 -3.78 2.97 4.77 0.15 -4.55 117.00 124.88 1ffv n LEU 326 Ca 0.15 0.11 -0.09 0.00 -0.03 0.00 0.00 56.01 56.16 1ffv n LEU 326 Cb 0.43 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 1ffv n LEU 326 CO 0.60 0.71 0.31 -0.83 -1.33 0.00 0.00 177.39 176.85 1ffv s GLY 327 N -5.72 -0.04 -0.05 -0.72 0.00 -1.02 -3.50 107.32 96.26 1ffv s GLY 327 Ca -0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 44.72 44.23 1ffv s GLY 327 CO 0.75 -0.25 0.10 -2.27 0.00 0.00 0.00 173.10 171.42 1ffv s LEU 328 N -2.89 0.74 -0.05 0.66 2.96 -0.80 -1.45 118.68 117.84 1ffv s LEU 328 Ca 0.11 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 1ffv s LEU 328 Cb -0.02 0.15 0.02 0.00 0.50 0.00 0.00 46.19 46.84 1ffv s LEU 328 CO 0.00 -0.16 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.23 1ffv s ARG 329 N 1.32 0.91 0.00 1.98 3.52 -0.62 -1.16 118.95 124.89 1ffv s ARG 329 Ca -0.07 -0.11 0.03 0.00 -0.13 0.00 0.00 55.73 55.45 1ffv s ARG 329 Cb -0.12 -0.95 -0.01 0.00 -1.56 0.00 0.00 34.95 32.31 1ffv s ARG 329 CO -0.05 -0.12 -0.08 0.08 -0.81 0.00 0.00 175.30 174.32 1ffv s VAL 330 N 1.10 0.66 -0.05 7.11 1.01 -0.27 -0.33 120.40 129.63 1ffv s VAL 330 Ca -0.08 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1ffv s VAL 330 Cb -0.14 -0.57 0.02 0.00 0.00 0.00 0.00 36.38 35.69 1ffv s VAL 330 CO -0.01 0.12 -0.05 0.20 0.00 0.00 0.00 175.10 175.36 1ffv s ASN 331 N -0.37 1.05 0.05 3.32 -0.87 -0.45 -0.67 114.94 116.99 1ffv s ASN 331 Ca 0.02 -0.14 0.05 0.00 -1.57 0.00 0.00 52.86 51.22 1ffv s ASN 331 Cb -0.04 -0.47 -0.02 0.00 -0.02 0.00 0.00 41.25 40.69 1ffv s ASN 331 CO -0.00 -0.06 -0.14 -0.69 -2.57 0.00 0.00 177.10 173.64 1ffv s VAL 332 N 0.98 1.14 -0.21 1.60 1.01 0.13 -0.72 120.40 124.33 1ffv s VAL 332 Ca -0.10 -1.07 -0.00 0.00 0.00 0.00 0.00 61.98 60.80 1ffv s VAL 332 Cb -0.14 -1.05 0.02 0.00 0.00 0.00 0.00 36.38 35.21 1ffv s VAL 332 CO -0.00 -0.03 -0.13 -0.69 0.00 0.00 0.00 175.10 174.25 1ffv s VAL 333 N -0.93 2.53 -0.16 2.92 1.01 -0.54 -0.63 120.40 124.60 1ffv s VAL 333 Ca 0.01 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 1ffv s VAL 333 Cb -0.08 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1ffv s VAL 333 CO 0.01 0.40 -0.03 0.00 0.00 0.00 0.00 175.10 175.49 1ffv s ALA 334 N 1.33 3.03 -0.44 5.51 0.00 0.12 -1.44 121.76 129.86 1ffv s ALA 334 Ca 0.03 -0.82 -0.16 0.00 0.00 0.00 0.00 51.96 51.01 1ffv s ALA 334 Cb -0.15 -1.59 0.04 0.00 0.00 0.00 0.00 23.12 21.43 1ffv s ALA 334 CO -0.09 0.20 0.39 0.34 0.00 0.00 0.00 175.76 176.61 1ffv s ASP 335 N 0.37 6.15 0.00 0.00 -1.08 -1.09 0.30 116.67 121.33 1ffv s ASP 335 Ca -0.03 -0.99 0.22 0.00 -0.52 0.00 0.00 52.55 51.23 1ffv s ASP 335 Cb -0.14 -2.19 0.56 0.00 -1.46 0.00 0.00 42.92 39.68 1ffv s ASP 335 CO 0.03 -0.59 1.48 1.41 0.52 0.00 0.00 175.17 178.02 1ffv n HIS 336 N 5.37 0.79 -4.08 -5.34 8.25 -0.72 -4.88 115.22 114.62 1ffv n HIS 336 Ca -0.10 -0.41 0.00 0.00 -0.26 0.00 0.00 57.72 56.95 1ffv n HIS 336 Cb 0.46 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 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 1.56 -1.71 0.26 -1.41 0.00 -1.26 -4.01 105.19 98.63 1ffv n GLY 337 Ca 0.22 -1.34 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.08 0.67 -4.31 4.61 0.00 0.14 -2.42 119.26 117.87 1ffv h ALA 338 Ca 0.00 -0.29 -0.61 0.00 0.00 0.00 0.00 54.91 54.02 1ffv h ALA 338 Cb 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 17.79 17.31 1ffv h ALA 338 CO 0.00 0.48 -0.86 -0.06 0.00 0.00 0.00 179.25 178.82 1ffv s PHE 339 N -5.01 1.89 -0.69 0.00 0.08 -1.26 -4.80 117.98 108.19 1ffv s PHE 339 Ca -0.12 -0.41 -0.26 0.00 0.12 0.00 0.00 56.93 56.26 1ffv s PHE 339 Cb 0.12 -1.23 0.04 0.00 -0.57 0.00 0.00 43.02 41.38 1ffv s PHE 339 CO 0.82 -0.07 1.19 0.34 -0.10 0.00 0.00 175.22 177.40 1ffv s ASP 340 N -0.38 6.21 -0.16 1.36 2.15 -1.26 -4.47 116.67 120.12 1ffv s ASP 340 Ca 0.05 -0.49 0.15 0.00 0.43 0.00 0.00 52.55 52.69 1ffv s ASP 340 Cb -0.09 -2.52 0.35 0.00 -0.30 0.00 0.00 42.92 40.36 1ffv s ASP 340 CO 0.00 -1.68 1.18 0.00 -0.17 0.00 0.00 175.17 174.50 1ffv n ALA 341 N 8.82 2.96 -1.84 3.66 0.00 -1.26 -4.07 120.51 128.78 1ffv n ALA 341 Ca 0.02 -2.88 -0.42 0.00 0.00 0.00 0.00 53.44 50.15 1ffv n ALA 341 Cb 0.48 -0.39 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 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 5.06 3.73 -0.15 0.00 0.00 -1.26 -3.45 121.76 125.69 1ffv s ALA 343 Ca 0.83 1.28 -0.34 0.00 0.00 0.00 0.00 51.96 53.73 1ffv s ALA 343 Cb -0.35 -3.64 0.14 0.00 0.00 0.00 0.00 23.12 19.26 1ffv s ALA 343 CO 0.35 -0.88 1.25 -0.51 0.00 0.00 0.00 175.76 175.97 1ffv s ASP 344 N 1.59 -0.10 0.33 0.00 1.01 -1.26 -4.67 116.67 113.56 1ffv s ASP 344 Ca 0.71 -0.04 -0.28 0.00 0.71 0.00 0.00 52.55 53.65 1ffv s ASP 344 Cb -0.41 0.14 -0.10 0.00 1.01 0.00 0.00 42.92 43.56 1ffv s ASP 344 CO 0.31 -0.23 1.19 -2.84 0.21 0.00 0.00 175.17 173.81 1ffv s PRO 345 N -2.38 4.38 0.51 8.23 0.02 -1.26 -4.79 135.00 139.70 1ffv s PRO 345 Ca 0.11 1.95 0.43 0.00 0.02 0.00 0.00 61.00 63.51 1ffv s PRO 345 Cb 0.01 -3.00 1.62 0.00 0.02 0.00 0.00 34.50 33.15 1ffv s PRO 345 CO -0.04 -0.07 1.54 2.41 -0.33 0.00 0.00 177.00 180.51 1ffv n THR 346 N 0.74 -0.09 0.69 0.99 -1.04 0.21 -1.16 114.28 114.64 1ffv n THR 346 Ca 0.01 1.58 0.11 0.00 -2.04 0.00 0.00 64.05 63.70 1ffv n THR 346 Cb 0.44 -2.61 0.28 0.00 -1.82 0.00 0.00 70.33 66.62 1ffv n THR 346 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1ffv n LYS 347 N -4.17 2.18 -3.65 -2.82 5.02 -1.26 -4.69 118.16 108.77 1ffv n LYS 347 Ca 0.42 -1.78 -0.28 0.00 -2.02 0.00 0.00 58.31 54.66 1ffv n LYS 347 Cb 1.83 -1.46 -0.12 0.00 -0.02 0.00 0.00 35.03 35.27 1ffv n LYS 347 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ffv s PHE 348 N -1.61 2.11 -0.48 2.13 0.08 -0.31 -4.94 117.98 114.96 1ffv s PHE 348 Ca 0.36 -2.65 0.17 0.00 0.12 0.00 0.00 56.93 54.92 1ffv s PHE 348 Cb 0.20 -1.76 0.84 0.00 -0.57 0.00 0.00 43.02 41.73 1ffv s PHE 348 CO 0.29 -0.73 1.51 -0.35 -0.10 0.00 0.00 175.22 175.84 1ffv n PRO 349 N 2.81 0.11 -0.45 0.24 -0.04 -1.26 -0.86 135.00 135.55 1ffv n PRO 349 Ca 0.20 0.54 0.07 0.00 -0.04 0.00 0.00 63.50 64.27 1ffv n PRO 349 Cb 0.40 -1.81 0.13 0.00 -0.04 0.00 0.00 33.50 32.18 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 -1.70 2.71 -0.91 0.55 0.00 -1.26 -5.05 120.51 114.84 1ffv n ALA 350 Ca -0.00 -2.62 0.00 0.00 0.00 0.00 0.00 53.44 50.82 1ffv n ALA 350 Cb 0.07 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.10 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 -0.95 2.39 2.41 0.00 0.00 -0.04 -2.58 105.19 106.41 1ffv n GLY 351 Ca 0.14 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 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 7.37 0.28 0.99 4.77 0.63 -4.65 117.00 126.39 1ffv n LEU 352 Ca 0.00 -4.45 0.12 0.00 -0.03 0.00 0.00 56.01 51.65 1ffv n LEU 352 Cb 0.00 -0.93 0.80 0.00 -2.33 0.00 0.00 43.42 40.96 1ffv n LEU 352 CO 0.00 1.60 1.09 0.15 -1.33 0.00 0.00 177.39 178.89 1ffv h PHE 353 N 2.20 0.00 0.00 -1.77 3.57 -1.63 -2.43 116.94 116.88 1ffv h PHE 353 Ca 0.57 0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.07 1ffv h PHE 353 Cb 0.74 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.48 1ffv h PHE 353 CO 1.33 0.01 0.00 -2.39 -2.23 0.00 0.00 178.31 175.03 1ffv n HIS 354 N -4.10 0.00 0.35 0.41 1.44 -1.26 -1.67 115.22 110.39 1ffv n HIS 354 Ca -0.03 -0.12 0.10 0.00 -2.01 0.00 0.00 57.72 55.66 1ffv n HIS 354 Cb 0.10 -0.11 0.16 0.00 0.12 0.00 0.00 29.99 30.25 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 0.36 0.42 0.37 0.61 0.00 -0.91 -4.54 119.36 115.67 1ffv n ILE 355 Ca 0.00 -0.71 0.02 0.00 0.00 0.00 0.00 62.75 62.07 1ffv n ILE 355 Cb 0.22 1.03 0.15 0.00 0.00 0.00 0.00 39.64 41.04 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 -0.91 0.40 0.00 0.00 3.41 -1.26 -4.50 113.62 110.75 1ffv n SER 357 Ca 0.04 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 1ffv n SER 357 Cb 0.02 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.31 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 0.78 1.70 1.07 5.00 0.00 -0.68 -3.07 105.19 109.99 1ffv n GLY 358 Ca 0.05 -0.57 0.05 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.41 3.07 -4.56 1.61 7.64 -1.26 -4.78 113.62 114.92 1ffv n SER 359 Ca 0.00 -2.32 -0.31 0.00 1.01 0.00 0.00 58.87 57.24 1ffv n SER 359 Cb 0.00 -0.48 -0.11 0.00 -1.01 0.00 0.00 64.21 62.61 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 -1.78 2.78 -1.20 1.43 2.02 -1.17 -1.33 117.35 118.09 1ffv s TYR 360 Ca 0.29 -0.12 -0.17 0.00 -0.37 0.00 0.00 57.07 56.70 1ffv s TYR 360 Cb 0.20 -1.53 0.11 0.00 -0.40 0.00 0.00 41.96 40.34 1ffv s TYR 360 CO 0.12 0.36 1.53 0.34 -1.57 0.00 0.00 175.55 176.33 1ffv s ASP 361 N -1.64 6.87 -0.28 2.29 2.15 -0.54 -4.80 116.67 120.71 1ffv s ASP 361 Ca 0.18 -2.51 -0.13 0.00 0.43 0.00 0.00 52.55 50.51 1ffv s ASP 361 Cb -0.11 -2.49 -0.04 0.00 -0.30 0.00 0.00 42.92 39.98 1ffv s ASP 361 CO 0.09 -1.03 0.30 -0.63 -0.17 0.00 0.00 175.17 173.72 1ffv s ILE 362 N 3.13 5.23 0.30 4.11 1.01 -1.26 -4.91 121.20 128.80 1ffv s ILE 362 Ca 0.47 0.33 0.02 0.00 0.00 0.00 0.00 60.65 61.46 1ffv s ILE 362 Cb 0.00 -3.65 0.12 0.00 0.01 0.00 0.00 42.46 38.94 1ffv s ILE 362 CO 0.01 0.16 1.79 1.55 0.00 0.00 0.00 174.94 178.45 1ffv h PRO 363 N 8.30 0.59 -4.86 2.79 0.13 -1.80 -3.38 132.00 133.76 1ffv h PRO 363 Ca -0.33 -0.16 -0.40 0.00 -0.87 0.00 0.00 66.00 64.24 1ffv h PRO 363 Cb 1.17 -0.07 -0.28 0.00 0.13 0.00 0.00 31.00 31.96 1ffv h PRO 363 CO 0.61 0.67 -0.78 1.03 -0.23 0.00 0.00 178.00 179.30 1ffv s ARG 364 N -4.82 0.79 -0.05 0.86 0.52 -1.23 -4.79 118.95 110.24 1ffv s ARG 364 Ca -0.08 -0.42 -0.29 0.00 -0.52 0.00 0.00 55.73 54.41 1ffv s ARG 364 Cb 0.15 -0.76 0.09 0.00 0.52 0.00 0.00 34.95 34.95 1ffv s ARG 364 CO 0.79 0.20 0.81 0.00 0.02 0.00 0.00 175.30 177.12 1ffv s ALA 365 N -0.37 -1.81 -0.05 2.13 0.00 -1.26 -1.90 121.76 118.50 1ffv s ALA 365 Ca 0.03 1.25 -0.17 0.00 0.00 0.00 0.00 51.96 53.07 1ffv s ALA 365 Cb -0.05 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.06 1ffv s ALA 365 CO -0.00 -0.45 0.38 -1.58 0.00 0.00 0.00 175.76 174.10 1ffv s HIS 366 N -1.80 -0.30 -0.06 0.00 5.04 -0.31 -1.64 115.29 116.22 1ffv s HIS 366 Ca -0.04 0.57 -0.06 0.00 -1.54 0.00 0.00 55.06 53.99 1ffv s HIS 366 Cb -0.00 0.15 0.01 0.00 0.04 0.00 0.00 32.58 32.78 1ffv s HIS 366 CO 0.01 -0.37 0.16 0.00 -2.34 0.00 0.00 174.74 172.20 1ffv s SER 368 N -0.07 1.17 -0.09 0.00 0.15 0.16 -2.09 113.70 112.93 1ffv s SER 368 Ca -0.02 -0.18 0.03 0.00 0.70 0.00 0.00 55.95 56.49 1ffv s SER 368 Cb -0.02 -0.54 0.01 0.00 -1.71 0.00 0.00 66.02 63.76 1ffv s SER 368 CO 0.00 -0.02 -0.19 -0.69 1.20 0.00 0.00 173.24 173.55 1ffv s VAL 369 N 0.75 1.69 -0.26 4.45 1.01 0.93 0.20 120.40 129.18 1ffv s VAL 369 Ca -0.12 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 1ffv s VAL 369 Cb -0.14 -1.49 0.04 0.00 0.00 0.00 0.00 36.38 34.78 1ffv s VAL 369 CO 0.01 0.48 -0.07 -0.75 0.00 0.00 0.00 175.10 174.77 1ffv s LYS 370 N 0.57 2.66 0.21 2.72 2.20 0.20 -0.42 119.74 127.88 1ffv s LYS 370 Ca -0.15 -1.09 -0.24 0.00 -0.36 0.00 0.00 55.97 54.13 1ffv s LYS 370 Cb -0.17 -2.98 -0.08 0.00 -1.51 0.00 0.00 37.83 33.09 1ffv s LYS 370 CO 0.05 -0.46 0.80 0.20 -0.36 0.00 0.00 175.35 175.58 1ffv s GLY 371 N 1.27 2.82 0.00 5.54 0.00 -0.07 0.13 107.32 117.00 1ffv s GLY 371 Ca -0.02 0.34 0.01 0.00 0.00 0.00 0.00 44.72 45.05 1ffv s GLY 371 CO -0.05 0.79 -0.02 0.14 0.00 0.00 0.00 173.10 173.96 1ffv s VAL 372 N -1.35 0.17 0.15 1.40 1.01 0.15 -0.97 120.40 120.96 1ffv s VAL 372 Ca 0.41 -0.26 -0.22 0.00 0.00 0.00 0.00 61.98 61.90 1ffv s VAL 372 Cb -0.20 -0.19 -0.08 0.00 0.00 0.00 0.00 36.38 35.91 1ffv s VAL 372 CO 0.24 -0.06 0.70 -0.31 0.00 0.00 0.00 175.10 175.68 1ffv s TYR 373 N -0.32 3.83 0.14 5.22 2.02 0.15 -1.76 117.35 126.63 1ffv s TYR 373 Ca -0.02 1.47 -0.08 0.00 -0.37 0.00 0.00 57.07 58.07 1ffv s TYR 373 Cb -0.03 -2.65 -0.01 0.00 -0.40 0.00 0.00 41.96 38.87 1ffv s TYR 373 CO -0.00 0.51 0.23 0.95 -1.57 0.00 0.00 175.55 175.66 1ffv s THR 374 N -1.21 0.09 -1.34 -0.71 -4.23 -0.91 -4.91 115.64 102.42 1ffv s THR 374 Ca 0.35 -1.40 -0.12 0.00 -1.18 0.00 0.00 61.69 59.34 1ffv s THR 374 Cb -0.21 -1.73 -0.05 0.00 1.34 0.00 0.00 72.50 71.86 1ffv s THR 374 CO 0.23 -0.42 2.43 0.59 -0.54 0.00 0.00 174.62 176.91 1ffv n ASN 375 N -0.15 5.58 -4.17 3.99 4.13 -0.34 -0.51 115.26 123.79 1ffv n ASN 375 Ca -0.09 -2.64 -0.10 0.00 1.68 0.00 0.00 54.58 53.42 1ffv n ASN 375 Cb 0.63 -1.46 -0.10 0.00 -1.54 0.00 0.00 39.78 37.31 1ffv n ASN 375 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1ffv s LYS 376 N 3.12 1.00 0.45 3.52 1.02 -1.25 -4.52 119.74 123.07 1ffv s LYS 376 Ca 0.55 -1.49 -0.24 0.00 0.02 0.00 0.00 55.97 54.81 1ffv s LYS 376 Cb 0.15 0.22 -0.08 0.00 -0.52 0.00 0.00 37.83 37.61 1ffv s LYS 376 CO -0.04 -0.28 1.26 0.00 -0.92 0.00 0.00 175.35 175.36 1ffv s ALA 377 N -4.06 3.09 1.09 5.17 0.00 -1.26 -0.77 121.76 125.02 1ffv s ALA 377 Ca 0.28 1.14 -0.13 0.00 0.00 0.00 0.00 51.96 53.25 1ffv s ALA 377 Cb 0.07 -3.46 0.24 0.00 0.00 0.00 0.00 23.12 19.97 1ffv s ALA 377 CO 0.04 -0.85 1.06 -1.25 0.00 0.00 0.00 175.76 174.76 1ffv s PRO 378 N -2.50 -0.29 0.00 0.00 0.04 -1.26 -4.40 135.00 126.59 1ffv s PRO 378 Ca 0.61 0.70 0.00 0.00 0.04 0.00 0.00 61.00 62.36 1ffv s PRO 378 Cb -0.35 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1ffv s PRO 378 CO 0.44 -3.26 0.00 0.41 0.04 0.00 0.00 177.00 174.62 1ffv n GLY 379 N -0.08 0.71 0.00 0.56 0.00 -1.26 -3.86 105.19 101.27 1ffv n GLY 379 Ca 0.04 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.43 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 3.72 3.31 -0.02 0.00 0.11 -4.10 105.19 108.21 1ffv n GLY 380 Ca 0.00 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 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 4.44 0.02 1.61 1.01 -1.24 -2.68 120.40 123.55 1ffv s VAL 381 Ca 0.00 -1.21 -0.27 0.00 0.00 0.00 0.00 61.98 60.50 1ffv s VAL 381 Cb 0.00 -3.64 0.09 0.00 0.00 0.00 0.00 36.38 32.83 1ffv s VAL 381 CO 0.00 -0.44 1.24 0.00 0.00 0.00 0.00 175.10 175.90 1ffv s ALA 382 N 1.49 -2.31 0.00 5.51 0.00 -1.26 -4.53 121.76 120.66 1ffv s ALA 382 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.97 1ffv s ALA 382 Cb -0.22 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.76 1ffv s ALA 382 CO 0.04 -1.13 0.00 0.98 0.00 0.00 0.00 175.76 175.65 1ffv n TYR 383 N -0.86 0.00 -2.18 0.00 4.19 0.17 -4.73 117.16 113.75 1ffv n TYR 383 Ca 0.02 0.00 0.01 0.00 3.31 0.00 0.00 57.90 61.24 1ffv n TYR 383 Cb 0.59 -1.06 -0.00 0.00 0.49 0.00 0.00 39.34 39.36 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 0.25 -1.71 2.98 7.64 -1.26 -4.96 113.62 116.56 1ffv n SER 386 Ca 0.00 -1.87 -0.00 0.00 1.01 0.00 0.00 58.87 58.00 1ffv n SER 386 Cb 0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 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 0.18 -0.39 -1.36 1.43 3.72 -1.26 -4.29 117.46 115.49 1ffv n PHE 387 Ca -0.01 0.15 -0.12 0.00 -0.05 0.00 0.00 57.45 57.41 1ffv n PHE 387 Cb 0.84 -1.92 -0.05 0.00 -0.94 0.00 0.00 39.48 37.41 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 -1.15 -1.30 0.09 -1.08 5.12 -1.26 -0.27 116.66 116.81 1ffv n ARG 388 Ca -0.00 0.91 -0.07 0.00 -1.93 0.00 0.00 57.85 56.76 1ffv n ARG 388 Cb 0.50 -5.13 -0.00 0.00 -1.16 0.00 0.00 32.46 26.66 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 1.54 -0.61 1.55 2.07 -1.83 -2.71 116.25 116.26 1ffv h VAL 389 Ca -0.26 -2.72 0.07 0.00 0.82 0.00 0.00 66.70 64.61 1ffv h VAL 389 Cb 1.03 2.51 -0.06 0.00 -1.52 0.00 0.00 31.29 33.25 1ffv h VAL 389 CO 0.37 0.79 0.29 0.71 0.02 0.00 0.00 177.57 179.75 1ffv h THR 390 N 0.06 0.88 -0.19 2.57 1.35 -1.91 -1.04 112.91 114.64 1ffv h THR 390 Ca -0.03 -0.18 -0.05 0.00 -0.55 0.00 0.00 66.41 65.59 1ffv h THR 390 Cb 1.50 0.30 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1ffv h THR 390 CO 0.12 0.10 -0.08 -0.33 -0.25 0.00 0.00 175.52 175.09 1ffv h GLU 391 N 0.53 0.39 -0.60 4.72 3.07 -1.94 -2.28 114.58 118.47 1ffv h GLU 391 Ca 0.29 -0.16 0.03 0.00 -0.50 0.00 0.00 59.36 59.01 1ffv h GLU 391 Cb 0.26 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.12 1ffv h GLU 391 CO -0.23 0.67 0.37 0.00 -1.40 0.00 0.00 179.01 178.42 1ffv h ALA 392 N 0.71 0.78 -0.38 3.43 0.00 -1.20 0.21 119.26 122.81 1ffv h ALA 392 Ca 0.04 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1ffv h ALA 392 Cb 0.55 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1ffv h ALA 392 CO 0.02 0.11 -0.31 0.28 0.00 0.00 0.00 179.25 179.35 1ffv h VAL 393 N 0.73 1.28 -0.39 0.00 2.07 -1.22 -2.15 116.25 116.56 1ffv h VAL 393 Ca 0.24 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.27 1ffv h VAL 393 Cb 0.02 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1ffv h VAL 393 CO -0.10 0.49 0.14 0.22 0.02 0.00 0.00 177.57 178.34 1ffv h TYR 394 N 0.71 0.61 0.45 1.57 3.20 -1.04 -1.73 116.97 120.75 1ffv h TYR 394 Ca 0.08 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1ffv h TYR 394 Cb 0.86 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.96 1ffv h TYR 394 CO 0.05 0.56 -0.22 1.25 -1.64 0.00 0.00 178.16 178.16 1ffv h LEU 395 N 0.49 -0.51 -0.48 2.82 5.85 -0.85 -1.83 115.31 120.80 1ffv h LEU 395 Ca 0.13 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1ffv h LEU 395 Cb 0.22 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1ffv h LEU 395 CO -0.01 -0.36 0.18 -0.29 -0.34 0.00 0.00 178.44 177.63 1ffv h ILE 396 N -0.62 1.21 -0.26 4.05 6.09 -1.37 -1.80 117.51 124.81 1ffv h ILE 396 Ca -0.06 -0.67 -0.07 0.00 -1.37 0.00 0.00 64.86 62.69 1ffv h ILE 396 Cb 0.47 0.76 -0.01 0.00 0.47 0.00 0.00 36.82 38.51 1ffv h ILE 396 CO 0.10 0.25 -0.16 -0.33 -3.07 0.00 0.00 178.15 174.94 1ffv h GLU 397 N 0.63 0.44 -0.25 2.19 4.39 -1.33 -0.68 114.58 119.96 1ffv h GLU 397 Ca 0.16 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.61 1ffv h GLU 397 Cb 0.21 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1ffv h GLU 397 CO -0.01 0.59 -0.27 0.00 -1.16 0.00 0.00 179.01 178.16 1ffv h ARG 398 N 0.40 0.63 -0.63 2.33 2.47 -1.19 -2.64 114.38 115.74 1ffv h ARG 398 Ca 0.07 -0.34 -0.06 0.00 -1.26 0.00 0.00 59.98 58.39 1ffv h ARG 398 Cb 0.52 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.83 1ffv h ARG 398 CO 0.03 0.95 0.16 0.52 0.56 0.00 0.00 179.97 182.19 1ffv h MET 399 N 0.35 1.01 -0.78 0.04 2.86 -1.03 -1.70 114.93 115.67 1ffv h MET 399 Ca 0.04 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1ffv h MET 399 Cb 0.84 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.33 1ffv h MET 399 CO 0.07 0.91 0.50 0.28 1.06 0.00 0.00 176.91 179.72 1ffv h VAL 400 N 0.93 1.21 -0.37 -2.22 2.07 -1.12 -0.20 116.25 116.54 1ffv h VAL 400 Ca 0.20 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 1ffv h VAL 400 Cb 0.35 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 1ffv h VAL 400 CO 0.00 0.20 0.05 0.44 0.02 0.00 0.00 177.57 178.28 1ffv h ASP 401 N 1.06 0.60 -0.67 0.57 3.32 -1.05 -0.77 116.42 119.48 1ffv h ASP 401 Ca 0.28 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1ffv h ASP 401 Cb -0.10 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 1ffv h ASP 401 CO -0.06 0.72 0.36 0.58 -1.72 0.00 0.00 179.24 179.12 1ffv h VAL 402 N 0.46 1.21 -0.62 -1.35 2.07 -0.65 -0.99 116.25 116.39 1ffv h VAL 402 Ca 0.11 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1ffv h VAL 402 Cb 0.38 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1ffv h VAL 402 CO 0.01 0.24 0.30 0.25 0.02 0.00 0.00 177.57 178.39 1ffv h LEU 403 N 0.92 0.81 -0.65 2.57 5.85 -0.87 -1.29 115.31 122.65 1ffv h LEU 403 Ca 0.23 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 1ffv h LEU 403 Cb 0.06 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1ffv h LEU 403 CO -0.04 0.71 0.33 0.00 -0.34 0.00 0.00 178.44 179.10 1ffv h ALA 404 N 1.13 0.83 -0.53 1.25 0.00 -0.70 -1.80 119.26 119.45 1ffv h ALA 404 Ca 0.21 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1ffv h ALA 404 Cb 0.11 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1ffv h ALA 404 CO -0.03 0.38 0.02 1.96 0.00 0.00 0.00 179.25 181.59 1ffv h GLN 405 N 0.89 0.88 -0.39 0.00 4.20 -0.83 0.23 115.11 120.09 1ffv h GLN 405 Ca 0.22 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 1ffv h GLN 405 Cb 0.09 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1ffv h GLN 405 CO -0.03 0.87 -0.21 -0.22 -0.67 0.00 0.00 178.83 178.57 1ffv h LYS 406 N 0.82 0.77 -0.01 1.46 3.64 -0.95 -2.74 116.57 119.58 1ffv h LYS 406 Ca 0.16 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1ffv h LYS 406 Cb 0.46 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1ffv h LYS 406 CO 0.02 0.92 -0.13 1.28 -2.27 0.00 0.00 179.45 179.27 1ffv n LEU 407 N -4.12 0.69 -3.74 5.20 4.77 -0.70 -4.91 117.00 114.19 1ffv n LEU 407 Ca 0.00 -0.11 -0.26 0.00 -0.03 0.00 0.00 56.01 55.60 1ffv n LEU 407 Cb 0.43 -0.14 0.06 0.00 -2.33 0.00 0.00 43.42 41.43 1ffv n LEU 407 CO 0.44 0.13 0.17 -3.20 -1.33 0.00 0.00 177.39 173.60 1ffv n ASN 408 N -0.76 -5.42 -4.60 -1.43 5.15 0.17 -4.97 115.26 103.40 1ffv n ASN 408 Ca 0.15 -0.66 -0.34 0.00 -0.60 0.00 0.00 54.58 53.13 1ffv n ASN 408 Cb 0.29 -4.51 -0.11 0.00 -0.53 0.00 0.00 39.78 34.93 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 -6.41 2.91 0.20 1.20 1.75 0.57 -5.02 119.30 114.50 1ffv s MET 409 Ca 0.59 -0.51 -0.32 0.00 -1.25 0.00 0.00 55.69 54.20 1ffv s MET 409 Cb -0.28 -2.68 -0.14 0.00 2.84 0.00 0.00 34.83 34.58 1ffv s MET 409 CO 0.78 0.63 1.50 -3.47 -0.65 0.00 0.00 175.02 173.81 1ffv n ASP 410 N 2.34 2.97 0.29 1.11 2.03 -1.26 -4.44 116.55 119.58 1ffv n ASP 410 Ca -0.18 1.11 0.15 0.00 0.52 0.00 0.00 54.79 56.39 1ffv n ASP 410 Cb 0.53 -1.43 0.89 0.00 -0.72 0.00 0.00 41.12 40.39 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 5.07 0.00 0.15 -0.67 1.57 -1.96 -1.47 116.57 119.25 1ffv h LYS 411 Ca -0.45 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.04 1ffv h LYS 411 Cb 1.26 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.58 1ffv h LYS 411 CO 0.82 0.02 -1.42 0.00 -0.57 0.00 0.00 179.45 178.31 1ffv h ALA 412 N 1.98 0.11 -0.69 3.86 0.00 -1.97 -3.31 119.26 119.23 1ffv h ALA 412 Ca -0.00 -1.03 0.03 0.00 0.00 0.00 0.00 54.91 53.91 1ffv h ALA 412 Cb 0.06 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ffv h ALA 412 CO 0.00 0.80 0.43 1.49 0.00 0.00 0.00 179.25 181.97 1ffv h GLU 413 N -0.18 0.82 0.00 0.00 4.81 -1.80 0.12 114.58 118.34 1ffv h GLU 413 Ca -0.29 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.85 1ffv h GLU 413 Cb 1.86 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 31.05 1ffv h GLU 413 CO 0.12 0.54 -0.21 0.97 -0.73 0.00 0.00 179.01 179.71 1ffv h ILE 414 N 0.85 0.81 0.01 2.32 2.10 -1.44 -1.58 117.51 120.58 1ffv h ILE 414 Ca 0.28 -0.81 -0.05 0.00 1.08 0.00 0.00 64.86 65.36 1ffv h ILE 414 Cb 0.02 1.48 0.00 0.00 -1.09 0.00 0.00 36.82 37.24 1ffv h ILE 414 CO -0.11 0.20 -0.19 0.03 -1.08 0.00 0.00 178.15 177.00 1ffv h ARG 415 N 0.00 0.11 -1.00 2.19 3.08 -1.31 -2.83 114.38 114.62 1ffv h ARG 415 Ca -0.00 -0.13 0.11 0.00 0.07 0.00 0.00 59.98 60.03 1ffv h ARG 415 Cb 0.47 0.04 -0.08 0.00 0.08 0.00 0.00 29.97 30.48 1ffv h ARG 415 CO 0.03 0.94 0.63 0.00 -1.07 0.00 0.00 179.97 180.51 1ffv h ALA 416 N 0.17 1.51 0.00 0.04 0.00 -0.80 0.90 119.26 121.08 1ffv h ALA 416 Ca -0.03 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1ffv h ALA 416 Cb 1.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1ffv h ALA 416 CO 0.04 0.25 -0.44 -0.22 0.00 0.00 0.00 179.25 178.88 1ffv h LYS 417 N 1.02 0.00 0.00 0.00 3.64 -1.36 -3.27 116.57 116.60 1ffv h LYS 417 Ca 0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 1ffv h LYS 417 Cb 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1ffv h LYS 417 CO -0.25 0.44 -1.17 0.09 -2.27 0.00 0.00 179.45 176.29 1ffv n ASN 418 N -3.84 0.81 -4.56 4.20 3.02 -0.24 -4.99 115.26 109.67 1ffv n ASN 418 Ca -0.01 -0.80 -0.38 0.00 -0.03 0.00 0.00 54.58 53.35 1ffv n ASN 418 Cb 0.49 1.17 0.04 0.00 -0.61 0.00 0.00 39.78 40.87 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 -1.64 0.28 -2.55 3.10 3.72 0.14 -1.47 117.46 119.03 1ffv n PHE 419 Ca 0.03 0.46 -0.41 0.00 -0.05 0.00 0.00 57.45 57.47 1ffv n PHE 419 Cb 0.37 -2.08 -0.04 0.00 -0.94 0.00 0.00 39.48 36.80 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 -1.56 4.07 0.51 4.37 1.01 -0.44 -4.48 121.20 124.67 1ffv s ILE 420 Ca 0.71 1.70 -0.16 0.00 0.00 0.00 0.00 60.65 62.91 1ffv s ILE 420 Cb -0.45 -4.09 -0.08 0.00 0.01 0.00 0.00 42.46 37.86 1ffv s ILE 420 CO 0.51 0.25 0.97 -0.13 0.00 0.00 0.00 174.94 176.55 1ffv s ARG 421 N -0.01 3.93 0.36 2.79 0.52 -1.26 -4.66 118.95 120.62 1ffv s ARG 421 Ca 0.50 0.92 0.11 0.00 -0.52 0.00 0.00 55.73 56.75 1ffv s ARG 421 Cb -0.28 -2.15 0.89 0.00 0.52 0.00 0.00 34.95 33.93 1ffv s ARG 421 CO 0.33 -0.26 1.83 -0.22 0.02 0.00 0.00 175.30 177.00 1ffv h LYS 422 N 0.92 0.60 0.00 3.54 3.64 -1.95 -0.37 116.57 122.95 1ffv h LYS 422 Ca -0.47 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1ffv h LYS 422 Cb 1.18 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1ffv h LYS 422 CO 0.62 0.40 0.00 -0.85 -2.27 0.00 0.00 179.45 177.34 1ffv n GLU 423 N -4.61 0.09 0.03 1.90 -0.00 -1.26 -3.14 120.64 113.65 1ffv n GLU 423 Ca 0.20 0.19 0.13 0.00 -0.00 0.00 0.00 57.16 57.69 1ffv n GLU 423 Cb 0.60 -1.63 0.47 0.00 -0.00 0.00 0.00 31.44 30.88 1ffv n GLU 423 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1ffv n GLN 424 N -1.78 0.09 -2.97 3.44 6.02 -0.15 -4.84 117.38 117.19 1ffv n GLN 424 Ca 0.05 0.06 -0.39 0.00 -0.01 0.00 0.00 57.00 56.70 1ffv n GLN 424 Cb 0.29 -1.59 -0.06 0.00 1.02 0.00 0.00 30.24 29.90 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 -3.04 3.91 0.05 1.08 0.08 -1.19 -2.70 117.98 116.18 1ffv s PHE 425 Ca 0.12 1.64 -0.31 0.00 0.12 0.00 0.00 56.93 58.51 1ffv s PHE 425 Cb 0.17 -2.77 -0.07 0.00 -0.57 0.00 0.00 43.02 39.77 1ffv s PHE 425 CO 0.59 0.51 1.51 -1.25 -0.10 0.00 0.00 175.22 176.49 1ffv s PRO 426 N -1.17 4.25 -0.23 0.24 0.04 -1.26 -5.01 135.00 131.86 1ffv s PRO 426 Ca 0.36 2.16 -0.09 0.00 0.04 0.00 0.00 61.00 63.46 1ffv s PRO 426 Cb -0.23 -3.51 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 1ffv s PRO 426 CO 0.26 -0.62 0.12 -0.47 0.04 0.00 0.00 177.00 176.33 1ffv s TYR 427 N 2.24 3.26 -0.28 0.56 5.04 -0.80 -4.89 117.35 122.47 1ffv s TYR 427 Ca 0.68 0.08 -0.16 0.00 -2.44 0.00 0.00 57.07 55.23 1ffv s TYR 427 Cb -0.36 -2.23 -0.03 0.00 0.35 0.00 0.00 41.96 39.69 1ffv s TYR 427 CO 0.30 0.00 0.42 0.99 -1.34 0.00 0.00 175.55 175.92 1ffv s THR 428 N 1.04 5.13 0.85 4.34 2.01 -1.26 0.07 115.64 127.82 1ffv s THR 428 Ca 0.06 0.58 -0.13 0.00 0.31 0.00 0.00 61.69 62.51 1ffv s THR 428 Cb -0.14 -3.76 0.12 0.00 0.01 0.00 0.00 72.50 68.73 1ffv s THR 428 CO 0.04 0.08 1.21 0.42 -0.69 0.00 0.00 174.62 175.69 1ffv s THR 429 N 2.16 2.01 0.17 -0.82 -4.23 -0.18 -4.91 115.64 109.85 1ffv s THR 429 Ca 0.17 -0.02 0.34 0.00 -1.18 0.00 0.00 61.69 61.00 1ffv s THR 429 Cb -0.16 -3.00 0.36 0.00 1.34 0.00 0.00 72.50 71.04 1ffv s THR 429 CO 0.10 0.00 2.03 0.06 -0.54 0.00 0.00 174.62 176.27 1ffv h GLN 430 N -1.21 0.00 0.00 3.99 3.07 -1.87 -0.29 115.11 118.80 1ffv h GLN 430 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.29 1ffv h GLN 430 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.86 1ffv h GLN 430 CO 0.57 0.00 -0.90 1.19 0.09 0.00 0.00 178.83 179.78 1ffv n PHE 431 N -2.79 0.02 0.00 0.06 3.72 -1.26 -4.54 117.46 112.67 1ffv n PHE 431 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1ffv n PHE 431 Cb 0.15 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.58 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 1.48 0.60 3.77 1.37 0.00 -0.12 -4.73 105.19 107.56 1ffv n GLY 432 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 3.63 -0.69 1.61 0.08 -1.26 -4.74 117.98 114.60 1ffv s PHE 433 Ca 0.00 1.76 -0.09 0.00 0.12 0.00 0.00 56.93 58.72 1ffv s PHE 433 Cb 0.00 -3.08 0.18 0.00 -0.57 0.00 0.00 43.02 39.55 1ffv s PHE 433 CO 0.00 -0.13 0.57 -2.00 -0.10 0.00 0.00 175.22 173.57 1ffv s GLU 434 N -1.82 3.03 0.14 0.44 2.12 -1.26 -1.01 118.70 120.35 1ffv s GLU 434 Ca 0.49 -2.35 -0.32 0.00 0.36 0.00 0.00 54.97 53.14 1ffv s GLU 434 Cb -0.24 -4.10 -0.12 0.00 0.26 0.00 0.00 34.13 29.93 1ffv s GLU 434 CO 0.31 -1.24 1.74 0.66 -0.54 0.00 0.00 175.26 176.19 1ffv n TYR 435 N 3.98 2.55 -0.05 5.30 4.02 0.11 -4.79 117.16 128.28 1ffv n TYR 435 Ca 0.07 0.03 -0.13 0.00 -0.01 0.00 0.00 57.90 57.86 1ffv n TYR 435 Cb 0.42 -2.66 -0.07 0.00 -0.02 0.00 0.00 39.34 37.01 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 7.39 0.38 -4.72 7.72 2.03 -1.88 -2.12 116.42 125.21 1ffv h ASP 436 Ca -0.45 -0.48 0.14 0.00 -0.73 0.00 0.00 57.03 55.51 1ffv h ASP 436 Cb 1.23 -0.11 -0.15 0.00 -0.83 0.00 0.00 39.33 39.47 1ffv h ASP 436 CO 0.94 0.78 0.54 -0.94 -1.03 0.00 0.00 179.24 179.53 1ffv s SER 437 N -6.13 -0.30 -0.20 4.15 1.04 -1.26 -4.28 113.70 106.72 1ffv s SER 437 Ca -0.14 -0.06 -0.36 0.00 0.48 0.00 0.00 55.95 55.87 1ffv s SER 437 Cb 0.05 0.36 0.15 0.00 0.10 0.00 0.00 66.02 66.68 1ffv s SER 437 CO 0.75 -0.60 1.34 -0.83 0.98 0.00 0.00 173.24 174.88 1ffv s GLY 438 N -2.52 -0.30 -0.47 7.32 0.00 -1.26 -4.86 107.32 105.22 1ffv s GLY 438 Ca 0.07 1.53 0.06 0.00 0.00 0.00 0.00 44.72 46.38 1ffv s GLY 438 CO -0.07 0.47 0.81 1.34 0.00 0.00 0.00 173.10 175.65 1ffv n ASP 439 N -0.17 -2.27 -0.19 1.64 -0.08 -1.26 -4.44 116.55 109.78 1ffv n ASP 439 Ca -0.00 -3.18 -0.05 0.00 -1.51 0.00 0.00 54.79 50.05 1ffv n ASP 439 Cb 0.59 1.32 0.12 0.00 2.34 0.00 0.00 41.12 45.49 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 4.01 1.02 0.16 -0.67 0.05 -1.97 -3.15 116.97 116.42 1ffv h TYR 440 Ca -0.10 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.56 1ffv h TYR 440 Cb 1.00 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 38.45 1ffv h TYR 440 CO 0.09 0.84 -0.08 0.45 -1.05 0.00 0.00 178.16 178.41 1ffv h HIS 441 N 0.93 -0.21 -0.77 4.88 3.86 -1.96 -1.48 115.15 120.42 1ffv h HIS 441 Ca 0.20 -0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.47 1ffv h HIS 441 Cb 0.34 0.07 -0.06 0.00 1.06 0.00 0.00 27.41 28.82 1ffv h HIS 441 CO 0.02 -0.13 0.44 1.15 0.86 0.00 0.00 177.93 180.28 1ffv h THR 442 N -0.22 0.97 -0.38 2.45 2.02 -2.00 -1.98 112.91 113.77 1ffv h THR 442 Ca -0.02 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 66.82 1ffv h THR 442 Cb 0.17 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 1ffv h THR 442 CO 0.03 0.15 -0.01 0.00 0.37 0.00 0.00 175.52 176.05 1ffv h ALA 443 N 1.39 0.51 -0.18 6.16 0.00 -1.48 -2.25 119.26 123.41 1ffv h ALA 443 Ca 0.35 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ffv h ALA 443 Cb 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ffv h ALA 443 CO -0.20 0.30 0.09 1.25 0.00 0.00 0.00 179.25 180.70 1ffv h LEU 444 N 0.50 0.15 -1.02 0.00 5.85 -0.92 -1.32 115.31 118.55 1ffv h LEU 444 Ca 0.11 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.86 1ffv h LEU 444 Cb 0.49 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 1ffv h LEU 444 CO 0.02 0.11 0.66 0.50 -0.34 0.00 0.00 178.44 179.39 1ffv h LYS 445 N 0.20 1.25 -0.47 1.25 3.64 -1.33 -0.22 116.57 120.89 1ffv h LYS 445 Ca 0.07 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1ffv h LYS 445 Cb 0.01 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.53 1ffv h LYS 445 CO -0.05 0.83 0.27 -0.22 -2.27 0.00 0.00 179.45 178.01 1ffv h LYS 446 N 1.29 0.65 -0.17 1.90 3.64 -0.76 -1.18 116.57 121.94 1ffv h LYS 446 Ca 0.39 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.63 1ffv h LYS 446 Cb -0.04 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1ffv h LYS 446 CO -0.11 0.50 -0.15 0.28 -2.27 0.00 0.00 179.45 177.69 1ffv h VAL 447 N 0.63 1.33 -0.76 2.00 2.07 -0.75 -2.34 116.25 118.43 1ffv h VAL 447 Ca 0.17 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.42 1ffv h VAL 447 Cb 0.02 1.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 1ffv h VAL 447 CO -0.03 0.39 0.49 -0.07 0.02 0.00 0.00 177.57 178.36 1ffv h LEU 448 N 0.07 0.80 -0.41 2.57 3.38 -0.92 -2.30 115.31 118.50 1ffv h LEU 448 Ca 0.03 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1ffv h LEU 448 Cb 0.68 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1ffv h LEU 448 CO 0.04 0.56 -0.04 0.44 0.09 0.00 0.00 178.44 179.53 1ffv h ASP 449 N 0.95 0.75 -0.75 -0.43 3.45 -1.23 -0.80 116.42 118.37 1ffv h ASP 449 Ca 0.30 -0.33 -0.00 0.00 0.43 0.00 0.00 57.03 57.43 1ffv h ASP 449 Cb 0.00 -0.20 -0.04 0.00 -0.56 0.00 0.00 39.33 38.53 1ffv h ASP 449 CO -0.11 0.90 0.46 0.00 -1.57 0.00 0.00 179.24 178.92 1ffv h ALA 450 N 0.88 1.39 -0.02 3.45 0.00 -1.06 -2.59 119.26 121.31 1ffv h ALA 450 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ffv h ALA 450 Cb 0.54 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ffv h ALA 450 CO 0.03 0.53 -0.13 1.33 0.00 0.00 0.00 179.25 181.01 1ffv n VAL 451 N -4.39 0.00 -3.49 0.00 0.24 -0.90 -4.98 118.33 104.82 1ffv n VAL 451 Ca 0.08 -0.35 -0.22 0.00 -2.04 0.00 0.00 64.34 61.81 1ffv n VAL 451 Cb 0.06 1.10 0.06 0.00 -1.47 0.00 0.00 33.84 33.59 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 0.58 -4.78 -0.30 -1.34 -0.08 -0.52 -4.72 116.55 105.39 1ffv n ASP 452 Ca 0.14 -0.82 0.00 0.00 -1.51 0.00 0.00 54.79 52.60 1ffv n ASP 452 Cb 0.49 -4.41 0.06 0.00 2.34 0.00 0.00 41.12 39.60 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 -1.56 -0.76 -0.78 -0.67 3.20 -1.48 -0.16 116.97 114.76 1ffv h TYR 453 Ca -0.63 0.08 0.06 0.00 3.14 0.00 0.00 58.73 61.39 1ffv h TYR 453 Cb 1.34 0.46 -0.05 0.00 1.54 0.00 0.00 36.73 40.02 1ffv h TYR 453 CO 0.36 -0.38 0.51 -1.00 -1.64 0.00 0.00 178.16 176.01 1ffv h PRO 454 N -0.04 0.83 -0.62 1.82 0.13 -1.90 -0.36 132.00 131.85 1ffv h PRO 454 Ca 0.35 -0.05 -0.08 0.00 -0.87 0.00 0.00 66.00 65.35 1ffv h PRO 454 Cb 0.60 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 1ffv h PRO 454 CO -0.87 0.55 0.06 0.00 -0.23 0.00 0.00 178.00 177.51 1ffv h ALA 455 N 1.57 0.94 0.12 -0.56 0.00 -1.39 -1.69 119.26 118.25 1ffv h ALA 455 Ca 0.34 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ffv h ALA 455 Cb 0.23 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ffv h ALA 455 CO -0.12 0.65 -0.06 -0.07 0.00 0.00 0.00 179.25 179.66 1ffv h LEU 456 N 0.97 -0.14 -1.54 0.00 4.07 -0.60 -0.38 115.31 117.69 1ffv h LEU 456 Ca 0.19 -0.00 0.02 0.00 0.08 0.00 0.00 57.88 58.16 1ffv h LEU 456 Cb 0.47 0.04 -0.03 0.00 1.08 0.00 0.00 40.66 42.22 1ffv h LEU 456 CO 0.02 -0.09 0.33 0.03 -1.08 0.00 0.00 178.44 177.64 1ffv h ARG 457 N -0.17 0.60 -0.29 1.13 2.47 -0.91 -0.84 114.38 116.36 1ffv h ARG 457 Ca -0.02 -0.04 -0.17 0.00 -1.26 0.00 0.00 59.98 58.50 1ffv h ARG 457 Cb 0.13 -0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1ffv h ARG 457 CO 0.03 0.40 -0.49 0.00 0.56 0.00 0.00 179.97 180.47 1ffv h ALA 458 N 1.70 0.45 -0.71 0.04 0.00 -0.92 -0.46 119.26 119.37 1ffv h ALA 458 Ca 0.19 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1ffv h ALA 458 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1ffv h ALA 458 CO -0.04 0.62 0.33 1.49 0.00 0.00 0.00 179.25 181.64 1ffv h GLU 459 N 0.62 1.02 -0.51 0.00 4.81 -0.46 -0.69 114.58 119.37 1ffv h GLU 459 Ca 0.02 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 1ffv h GLU 459 Cb 1.09 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 1ffv h GLU 459 CO 0.11 0.82 0.28 0.37 -0.73 0.00 0.00 179.01 179.85 1ffv h GLN 460 N 0.99 0.72 -0.71 1.92 4.15 -1.01 -1.27 115.11 119.90 1ffv h GLN 460 Ca 0.24 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.54 1ffv h GLN 460 Cb 0.14 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 1ffv h GLN 460 CO -0.03 0.56 0.32 0.00 -1.93 0.00 0.00 178.83 177.75 1ffv h ALA 461 N 1.11 0.91 -0.11 3.38 0.00 -0.69 -0.94 119.26 122.94 1ffv h ALA 461 Ca 0.18 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ffv h ALA 461 Cb 0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1ffv h ALA 461 CO -0.03 0.50 -0.25 0.00 0.00 0.00 0.00 179.25 179.48 1ffv h ALA 462 N 1.15 1.39 0.09 0.00 0.00 -0.84 -2.50 119.26 118.55 1ffv h ALA 462 Ca 0.24 -0.28 -0.29 0.00 0.00 0.00 0.00 54.91 54.58 1ffv h ALA 462 Cb 0.15 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.89 1ffv h ALA 462 CO -0.03 0.43 -1.19 -0.09 0.00 0.00 0.00 179.25 178.38 1ffv h ARG 463 N 0.17 0.60 0.00 0.00 2.43 -0.62 -3.23 114.38 113.72 1ffv h ARG 463 Ca 0.03 -0.76 -0.06 0.00 -0.81 0.00 0.00 59.98 58.38 1ffv h ARG 463 Cb 0.54 0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.32 1ffv h ARG 463 CO 0.04 1.34 -0.28 0.00 -1.51 0.00 0.00 179.97 179.55 1ffv h ARG 464 N 0.28 0.00 -0.32 0.20 3.08 -1.09 -2.70 114.38 113.82 1ffv h ARG 464 Ca -0.17 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 1ffv h ARG 464 Cb 1.85 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.89 1ffv h ARG 464 CO 0.22 0.28 -0.03 0.00 -1.07 0.00 0.00 179.97 179.37 1ffv h ALA 465 N 1.72 1.35 -2.14 0.04 0.00 -1.47 -3.38 119.26 115.39 1ffv h ALA 465 Ca -0.00 -0.22 -0.65 0.00 0.00 0.00 0.00 54.91 54.04 1ffv h ALA 465 Cb 0.58 -0.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.08 1ffv h ALA 465 CO 0.04 0.44 0.19 0.34 0.00 0.00 0.00 179.25 180.26 1ffv s ASP 466 N -6.75 6.34 0.00 0.00 -1.08 -1.02 -4.91 116.67 109.25 1ffv s ASP 466 Ca -0.07 -0.30 0.19 0.00 -0.52 0.00 0.00 52.55 51.85 1ffv s ASP 466 Cb 0.15 -2.34 1.04 0.00 -1.46 0.00 0.00 42.92 40.31 1ffv s ASP 466 CO 0.77 -0.83 1.56 -0.81 0.52 0.00 0.00 175.17 176.38 1ffv n PRO 467 N 6.40 0.42 -0.01 4.34 -0.04 -1.26 -2.57 135.00 142.28 1ffv n PRO 467 Ca -0.01 0.06 0.10 0.00 -0.04 0.00 0.00 63.50 63.61 1ffv n PRO 467 Cb 0.48 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.53 1ffv n PRO 467 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ffv n ASN 468 N -1.16 2.66 -4.68 3.54 5.03 -1.26 -4.97 115.26 114.42 1ffv n ASN 468 Ca 0.11 -1.82 -0.44 0.00 0.87 0.00 0.00 54.58 53.31 1ffv n ASN 468 Cb 0.11 -0.01 -0.04 0.00 -1.02 0.00 0.00 39.78 38.82 1ffv n ASN 468 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1ffv n SER 469 N 1.10 3.85 0.21 6.41 7.64 -1.06 -4.85 113.62 126.92 1ffv n SER 469 Ca 0.12 0.98 0.15 0.00 1.01 0.00 0.00 58.87 61.12 1ffv n SER 469 Cb 0.49 -1.49 0.69 0.00 -1.01 0.00 0.00 64.21 62.89 1ffv n SER 469 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1ffv h PRO 470 N 8.79 0.00 -5.35 1.43 0.13 -1.93 -3.44 132.00 131.63 1ffv h PRO 470 Ca -0.47 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.26 1ffv h PRO 470 Cb 1.24 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 1ffv h PRO 470 CO 0.94 0.00 -0.73 0.95 -0.23 0.00 0.00 178.00 178.93 1ffv s THR 471 N -3.60 1.48 -0.04 1.56 -4.23 -1.26 -1.73 115.64 107.82 1ffv s THR 471 Ca 0.00 -2.13 0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1ffv s THR 471 Cb 0.09 -1.94 -0.03 0.00 1.34 0.00 0.00 72.50 71.96 1ffv s THR 471 CO 0.38 -0.65 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.00 1ffv s LEU 472 N -3.22 3.29 -0.18 4.79 1.43 -0.52 -4.91 118.68 119.36 1ffv s LEU 472 Ca 0.19 -0.02 -0.05 0.00 -1.03 0.00 0.00 54.13 53.22 1ffv s LEU 472 Cb 0.01 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 1ffv s LEU 472 CO 0.04 0.33 0.00 -0.32 0.23 0.00 0.00 176.35 176.63 1ffv s MET 473 N -1.09 3.71 0.01 1.70 -2.45 -1.26 -0.98 119.30 118.94 1ffv s MET 473 Ca 0.15 -0.48 0.07 0.00 -1.25 0.00 0.00 55.69 54.18 1ffv s MET 473 Cb -0.11 -3.05 -0.02 0.00 1.25 0.00 0.00 34.83 32.90 1ffv s MET 473 CO 0.04 0.15 -0.22 0.20 1.05 0.00 0.00 175.02 176.24 1ffv s GLY 474 N 0.65 1.12 -0.15 2.11 0.00 0.36 -4.28 107.32 107.13 1ffv s GLY 474 Ca -0.00 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.70 1ffv s GLY 474 CO 0.02 -0.89 -0.10 -0.42 0.00 0.00 0.00 173.10 171.71 1ffv s ILE 475 N -0.65 1.35 -0.04 0.90 1.01 -1.25 -0.92 121.20 121.60 1ffv s ILE 475 Ca 0.08 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.17 1ffv s ILE 475 Cb -0.09 -1.36 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 1ffv s ILE 475 CO 0.00 0.33 -0.09 -0.83 0.00 0.00 0.00 174.94 174.36 1ffv s GLY 476 N 1.56 1.67 -0.04 6.18 0.00 0.35 -4.25 107.32 112.79 1ffv s GLY 476 Ca 0.03 -0.95 -0.01 0.00 0.00 0.00 0.00 44.72 43.79 1ffv s GLY 476 CO -0.09 -0.75 0.07 -2.27 0.00 0.00 0.00 173.10 170.06 1ffv s LEU 477 N -0.95 0.97 -0.05 0.66 2.96 -1.26 -0.81 118.68 120.20 1ffv s LEU 477 Ca 0.13 0.13 0.01 0.00 -0.22 0.00 0.00 54.13 54.19 1ffv s LEU 477 Cb -0.11 0.09 0.02 0.00 0.50 0.00 0.00 46.19 46.69 1ffv s LEU 477 CO 0.03 -0.13 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.17 1ffv s VAL 478 N 1.08 0.72 -0.32 1.68 1.01 -0.41 -4.91 120.40 119.25 1ffv s VAL 478 Ca -0.09 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.70 1ffv s VAL 478 Cb -0.12 -0.71 0.09 0.00 0.00 0.00 0.00 36.38 35.64 1ffv s VAL 478 CO -0.04 0.27 0.04 0.42 0.00 0.00 0.00 175.10 175.78 1ffv s THR 479 N 0.89 1.90 0.33 3.92 -4.23 -1.26 -0.73 115.64 116.45 1ffv s THR 479 Ca -0.11 -1.97 0.10 0.00 -1.18 0.00 0.00 61.69 58.53 1ffv s THR 479 Cb -0.15 -2.35 -0.06 0.00 1.34 0.00 0.00 72.50 71.29 1ffv s THR 479 CO 0.01 -0.51 -0.06 0.72 -0.54 0.00 0.00 174.62 174.23 1ffv s PHE 480 N 1.12 2.47 -0.11 3.99 -0.71 -0.64 -4.52 117.98 119.57 1ffv s PHE 480 Ca 0.07 -0.42 0.01 0.00 -1.04 0.00 0.00 56.93 55.55 1ffv s PHE 480 Cb -0.19 -1.34 0.02 0.00 -1.21 0.00 0.00 43.02 40.30 1ffv s PHE 480 CO -0.11 0.57 -0.11 0.99 -1.34 0.00 0.00 175.22 175.22 1ffv s THR 481 N -2.53 1.20 0.36 -4.49 2.01 -1.26 -1.67 115.64 109.26 1ffv s THR 481 Ca 0.33 -0.44 0.03 0.00 0.31 0.00 0.00 61.69 61.92 1ffv s THR 481 Cb -0.01 -1.16 -0.02 0.00 0.01 0.00 0.00 72.50 71.33 1ffv s THR 481 CO 0.18 0.39 0.54 -1.61 -0.69 0.00 0.00 174.62 173.42 1ffv s GLU 482 N 1.32 3.27 -0.27 4.92 0.41 0.30 -4.90 118.70 123.75 1ffv s GLU 482 Ca -0.01 -0.60 -0.04 0.00 -0.41 0.00 0.00 54.97 53.91 1ffv s GLU 482 Cb -0.14 -2.70 0.09 0.00 -1.78 0.00 0.00 34.13 29.60 1ffv s GLU 482 CO -0.05 0.05 0.11 0.54 -0.49 0.00 0.00 175.26 175.42 1ffv s VAL 483 N -2.30 0.12 0.11 2.63 0.11 -1.26 -3.64 120.40 116.17 1ffv s VAL 483 Ca 0.43 -0.78 0.05 0.00 -2.93 0.00 0.00 61.98 58.74 1ffv s VAL 483 Cb -0.10 -1.05 -0.04 0.00 -1.53 0.00 0.00 36.38 33.67 1ffv s VAL 483 CO 0.34 -0.64 -0.12 0.68 -3.33 0.00 0.00 175.10 172.03 1ffv s VAL 484 N 2.01 1.16 0.00 2.04 -7.23 -0.33 -4.92 120.40 113.13 1ffv s VAL 484 Ca 0.08 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1ffv s VAL 484 Cb -0.16 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.35 1ffv s VAL 484 CO -0.30 -0.46 0.00 0.61 -0.31 0.00 0.00 175.10 174.64 1ffv n GLY 485 N 0.60 0.91 3.50 2.32 0.00 -1.21 -0.76 105.19 110.55 1ffv n GLY 485 Ca -0.16 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.28 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 0.17 0.21 4.61 0.00 -1.26 -4.69 120.51 119.55 1ffv n ALA 486 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1ffv n ALA 486 Cb 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.21 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 5.86 -1.40 1.95 0.00 0.00 -1.25 -4.74 105.19 105.61 1ffv n GLY 487 Ca 0.40 0.26 -0.24 0.00 0.00 0.00 0.00 46.02 46.44 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 -3.42 0.00 0.18 1.61 -0.02 -1.21 -3.17 135.00 128.97 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 -0.84 0.78 0.00 -0.02 0.00 0.00 33.50 33.42 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 6.57 0.00 -0.92 2.55 4.64 -1.83 0.55 113.55 125.11 1ffv h SER 489 Ca -0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1ffv h SER 489 Cb 0.74 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.78 1ffv h SER 489 CO 0.76 0.00 0.56 0.50 -0.87 0.00 0.00 176.83 177.78 1ffv h LYS 490 N 0.00 1.25 0.00 4.77 3.64 -1.96 -3.33 116.57 120.95 1ffv h LYS 490 Ca 0.13 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1ffv h LYS 490 Cb 0.90 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1ffv h LYS 490 CO -0.00 0.87 -1.24 0.00 -2.27 0.00 0.00 179.45 176.81 1ffv n MET 491 N -4.36 0.79 -4.41 1.90 0.00 -0.38 -5.01 117.12 105.65 1ffv n MET 491 Ca 0.10 -0.04 -0.34 0.00 0.00 0.00 0.00 57.70 57.43 1ffv n MET 491 Cb 0.06 -1.12 -0.14 0.00 0.00 0.00 0.00 33.22 32.02 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 0.80 -0.56 -0.31 0.00 1.47 -1.26 -1.79 116.67 115.01 1ffv s ASP 493 Ca -0.04 0.67 -0.05 0.00 1.18 0.00 0.00 52.55 54.31 1ffv s ASP 493 Cb -0.15 0.60 0.03 0.00 -0.34 0.00 0.00 42.92 43.06 1ffv s ASP 493 CO 0.01 -0.52 0.06 -0.63 0.68 0.00 0.00 175.17 174.77 1ffv s ILE 494 N -1.01 3.56 -1.41 2.11 -1.09 0.07 -0.61 121.20 122.82 1ffv s ILE 494 Ca -0.10 -1.07 -0.11 0.00 -2.23 0.00 0.00 60.65 57.15 1ffv s ILE 494 Cb -0.02 -2.95 0.08 0.00 -1.58 0.00 0.00 42.46 37.99 1ffv s ILE 494 CO 0.08 -0.06 0.64 0.18 -1.23 0.00 0.00 174.94 174.54 1ffv n LEU 495 N 4.77 -1.89 0.00 2.97 4.77 -1.26 -1.09 117.00 125.27 1ffv n LEU 495 Ca -0.14 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1ffv n LEU 495 Cb 0.45 -2.30 0.00 0.00 -2.33 0.00 0.00 43.42 39.24 1ffv n LEU 495 CO 0.30 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1ffv n GLY 496 N -1.34 0.83 3.66 -0.72 0.00 -1.26 -5.05 105.19 101.31 1ffv n GLY 496 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.26 5.16 0.49 1.61 1.01 -0.25 -5.03 120.40 121.14 1ffv s VAL 497 Ca 0.00 0.77 -0.23 0.00 0.00 0.00 0.00 61.98 62.53 1ffv s VAL 497 Cb 0.00 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 1ffv s VAL 497 CO 0.00 0.21 1.19 0.61 0.00 0.00 0.00 175.10 177.11 1ffv n GLY 498 N 4.01 0.30 2.28 4.51 0.00 -1.26 -0.75 105.19 114.28 1ffv n GLY 498 Ca -0.07 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.45 3.21 -1.68 1.61 0.00 -0.74 -4.81 117.12 114.25 1ffv n MET 499 Ca 0.10 -2.13 -0.11 0.00 0.00 0.00 0.00 57.70 55.56 1ffv n MET 499 Cb 0.42 -2.44 0.05 0.00 0.00 0.00 0.00 33.22 31.26 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 2.51 -3.04 -3.94 2.03 1.16 -1.26 -3.75 117.46 111.17 1ffv n PHE 500 Ca 0.61 -0.92 -0.10 0.00 -1.87 0.00 0.00 57.45 55.18 1ffv n PHE 500 Cb 0.48 -0.34 -0.03 0.00 -1.61 0.00 0.00 39.48 37.98 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 -2.97 0.10 0.21 5.98 2.15 -1.01 -3.91 116.67 117.22 1ffv s ASP 501 Ca 0.32 -1.03 -0.05 0.00 0.43 0.00 0.00 52.55 52.23 1ffv s ASP 501 Cb -0.02 0.69 -0.03 0.00 -0.30 0.00 0.00 42.92 43.27 1ffv s ASP 501 CO 0.21 -1.34 0.25 -0.94 -0.17 0.00 0.00 175.17 173.18 1ffv s SER 502 N -3.05 0.07 -0.20 -0.34 1.04 -1.26 -0.27 113.70 109.69 1ffv s SER 502 Ca 0.20 -1.21 -0.16 0.00 0.48 0.00 0.00 55.95 55.26 1ffv s SER 502 Cb -0.03 0.45 0.06 0.00 0.10 0.00 0.00 66.02 66.60 1ffv s SER 502 CO 0.11 -0.94 0.52 0.00 0.98 0.00 0.00 173.24 173.92 1ffv s GLU 504 N 0.69 2.33 -0.04 0.00 2.12 0.05 -1.15 118.70 122.70 1ffv s GLU 504 Ca -0.03 -0.61 0.05 0.00 0.36 0.00 0.00 54.97 54.74 1ffv s GLU 504 Cb -0.05 -1.93 -0.01 0.00 0.26 0.00 0.00 34.13 32.40 1ffv s GLU 504 CO -0.05 -0.02 -0.20 0.42 -0.54 0.00 0.00 175.26 174.88 1ffv s ILE 505 N 0.86 1.61 -0.10 -3.70 1.01 -0.14 -1.19 121.20 119.56 1ffv s ILE 505 Ca -0.09 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 1ffv s ILE 505 Cb -0.15 -1.37 0.03 0.00 0.01 0.00 0.00 42.46 40.97 1ffv s ILE 505 CO 0.00 0.46 -0.06 -0.60 0.00 0.00 0.00 174.94 174.74 1ffv s ARG 506 N -0.07 1.27 -0.07 2.79 3.52 -0.53 -0.97 118.95 124.88 1ffv s ARG 506 Ca -0.02 -0.16 -0.18 0.00 -0.13 0.00 0.00 55.73 55.24 1ffv s ARG 506 Cb -0.12 -1.40 -0.05 0.00 -1.56 0.00 0.00 34.95 31.83 1ffv s ARG 506 CO 0.02 -0.27 0.47 0.42 -0.81 0.00 0.00 175.30 175.14 1ffv s ILE 507 N 1.74 5.11 0.56 4.11 1.09 -0.18 -2.10 121.20 131.53 1ffv s ILE 507 Ca 0.04 0.96 -0.07 0.00 -1.10 0.00 0.00 60.65 60.48 1ffv s ILE 507 Cb -0.13 -3.81 -0.03 0.00 -1.06 0.00 0.00 42.46 37.44 1ffv s ILE 507 CO -0.07 0.40 0.90 -1.00 -0.10 0.00 0.00 174.94 175.07 1ffv s HIS 508 N 0.11 3.51 0.46 3.97 3.76 -0.38 -4.47 115.29 122.24 1ffv s HIS 508 Ca 0.26 0.93 0.23 0.00 -0.15 0.00 0.00 55.06 56.33 1ffv s HIS 508 Cb -0.16 -2.56 1.24 0.00 1.11 0.00 0.00 32.58 32.21 1ffv s HIS 508 CO 0.12 -0.56 1.85 -1.35 -0.85 0.00 0.00 174.74 173.95 1ffv h PRO 509 N -0.07 0.25 -0.29 8.40 0.11 -1.88 -1.73 132.00 136.78 1ffv h PRO 509 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ffv h PRO 509 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ffv h PRO 509 CO 0.62 0.16 0.00 0.25 -0.21 0.00 0.00 178.00 178.82 1ffv n THR 510 N -4.44 0.38 0.00 -1.15 -2.24 -1.26 -3.03 114.28 102.54 1ffv n THR 510 Ca 0.20 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1ffv n THR 510 Cb 0.83 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 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 1.24 2.77 3.95 3.38 0.00 -0.65 -4.94 105.19 110.93 1ffv n GLY 511 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1ffv n GLY 511 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ffv s SER 512 N -0.60 3.23 0.18 1.61 1.04 -1.26 -4.79 113.70 113.10 1ffv s SER 512 Ca 0.00 0.09 -0.17 0.00 0.48 0.00 0.00 55.95 56.35 1ffv s SER 512 Cb 0.00 -0.15 0.03 0.00 0.10 0.00 0.00 66.02 66.00 1ffv s SER 512 CO 0.00 -2.64 0.48 0.00 0.98 0.00 0.00 173.24 172.06 1ffv s ALA 513 N -3.78 -0.90 0.00 5.32 0.00 -1.06 -1.25 121.76 120.09 1ffv s ALA 513 Ca 0.74 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.56 1ffv s ALA 513 Cb -0.03 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 23.89 1ffv s ALA 513 CO 0.52 -0.76 -0.20 -1.50 0.00 0.00 0.00 175.76 173.82 1ffv s ILE 514 N -3.86 1.62 0.00 0.00 2.07 -0.89 -0.73 121.20 119.41 1ffv s ILE 514 Ca 0.08 -0.97 0.01 0.00 -1.41 0.00 0.00 60.65 58.36 1ffv s ILE 514 Cb -0.00 -1.37 -0.00 0.00 0.13 0.00 0.00 42.46 41.22 1ffv s ILE 514 CO -0.05 0.38 -0.02 0.00 -1.91 0.00 0.00 174.94 173.33 1ffv s ALA 515 N -0.58 0.19 -0.00 1.50 0.00 0.68 -1.45 121.76 122.09 1ffv s ALA 515 Ca 0.08 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 51.89 1ffv s ALA 515 Cb -0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 1ffv s ALA 515 CO 0.00 0.02 -0.09 1.03 0.00 0.00 0.00 175.76 176.72 1ffv s ARG 516 N -0.26 0.71 0.30 0.00 0.52 -0.33 -1.13 118.95 118.76 1ffv s ARG 516 Ca -0.01 -0.34 0.07 0.00 -0.52 0.00 0.00 55.73 54.93 1ffv s ARG 516 Cb -0.02 -0.69 -0.06 0.00 0.52 0.00 0.00 34.95 34.70 1ffv s ARG 516 CO -0.00 0.19 -0.06 -1.64 0.02 0.00 0.00 175.30 173.80 1ffv s MET 517 N -0.26 1.62 0.00 3.54 -1.94 -1.15 -0.77 119.30 120.33 1ffv s MET 517 Ca 0.03 -1.83 0.19 0.00 -1.71 0.00 0.00 55.69 52.37 1ffv s MET 517 Cb -0.04 -1.28 0.82 0.00 2.01 0.00 0.00 34.83 36.34 1ffv s MET 517 CO -0.00 0.05 1.56 0.41 -0.01 0.00 0.00 175.02 177.03 1ffv n GLY 518 N -0.64 -0.18 2.93 -0.03 0.00 -0.86 -4.43 105.19 101.99 1ffv n GLY 518 Ca -0.05 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.07 0.00 -3.22 2.61 -2.24 -1.26 -2.07 114.28 108.02 1ffv n THR 519 Ca 0.14 -1.18 -0.01 0.00 -2.27 0.00 0.00 64.05 60.74 1ffv n THR 519 Cb 0.22 -1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 67.40 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 -2.29 -0.86 0.73 2.28 1.10 -1.26 -3.64 121.20 117.27 1ffv s ILE 520 Ca 0.50 -0.04 -0.14 0.00 -0.51 0.00 0.00 60.65 60.46 1ffv s ILE 520 Cb -0.03 -0.95 0.04 0.00 0.15 0.00 0.00 42.46 41.68 1ffv s ILE 520 CO 0.33 -0.06 1.16 0.28 -2.11 0.00 0.00 174.94 174.54 1ffv s THR 521 N 2.74 2.68 -0.03 4.00 -1.32 -1.26 -4.37 115.64 118.08 1ffv s THR 521 Ca 0.16 0.30 0.25 0.00 -1.21 0.00 0.00 61.69 61.20 1ffv s THR 521 Cb -0.14 -2.78 0.44 0.00 -1.51 0.00 0.00 72.50 68.51 1ffv s THR 521 CO -0.21 -0.21 1.17 0.00 -2.21 0.00 0.00 174.62 173.16 1ffv n GLN 522 N -2.89 0.21 0.00 7.08 6.02 -1.26 -4.66 117.38 121.88 1ffv n GLN 522 Ca 0.12 -2.18 0.00 0.00 -0.01 0.00 0.00 57.00 54.93 1ffv n GLN 522 Cb 0.51 -0.20 0.00 0.00 1.02 0.00 0.00 30.24 31.57 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 0.34 1.31 0.00 1.08 0.00 -1.26 -3.01 105.19 103.65 1ffv n GLY 523 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.15 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 0.75 -1.60 1.61 0.00 -1.26 -4.90 117.38 111.98 1ffv n GLN 524 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 57.00 56.99 1ffv n GLN 524 Cb 0.00 -1.26 -0.00 0.00 0.00 0.00 0.00 30.24 28.97 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 0.38 0.38 0.37 2.61 0.00 -1.26 -4.96 105.19 102.72 1ffv n GLY 525 Ca 0.10 -0.94 0.13 0.00 0.00 0.00 0.00 46.02 45.30 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 0.71 0.00 1.61 3.86 -1.98 -0.61 115.15 118.74 1ffv h HIS 526 Ca -0.02 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1ffv h HIS 526 Cb 0.62 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 1ffv h HIS 526 CO 0.02 0.28 -0.00 1.96 0.86 0.00 0.00 177.93 181.05 1ffv h GLN 527 N 0.61 0.00 0.00 2.45 4.20 -1.93 0.26 115.11 120.70 1ffv h GLN 527 Ca 0.41 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.96 1ffv h GLN 527 Cb 0.72 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 1ffv h GLN 527 CO -0.17 0.00 -1.46 2.41 -0.67 0.00 0.00 178.83 178.95 1ffv n THR 528 N -3.10 1.50 -0.26 -0.54 -1.04 -0.35 -4.30 114.28 106.20 1ffv n THR 528 Ca -0.02 -0.03 -0.06 0.00 -2.04 0.00 0.00 64.05 61.90 1ffv n THR 528 Cb 0.14 -2.18 0.05 0.00 -1.82 0.00 0.00 70.33 66.52 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 -1.00 1.22 -0.83 12.58 1.35 -1.23 -2.31 112.91 122.69 1ffv h THR 529 Ca -0.25 -0.56 -0.01 0.00 -0.55 0.00 0.00 66.41 65.03 1ffv h THR 529 Cb 1.16 0.27 -0.04 0.00 -1.73 0.00 0.00 68.15 67.82 1ffv h THR 529 CO -0.15 0.25 0.46 1.88 -0.25 0.00 0.00 175.52 177.71 1ffv h TYR 530 N 1.00 1.12 -0.55 4.73 -1.99 -1.17 -1.89 116.97 118.22 1ffv h TYR 530 Ca 0.25 -0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.93 1ffv h TYR 530 Cb 0.04 -0.36 -0.03 0.00 2.00 0.00 0.00 36.73 38.39 1ffv h TYR 530 CO -0.00 0.77 0.20 0.00 -0.00 0.00 0.00 178.16 179.12 1ffv h ALA 531 N 1.36 1.31 -0.58 3.88 0.00 -1.59 -2.73 119.26 120.90 1ffv h ALA 531 Ca 0.29 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1ffv h ALA 531 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ffv h ALA 531 CO -0.05 0.50 -0.01 1.96 0.00 0.00 0.00 179.25 181.65 1ffv h GLN 532 N 0.79 1.04 0.45 0.00 4.20 -0.84 -0.55 115.11 120.20 1ffv h GLN 532 Ca 0.19 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 1ffv h GLN 532 Cb 0.19 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1ffv h GLN 532 CO -0.01 1.03 -0.28 0.82 -0.67 0.00 0.00 178.83 179.71 1ffv h ILE 533 N 0.93 0.42 -0.81 2.54 2.04 -1.16 -2.56 117.51 118.91 1ffv h ILE 533 Ca 0.16 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.04 1ffv h ILE 533 Cb 0.57 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1ffv h ILE 533 CO 0.03 0.00 0.54 0.40 0.00 0.00 0.00 178.15 179.12 1ffv h ILE 534 N -0.70 1.17 -0.44 -0.67 2.04 -1.48 -2.36 117.51 115.08 1ffv h ILE 534 Ca -0.05 -0.36 0.05 0.00 1.00 0.00 0.00 64.86 65.50 1ffv h ILE 534 Cb 0.57 0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.63 1ffv h ILE 534 CO 0.05 0.19 0.16 0.00 0.00 0.00 0.00 178.15 178.56 1ffv h ALA 535 N 1.51 0.52 -0.10 1.87 0.00 -0.81 -0.14 119.26 122.10 1ffv h ALA 535 Ca 0.31 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 1ffv h ALA 535 Cb -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ffv h ALA 535 CO -0.08 -0.22 -0.48 1.15 0.00 0.00 0.00 179.25 179.62 1ffv h THR 536 N 0.34 1.34 0.00 0.00 2.02 -1.11 0.13 112.91 115.63 1ffv h THR 536 Ca 0.20 -1.68 -0.07 0.00 0.77 0.00 0.00 66.41 65.64 1ffv h THR 536 Cb 0.18 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1ffv h THR 536 CO -0.20 0.50 -0.31 -0.33 0.37 0.00 0.00 175.52 175.55 1ffv h GLU 537 N 0.21 0.00 0.00 6.66 4.39 -0.84 -3.36 114.58 121.63 1ffv h GLU 537 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1ffv h GLU 537 Cb 0.92 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 1ffv h GLU 537 CO 0.07 0.31 0.00 1.28 -1.16 0.00 0.00 179.01 179.52 1ffv n LEU 538 N -3.37 0.49 -1.64 1.33 4.77 -0.14 -4.85 117.00 113.59 1ffv n LEU 538 Ca 0.01 -0.59 -0.12 0.00 -0.03 0.00 0.00 56.01 55.27 1ffv n LEU 538 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1ffv n LEU 538 CO 0.36 0.12 -0.05 0.61 -1.33 0.00 0.00 177.39 177.10 1ffv n GLY 539 N 0.20 -0.04 3.24 -0.72 0.00 0.44 -4.78 105.19 103.53 1ffv n GLY 539 Ca 0.00 -0.31 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.78 2.34 0.25 -0.61 1.01 -1.18 -4.74 121.20 115.49 1ffv s ILE 540 Ca 0.11 -0.90 -0.31 0.00 0.00 0.00 0.00 60.65 59.55 1ffv s ILE 540 Cb -0.05 -1.94 -0.12 0.00 0.01 0.00 0.00 42.46 40.36 1ffv s ILE 540 CO 0.14 0.54 1.55 -0.81 0.00 0.00 0.00 174.94 176.36 1ffv n PRO 541 N 3.77 2.44 0.01 2.79 -0.04 -1.26 -4.21 135.00 138.50 1ffv n PRO 541 Ca -0.19 0.87 0.21 0.00 -0.04 0.00 0.00 63.50 64.35 1ffv n PRO 541 Cb 0.52 -2.62 0.72 0.00 -0.04 0.00 0.00 33.50 32.08 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 4.96 0.00 0.03 3.54 4.64 -1.33 -1.97 113.55 123.42 1ffv h SER 542 Ca -0.46 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1ffv h SER 542 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1ffv h SER 542 CO 0.81 0.00 -0.01 -0.08 -0.87 0.00 0.00 176.83 176.68 1ffv h GLU 543 N 0.00 0.00 -0.28 4.77 4.57 -1.89 -2.42 114.58 119.34 1ffv h GLU 543 Ca 0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 1ffv h GLU 543 Cb 1.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 1ffv h GLU 543 CO -0.00 0.01 0.00 1.33 -1.18 0.00 0.00 179.01 179.17 1ffv n VAL 544 N -3.98 0.79 -3.20 0.32 0.24 -0.74 -4.82 118.33 106.93 1ffv n VAL 544 Ca -0.03 -0.89 -0.45 0.00 -2.04 0.00 0.00 64.34 60.92 1ffv n VAL 544 Cb 0.10 0.65 -0.05 0.00 -1.47 0.00 0.00 33.84 33.08 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 -0.98 5.01 -0.28 1.34 1.01 -0.91 -2.58 121.20 123.81 1ffv s ILE 545 Ca 0.21 -1.24 -0.26 0.00 0.00 0.00 0.00 60.65 59.35 1ffv s ILE 545 Cb 0.11 -4.42 0.00 0.00 0.01 0.00 0.00 42.46 38.17 1ffv s ILE 545 CO 0.15 -1.01 0.92 -1.10 0.00 0.00 0.00 174.94 173.90 1ffv s GLN 546 N 2.17 4.11 -0.01 2.79 -1.52 0.09 -4.78 119.66 122.50 1ffv s GLN 546 Ca 0.08 0.96 0.02 0.00 -1.95 0.00 0.00 55.36 54.46 1ffv s GLN 546 Cb -0.27 -3.69 -0.03 0.00 -0.22 0.00 0.00 33.01 28.80 1ffv s GLN 546 CO 0.05 -0.67 -0.04 0.14 -0.25 0.00 0.00 175.29 174.51 1ffv s VAL 547 N 3.13 3.87 0.05 1.09 -7.23 -1.26 -0.23 120.40 119.82 1ffv s VAL 547 Ca 0.38 -0.65 0.01 0.00 -1.81 0.00 0.00 61.98 59.91 1ffv s VAL 547 Cb -0.14 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 1ffv s VAL 547 CO 0.10 0.42 -0.05 -1.61 -0.31 0.00 0.00 175.10 173.66 1ffv s GLU 548 N -1.36 0.56 0.28 4.82 2.02 -0.28 -4.86 118.70 119.88 1ffv s GLU 548 Ca 0.17 -0.98 -0.05 0.00 0.02 0.00 0.00 54.97 54.13 1ffv s GLU 548 Cb -0.11 -0.02 -0.01 0.00 0.10 0.00 0.00 34.13 34.09 1ffv s GLU 548 CO 0.07 -0.04 0.41 -1.21 0.02 0.00 0.00 175.26 174.51 1ffv s GLU 549 N -2.74 1.65 0.00 1.61 2.02 -1.26 -2.95 118.70 117.04 1ffv s GLU 549 Ca -0.02 -1.58 0.00 0.00 0.02 0.00 0.00 54.97 53.40 1ffv s GLU 549 Cb -0.01 0.42 0.00 0.00 0.10 0.00 0.00 34.13 34.63 1ffv s GLU 549 CO -0.04 -0.66 0.00 0.41 0.02 0.00 0.00 175.26 174.98 1ffv n GLY 550 N -0.45 2.99 3.43 -1.39 0.00 -1.24 -4.88 105.19 103.65 1ffv n GLY 550 Ca 0.01 0.00 -0.44 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 -1.38 6.13 0.59 1.61 -1.08 -1.26 -1.01 116.67 120.27 1ffv s ASP 551 Ca 0.00 -1.09 0.40 0.00 -0.52 0.00 0.00 52.55 51.34 1ffv s ASP 551 Cb 0.00 -2.17 2.12 0.00 -1.46 0.00 0.00 42.92 41.41 1ffv s ASP 551 CO 0.00 -0.54 2.21 0.71 0.52 0.00 0.00 175.17 178.07 1ffv h THR 552 N 5.69 0.00 0.00 1.71 1.35 -1.68 0.17 112.91 120.15 1ffv h THR 552 Ca -0.28 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1ffv h THR 552 Cb 1.12 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1ffv h THR 552 CO 0.80 0.00 -0.34 -1.28 -0.25 0.00 0.00 175.52 174.45 1ffv h SER 553 N 0.00 0.00 0.00 5.36 0.87 -1.90 -3.40 113.55 114.47 1ffv h SER 553 Ca 0.00 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1ffv h SER 553 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1ffv h SER 553 CO 0.00 0.04 -0.90 0.35 -0.53 0.00 0.00 176.83 175.79 1ffv n THR 554 N -2.35 0.00 -2.95 2.23 -2.24 -0.52 -5.07 114.28 103.38 1ffv n THR 554 Ca 0.04 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.48 1ffv n THR 554 Cb 0.46 -0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 68.01 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 -1.90 3.19 0.57 6.98 0.00 0.48 -5.01 121.76 126.07 1ffv s ALA 555 Ca 0.00 0.27 -0.19 0.00 0.00 0.00 0.00 51.96 52.04 1ffv s ALA 555 Cb 0.00 -2.99 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 1ffv s ALA 555 CO 0.00 0.22 1.18 -1.25 0.00 0.00 0.00 175.76 175.92 1ffv s PRO 556 N -2.87 3.14 0.19 0.00 0.04 -1.26 -4.77 135.00 129.47 1ffv s PRO 556 Ca 0.56 1.76 -0.32 0.00 0.04 0.00 0.00 61.00 63.04 1ffv s PRO 556 Cb -0.11 -1.98 -0.12 0.00 0.04 0.00 0.00 34.50 32.32 1ffv s PRO 556 CO 0.16 -1.06 1.70 0.98 0.04 0.00 0.00 177.00 178.83 1ffv n TYR 557 N -1.43 2.63 -4.23 0.56 4.19 -1.26 -3.62 117.16 114.00 1ffv n TYR 557 Ca 0.13 0.08 -0.18 0.00 3.31 0.00 0.00 57.90 61.24 1ffv n TYR 557 Cb 0.50 -2.65 -0.07 0.00 0.49 0.00 0.00 39.34 37.61 1ffv n TYR 557 CO 0.00 0.00 0.00 0.20 0.91 0.00 0.00 176.86 177.97 1ffv s GLY 558 N 1.22 2.09 0.00 2.98 0.00 -1.25 -4.09 107.32 108.27 1ffv s GLY 558 Ca 0.77 -1.92 0.21 0.00 0.00 0.00 0.00 44.72 43.77 1ffv s GLY 558 CO 0.34 -1.35 1.42 1.04 0.00 0.00 0.00 173.10 174.55 1ffv n LEU 559 N -0.59 3.56 0.00 0.66 7.99 -1.23 -4.45 117.00 122.94 1ffv n LEU 559 Ca 0.06 -1.79 0.00 0.00 -0.01 0.00 0.00 56.01 54.27 1ffv n LEU 559 Cb 0.62 -0.35 0.00 0.00 -0.11 0.00 0.00 43.42 43.58 1ffv n LEU 559 CO 0.32 0.84 0.00 0.61 -1.51 0.00 0.00 177.39 177.65 1ffv n GLY 560 N 1.39 -2.18 3.05 -0.72 0.00 -0.88 -4.70 105.19 101.15 1ffv n GLY 560 Ca 0.20 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1ffv n GLY 560 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ffv s THR 561 N -0.35 1.84 0.03 2.61 -4.23 -0.45 -4.66 115.64 110.43 1ffv s THR 561 Ca 0.00 -0.96 -0.27 0.00 -1.18 0.00 0.00 61.69 59.27 1ffv s THR 561 Cb 0.00 -1.77 0.09 0.00 1.34 0.00 0.00 72.50 72.16 1ffv s THR 561 CO 0.00 0.35 0.80 -0.72 -0.54 0.00 0.00 174.62 174.51 1ffv s TYR 562 N 1.35 -0.42 -1.47 3.99 -0.85 -1.26 -4.90 117.35 113.79 1ffv s TYR 562 Ca 0.02 0.31 0.00 0.00 -0.52 0.00 0.00 57.07 56.88 1ffv s TYR 562 Cb -0.15 0.53 0.00 0.00 0.38 0.00 0.00 41.96 42.73 1ffv s TYR 562 CO -0.10 -0.62 0.00 0.41 -1.52 0.00 0.00 175.55 173.71 1ffv n GLY 563 N -0.17 0.74 3.67 5.49 0.00 -1.26 -2.65 105.19 111.01 1ffv n GLY 563 Ca -0.12 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.65 -3.57 0.08 1.61 7.64 -1.26 -3.35 113.62 114.12 1ffv n SER 564 Ca -0.16 -0.60 0.13 0.00 1.01 0.00 0.00 58.87 59.24 1ffv n SER 564 Cb 0.56 -2.94 0.35 0.00 -1.01 0.00 0.00 64.21 61.17 1ffv n SER 564 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1ffv n ARG 565 N -3.97 0.24 0.22 1.43 1.85 -1.08 -4.19 116.66 111.16 1ffv n ARG 565 Ca 0.02 0.16 -0.16 0.00 -1.00 0.00 0.00 57.85 56.87 1ffv n ARG 565 Cb 0.52 -1.74 -0.08 0.00 -1.05 0.00 0.00 32.46 30.11 1ffv n ARG 565 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1ffv h SER 566 N 0.00 -1.06 -0.35 2.89 0.02 -1.88 0.24 113.55 113.42 1ffv h SER 566 Ca 0.00 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 1ffv h SER 566 Cb 0.72 0.36 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 1ffv h SER 566 CO 0.00 -0.52 0.09 0.74 -1.14 0.00 0.00 176.83 176.00 1ffv h THR 567 N -0.76 1.22 0.18 -2.27 2.02 -1.92 0.30 112.91 111.69 1ffv h THR 567 Ca -0.02 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 1ffv h THR 567 Cb 0.70 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 1ffv h THR 567 CO -0.09 0.25 -0.09 -0.65 0.37 0.00 0.00 175.52 175.32 1ffv h PRO 568 N 0.41 -0.23 0.00 6.66 0.11 -1.74 -2.69 132.00 134.52 1ffv h PRO 568 Ca 0.11 0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 1ffv h PRO 568 Cb 0.30 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1ffv h PRO 568 CO 0.00 0.02 -0.59 0.28 -0.21 0.00 0.00 178.00 177.51 1ffv h VAL 569 N -0.48 0.46 -0.37 3.15 2.07 -0.59 -3.31 116.25 117.18 1ffv h VAL 569 Ca -0.02 -1.49 -0.15 0.00 0.82 0.00 0.00 66.70 65.86 1ffv h VAL 569 Cb 0.37 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1ffv h VAL 569 CO 0.04 0.15 -0.36 0.00 0.02 0.00 0.00 177.57 177.42 1ffv h ALA 570 N -0.75 0.65 -0.43 1.67 0.00 -1.18 -2.77 119.26 116.45 1ffv h ALA 570 Ca -0.10 -0.44 0.09 0.00 0.00 0.00 0.00 54.91 54.46 1ffv h ALA 570 Cb 0.70 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ffv h ALA 570 CO -0.06 0.67 0.30 0.78 0.00 0.00 0.00 179.25 180.94 1ffv h GLY 571 N 0.85 0.23 0.59 0.00 0.00 -0.12 0.11 103.07 104.73 1ffv h GLY 571 Ca 0.06 -0.07 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 1ffv h GLY 571 CO 0.09 0.04 -0.36 0.00 0.00 0.00 0.00 176.54 176.32 1ffv h ALA 572 N 1.78 0.06 -0.36 3.60 0.00 -1.60 -2.71 119.26 120.04 1ffv h ALA 572 Ca 0.20 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1ffv h ALA 572 Cb 0.57 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ffv h ALA 572 CO -0.03 0.18 0.15 0.00 0.00 0.00 0.00 179.25 179.54 1ffv h ALA 573 N 0.31 1.59 -0.23 0.00 0.00 -1.06 -0.30 119.26 119.56 1ffv h ALA 573 Ca -0.04 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1ffv h ALA 573 Cb 1.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1ffv h ALA 573 CO 0.07 0.32 0.01 0.82 0.00 0.00 0.00 179.25 180.47 1ffv h ILE 574 N 0.50 1.25 -0.53 0.00 2.04 -0.82 0.92 117.51 120.88 1ffv h ILE 574 Ca 0.13 -0.87 -0.11 0.00 1.00 0.00 0.00 64.86 65.00 1ffv h ILE 574 Cb 0.09 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1ffv h ILE 574 CO -0.01 0.27 -0.10 0.00 0.00 0.00 0.00 178.15 178.30 1ffv h ALA 575 N 0.81 0.81 -0.24 1.87 0.00 -1.11 -1.63 119.26 119.77 1ffv h ALA 575 Ca 0.07 -0.35 -0.19 0.00 0.00 0.00 0.00 54.91 54.44 1ffv h ALA 575 Cb 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ffv h ALA 575 CO 0.01 0.66 -0.60 -0.07 0.00 0.00 0.00 179.25 179.25 1ffv h LEU 576 N 0.89 0.89 -0.87 0.00 3.38 -1.00 -0.73 115.31 117.86 1ffv h LEU 576 Ca 0.14 -0.50 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 1ffv h LEU 576 Cb 0.66 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1ffv h LEU 576 CO 0.05 1.28 -0.09 0.00 0.09 0.00 0.00 178.44 179.77 1ffv h ALA 577 N 0.72 1.05 -0.39 1.53 0.00 -0.73 -1.94 119.26 119.50 1ffv h ALA 577 Ca -0.00 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1ffv h ALA 577 Cb 1.20 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1ffv h ALA 577 CO 0.13 0.58 -0.12 0.00 0.00 0.00 0.00 179.25 179.84 1ffv h ALA 578 N 1.22 0.55 0.00 0.00 0.00 -1.18 -2.96 119.26 116.89 1ffv h ALA 578 Ca 0.12 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ffv h ALA 578 Cb 0.55 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ffv h ALA 578 CO 0.03 0.43 -0.12 0.00 0.00 0.00 0.00 179.25 179.59 1ffv h ARG 579 N 0.58 0.00 -0.34 0.00 3.08 -0.77 0.33 114.38 117.26 1ffv h ARG 579 Ca 0.10 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 1ffv h ARG 579 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1ffv h ARG 579 CO 0.04 0.12 -0.21 0.87 -1.07 0.00 0.00 179.97 179.73 1ffv h LYS 580 N 0.00 0.75 -0.32 0.04 1.57 -1.20 -1.25 116.57 116.16 1ffv h LYS 580 Ca -0.00 -0.35 -0.07 0.00 -1.87 0.00 0.00 60.65 58.37 1ffv h LYS 580 Cb 0.28 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1ffv h LYS 580 CO 0.02 0.96 -0.09 0.82 -0.57 0.00 0.00 179.45 180.59 1ffv h ILE 581 N 0.52 1.22 -0.32 1.86 2.04 -1.18 -2.36 117.51 119.29 1ffv h ILE 581 Ca 0.07 -0.96 -0.16 0.00 1.00 0.00 0.00 64.86 64.81 1ffv h ILE 581 Cb 0.76 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1ffv h ILE 581 CO 0.06 0.32 -0.43 -0.74 0.00 0.00 0.00 178.15 177.36 1ffv h HIS 582 N 0.50 0.99 -0.35 1.37 2.76 -0.74 -0.86 115.15 118.81 1ffv h HIS 582 Ca 0.10 -0.31 -0.05 0.00 -2.20 0.00 0.00 60.37 57.91 1ffv h HIS 582 Cb 0.45 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 1ffv h HIS 582 CO 0.02 1.10 0.00 0.00 -1.30 0.00 0.00 177.93 177.75 1ffv h ALA 583 N 0.85 1.35 -0.03 5.26 0.00 -0.86 -1.16 119.26 124.67 1ffv h ALA 583 Ca 0.05 -0.20 -0.25 0.00 0.00 0.00 0.00 54.91 54.50 1ffv h ALA 583 Cb 1.00 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 18.66 1ffv h ALA 583 CO 0.10 0.45 -0.97 -0.22 0.00 0.00 0.00 179.25 178.60 1ffv h LYS 584 N 0.52 0.66 -0.50 0.00 3.64 -1.24 -3.00 116.57 116.65 1ffv h LYS 584 Ca 0.11 -0.67 -0.02 0.00 -1.27 0.00 0.00 60.65 58.80 1ffv h LYS 584 Cb 0.34 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1ffv h LYS 584 CO 0.01 1.27 0.22 0.00 -2.27 0.00 0.00 179.45 178.68 1ffv h ALA 585 N 0.51 1.44 -0.55 5.00 0.00 -0.69 -0.21 119.26 124.75 1ffv h ALA 585 Ca -0.10 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1ffv h ALA 585 Cb 1.62 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1ffv h ALA 585 CO 0.19 0.43 0.01 -0.09 0.00 0.00 0.00 179.25 179.80 1ffv h ARG 586 N 0.71 0.96 -0.54 0.00 2.43 -1.24 0.18 114.38 116.88 1ffv h ARG 586 Ca 0.17 -0.30 -0.04 0.00 -0.81 0.00 0.00 59.98 59.01 1ffv h ARG 586 Cb 0.11 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1ffv h ARG 586 CO -0.02 0.96 0.18 -0.22 -1.51 0.00 0.00 179.97 179.36 1ffv h LYS 587 N 0.84 0.82 -0.29 0.20 3.64 -1.25 -0.13 116.57 120.39 1ffv h LYS 587 Ca 0.16 -0.17 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 1ffv h LYS 587 Cb 0.52 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1ffv h LYS 587 CO 0.03 0.74 -0.42 0.82 -2.27 0.00 0.00 179.45 178.35 1ffv h ILE 588 N 0.73 1.29 -0.94 2.00 2.04 -0.86 -2.68 117.51 119.09 1ffv h ILE 588 Ca 0.17 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.42 1ffv h ILE 588 Cb 0.25 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.89 1ffv h ILE 588 CO -0.01 0.52 0.56 0.00 0.00 0.00 0.00 178.15 179.22 1ffv h ALA 589 N 0.69 1.20 -0.50 1.87 0.00 -0.40 -0.96 119.26 121.16 1ffv h ALA 589 Ca 0.03 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1ffv h ALA 589 Cb 1.02 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ffv h ALA 589 CO 0.10 0.66 0.02 0.00 0.00 0.00 0.00 179.25 180.03 1ffv h ALA 590 N 1.31 1.10 -0.35 0.00 0.00 -0.96 -0.24 119.26 120.13 1ffv h ALA 590 Ca 0.34 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1ffv h ALA 590 Cb -0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1ffv h ALA 590 CO -0.06 0.57 -0.10 1.25 0.00 0.00 0.00 179.25 180.91 1ffv h HIS 591 N 0.76 0.77 -0.65 0.00 6.17 -1.02 -1.25 115.15 119.94 1ffv h HIS 591 Ca 0.15 -0.17 -0.08 0.00 0.71 0.00 0.00 60.37 60.98 1ffv h HIS 591 Cb 0.43 -0.19 -0.03 0.00 2.52 0.00 0.00 27.41 30.15 1ffv h HIS 591 CO 0.02 0.85 0.09 0.52 0.71 0.00 0.00 177.93 180.13 1ffv h MET 592 N 0.47 1.09 -0.07 5.26 2.86 -0.98 -2.91 114.93 120.65 1ffv h MET 592 Ca 0.09 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 1ffv h MET 592 Cb 0.62 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.16 1ffv h MET 592 CO 0.04 1.01 0.00 1.28 1.06 0.00 0.00 176.91 180.30 1ffv n LEU 593 N -4.22 0.99 -4.03 1.22 4.77 -0.12 -4.94 117.00 110.67 1ffv n LEU 593 Ca 0.04 -0.38 -0.33 0.00 -0.03 0.00 0.00 56.01 55.30 1ffv n LEU 593 Cb 0.30 -0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1ffv n LEU 593 CO 0.43 0.19 0.03 -0.62 -1.33 0.00 0.00 177.39 176.10 1ffv n GLU 594 N -0.17 -4.20 -4.45 3.23 1.02 -0.54 -4.97 120.64 110.56 1ffv n GLU 594 Ca 0.17 0.48 -0.23 0.00 -0.02 0.00 0.00 57.16 57.56 1ffv n GLU 594 Cb 0.24 -5.28 -0.09 0.00 -0.02 0.00 0.00 31.44 26.29 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 -3.26 0.63 0.46 2.62 -7.23 -0.77 -5.05 120.40 107.80 1ffv s VAL 595 Ca 0.69 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.79 1ffv s VAL 595 Cb -0.36 -2.48 -0.05 0.00 0.56 0.00 0.00 36.38 34.05 1ffv s VAL 595 CO 0.85 0.00 0.78 0.20 -0.31 0.00 0.00 175.10 176.63 1ffv s ASN 596 N -3.52 6.35 0.23 4.85 -0.87 -1.26 -4.43 114.94 116.28 1ffv s ASN 596 Ca 0.29 1.00 -0.08 0.00 -1.57 0.00 0.00 52.86 52.51 1ffv s ASN 596 Cb 0.04 -2.28 0.25 0.00 -0.02 0.00 0.00 41.25 39.25 1ffv s ASN 596 CO 0.16 -0.52 1.86 -0.33 -2.57 0.00 0.00 177.10 175.69 1ffv h GLU 597 N 0.57 0.94 0.00 -0.60 5.08 -1.91 -2.10 114.58 116.55 1ffv h GLU 597 Ca -0.47 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1ffv h GLU 597 Cb 1.20 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1ffv h GLU 597 CO 0.62 0.62 0.00 0.27 -1.00 0.00 0.00 179.01 179.52 1ffv n ASN 598 N -4.61 0.28 -1.25 1.42 0.23 -1.26 -1.55 115.26 108.51 1ffv n ASN 598 Ca 0.10 0.60 0.08 0.00 -0.53 0.00 0.00 54.58 54.82 1ffv n ASN 598 Cb 0.11 -0.65 0.27 0.00 -2.08 0.00 0.00 39.78 37.44 1ffv n ASN 598 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1ffv n ASP 599 N -1.84 3.66 -4.50 0.53 8.00 -0.79 -4.93 116.55 116.68 1ffv n ASP 599 Ca 0.01 -2.29 -0.29 0.00 0.71 0.00 0.00 54.79 52.93 1ffv n ASP 599 Cb 0.10 -0.48 -0.11 0.00 -0.02 0.00 0.00 41.12 40.60 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 -1.44 2.76 -0.07 0.64 1.43 -0.60 -0.81 118.68 120.59 1ffv s LEU 600 Ca 0.39 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1ffv s LEU 600 Cb 0.25 -1.60 0.02 0.00 0.03 0.00 0.00 46.19 44.89 1ffv s LEU 600 CO 0.20 0.18 -0.09 -1.81 0.23 0.00 0.00 176.35 175.06 1ffv s ASP 601 N -2.14 1.65 -0.04 2.29 1.01 -0.07 -4.89 116.67 114.47 1ffv s ASP 601 Ca 0.18 -0.26 -0.28 0.00 0.71 0.00 0.00 52.55 52.91 1ffv s ASP 601 Cb -0.11 -0.73 -0.03 0.00 1.01 0.00 0.00 42.92 43.06 1ffv s ASP 601 CO 0.11 -0.02 0.89 0.86 0.21 0.00 0.00 175.17 177.22 1ffv s TRP 602 N 0.92 3.60 -0.39 4.23 -0.11 -1.26 -0.84 118.94 125.10 1ffv s TRP 602 Ca -0.10 1.53 0.01 0.00 1.22 0.00 0.00 56.10 58.75 1ffv s TRP 602 Cb -0.15 -3.03 0.13 0.00 -1.50 0.00 0.00 33.47 28.92 1ffv s TRP 602 CO 0.01 -0.03 0.20 -2.00 -4.62 0.00 0.00 176.95 170.52 1ffv s GLU 603 N 1.15 0.92 0.00 5.86 2.12 0.20 -4.99 118.70 123.97 1ffv s GLU 603 Ca 0.47 -1.59 0.00 0.00 0.36 0.00 0.00 54.97 54.21 1ffv s GLU 603 Cb -0.19 -1.91 0.00 0.00 0.26 0.00 0.00 34.13 32.29 1ffv s GLU 603 CO 0.23 -1.14 0.00 0.28 -0.54 0.00 0.00 175.26 174.09 1ffv n VAL 604 N 3.97 0.00 -2.21 3.70 0.31 -1.26 -3.05 118.33 119.79 1ffv n VAL 604 Ca 0.07 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.41 1ffv n VAL 604 Cb 0.37 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 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 1.15 0.32 -3.46 4.52 5.75 -1.26 -3.71 116.55 119.85 1ffv n ASP 605 Ca 0.00 -1.91 -0.11 0.00 -0.01 0.00 0.00 54.79 52.76 1ffv n ASP 605 Cb 0.00 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 39.90 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 1.18 -0.22 0.11 1.70 -1.17 -3.07 118.95 117.47 1ffv s ARG 606 Ca 0.14 -0.45 -0.06 0.00 -0.47 0.00 0.00 55.73 54.90 1ffv s ARG 606 Cb 0.16 0.53 -0.03 0.00 -0.57 0.00 0.00 34.95 35.05 1ffv s ARG 606 CO -0.07 -0.52 0.03 -0.06 -1.08 0.00 0.00 175.30 173.60 1ffv s PHE 607 N -3.59 3.06 0.09 5.89 0.08 -0.72 -0.62 117.98 122.17 1ffv s PHE 607 Ca 0.03 -0.47 0.10 0.00 0.12 0.00 0.00 56.93 56.71 1ffv s PHE 607 Cb -0.01 -2.14 -0.04 0.00 -0.57 0.00 0.00 43.02 40.26 1ffv s PHE 607 CO -0.11 -0.30 -0.24 -1.59 -0.10 0.00 0.00 175.22 172.88 1ffv s LYS 608 N 1.25 1.66 0.08 0.44 -2.85 -0.02 -1.64 119.74 118.66 1ffv s LYS 608 Ca 0.04 -1.21 -0.31 0.00 -1.00 0.00 0.00 55.97 53.49 1ffv s LYS 608 Cb -0.15 -1.99 -0.07 0.00 -2.06 0.00 0.00 37.83 33.57 1ffv s LYS 608 CO 0.02 0.48 1.28 0.08 0.10 0.00 0.00 175.35 177.31 1ffv s VAL 609 N -0.98 3.72 0.01 1.79 1.01 -0.55 -0.89 120.40 124.51 1ffv s VAL 609 Ca 0.14 1.23 -0.34 0.00 0.00 0.00 0.00 61.98 63.01 1ffv s VAL 609 Cb -0.10 -3.79 -0.13 0.00 0.00 0.00 0.00 36.38 32.36 1ffv s VAL 609 CO 0.05 0.10 1.74 0.29 0.00 0.00 0.00 175.10 177.28 1ffv n LYS 610 N 3.94 2.13 0.00 2.72 5.02 0.01 -2.67 118.16 129.31 1ffv n LYS 610 Ca 0.10 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 57.16 1ffv n LYS 610 Cb 0.45 -2.58 0.00 0.00 -0.02 0.00 0.00 35.03 32.87 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 3.95 2.13 3.52 0.72 0.00 -1.26 -4.95 105.19 109.30 1ffv n GLY 611 Ca 0.20 -0.61 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 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 0.00 6.30 0.32 1.61 -1.08 -1.09 -4.90 116.67 117.83 1ffv s ASP 612 Ca 0.00 -0.42 0.14 0.00 -0.52 0.00 0.00 52.55 51.75 1ffv s ASP 612 Cb 0.00 -2.47 0.52 0.00 -1.46 0.00 0.00 42.92 39.51 1ffv s ASP 612 CO 0.00 -1.39 1.68 0.44 0.52 0.00 0.00 175.17 176.42 1ffv h ASP 613 N 9.49 0.00 0.77 -0.34 3.32 -1.93 -3.16 116.42 124.57 1ffv h ASP 613 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1ffv h ASP 613 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1ffv h ASP 613 CO 1.15 0.50 0.00 0.77 -1.72 0.00 0.00 179.24 179.94 1ffv h SER 614 N 0.00 0.00 -3.34 6.45 4.64 -1.92 -3.39 113.55 115.99 1ffv h SER 614 Ca -0.01 0.00 -0.71 0.00 -0.47 0.00 0.00 61.79 60.61 1ffv h SER 614 Cb 0.97 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 62.86 1ffv h SER 614 CO 0.07 0.00 -0.15 -0.54 -0.87 0.00 0.00 176.83 175.34 1ffv s LYS 615 N -3.64 3.06 0.24 4.77 1.02 -1.19 -5.02 119.74 118.99 1ffv s LYS 615 Ca 0.01 -1.02 -0.17 0.00 0.02 0.00 0.00 55.97 54.81 1ffv s LYS 615 Cb 0.09 -4.08 0.01 0.00 -0.52 0.00 0.00 37.83 33.34 1ffv s LYS 615 CO 0.47 -1.07 0.56 -0.59 -0.92 0.00 0.00 175.35 173.81 1ffv s PHE 616 N 2.17 0.06 -0.09 3.18 -0.12 -1.26 -1.48 117.98 120.43 1ffv s PHE 616 Ca 0.10 -0.44 -0.04 0.00 -0.05 0.00 0.00 56.93 56.50 1ffv s PHE 616 Cb -0.20 0.40 0.05 0.00 -0.63 0.00 0.00 43.02 42.64 1ffv s PHE 616 CO 0.10 -1.05 0.18 0.15 -0.05 0.00 0.00 175.22 174.56 1ffv s LYS 617 N -3.95 0.09 0.86 1.99 -0.14 -0.65 -4.99 119.74 112.96 1ffv s LYS 617 Ca 0.15 0.53 -0.12 0.00 -1.36 0.00 0.00 55.97 55.17 1ffv s LYS 617 Cb -0.02 -0.19 0.11 0.00 -1.68 0.00 0.00 37.83 36.05 1ffv s LYS 617 CO 0.05 -0.24 1.17 0.95 -0.76 0.00 0.00 175.35 176.52 1ffv s THR 618 N 1.83 2.00 0.41 2.17 -4.23 -1.26 -1.75 115.64 114.80 1ffv s THR 618 Ca -0.03 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 60.63 1ffv s THR 618 Cb -0.12 -2.90 0.16 0.00 1.34 0.00 0.00 72.50 70.99 1ffv s THR 618 CO -0.07 0.00 1.93 -0.03 -0.54 0.00 0.00 174.62 175.92 1ffv h MET 619 N -1.28 0.00 -0.19 3.99 4.05 -1.84 -1.12 114.93 118.53 1ffv h MET 619 Ca -0.48 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 58.92 1ffv h MET 619 Cb 1.33 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.12 1ffv h MET 619 CO 0.63 0.25 0.03 0.00 0.23 0.00 0.00 176.91 178.04 1ffv h ALA 620 N 1.75 0.26 -0.62 0.39 0.00 -1.90 0.17 119.26 119.31 1ffv h ALA 620 Ca -0.00 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1ffv h ALA 620 Cb 0.46 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1ffv h ALA 620 CO 0.03 -0.07 0.41 -0.44 0.00 0.00 0.00 179.25 179.18 1ffv h ASP 621 N 0.11 0.70 -0.58 0.00 3.32 -1.75 -2.06 116.42 116.16 1ffv h ASP 621 Ca 0.06 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 1ffv h ASP 621 Cb 0.32 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1ffv h ASP 621 CO 0.00 0.51 0.07 0.40 -1.72 0.00 0.00 179.24 178.50 1ffv h ILE 622 N 0.83 1.26 -0.17 0.35 2.04 -1.04 -2.27 117.51 118.51 1ffv h ILE 622 Ca 0.23 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1ffv h ILE 622 Cb -0.09 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1ffv h ILE 622 CO -0.05 0.37 0.11 0.00 0.00 0.00 0.00 178.15 178.58 1ffv h ALA 623 N 1.00 0.22 -0.45 1.87 0.00 -0.31 -1.31 119.26 120.27 1ffv h ALA 623 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ffv h ALA 623 Cb 0.45 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ffv h ALA 623 CO 0.02 -0.31 0.29 2.35 0.00 0.00 0.00 179.25 181.60 1ffv h TRP 624 N 0.22 0.58 -0.74 0.00 2.91 -1.30 -2.31 115.95 115.32 1ffv h TRP 624 Ca 0.06 0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.13 1ffv h TRP 624 Cb -0.02 -0.19 -0.04 0.00 -0.51 0.00 0.00 29.16 28.39 1ffv h TRP 624 CO -0.07 0.38 0.48 0.37 -1.03 0.00 0.00 178.44 178.58 1ffv h GLN 625 N 0.61 0.85 0.00 2.65 5.75 -1.12 0.29 115.11 124.14 1ffv h GLN 625 Ca 0.16 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1ffv h GLN 625 Cb -0.04 -0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.31 1ffv h GLN 625 CO -0.03 0.56 -0.15 0.00 -2.65 0.00 0.00 178.83 176.56 1ffv h ALA 626 N 1.58 1.67 0.03 3.38 0.00 -0.68 -1.35 119.26 123.88 1ffv h ALA 626 Ca 0.30 -0.14 -0.34 0.00 0.00 0.00 0.00 54.91 54.72 1ffv h ALA 626 Cb 0.08 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1ffv h ALA 626 CO -0.09 0.19 -2.07 0.66 0.00 0.00 0.00 179.25 177.95 1ffv n TYR 627 N -4.25 0.63 0.18 0.00 4.01 -0.44 -0.95 117.16 116.34 1ffv n TYR 627 Ca -0.02 0.19 -0.08 0.00 -0.16 0.00 0.00 57.90 57.83 1ffv n TYR 627 Cb 0.22 -1.10 -0.04 0.00 -0.31 0.00 0.00 39.34 38.12 1ffv n TYR 627 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1ffv h HIS 628 N 0.01 -0.45 -1.34 -0.72 2.76 -0.31 -3.46 115.15 111.63 1ffv h HIS 628 Ca -0.43 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 57.70 1ffv h HIS 628 Cb 2.07 0.15 -0.24 0.00 1.55 0.00 0.00 27.41 30.93 1ffv h HIS 628 CO 0.02 -0.28 -0.39 -1.14 -1.30 0.00 0.00 177.93 174.84 1ffv s GLN 629 N -3.35 0.49 0.27 5.26 0.74 -0.52 -5.08 119.66 117.47 1ffv s GLN 629 Ca -0.07 0.66 -0.29 0.00 0.05 0.00 0.00 55.36 55.71 1ffv s GLN 629 Cb 0.01 0.10 -0.10 0.00 1.10 0.00 0.00 33.01 34.11 1ffv s GLN 629 CO 0.21 -0.77 1.36 -1.25 -0.55 0.00 0.00 175.29 174.29 1ffv s PRO 630 N 2.72 4.33 0.70 1.67 0.04 -1.24 -4.71 135.00 138.51 1ffv s PRO 630 Ca 0.15 2.21 -0.16 0.00 0.04 0.00 0.00 61.00 63.24 1ffv s PRO 630 Cb -0.14 -3.11 0.01 0.00 0.04 0.00 0.00 34.50 31.30 1ffv s PRO 630 CO -0.22 -0.28 1.10 -2.30 0.04 0.00 0.00 177.00 175.34 1ffv n PRO 631 N 1.73 0.69 -1.59 0.56 -0.02 -1.26 -4.82 135.00 130.28 1ffv n PRO 631 Ca 0.04 0.29 -0.48 0.00 -2.02 0.00 0.00 63.50 61.33 1ffv n PRO 631 Cb 0.41 -2.35 -0.04 0.00 -0.02 0.00 0.00 33.50 31.51 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 -2.36 -0.45 -0.06 3.55 0.00 -1.26 -1.46 120.51 118.48 1ffv n ALA 632 Ca 0.14 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1ffv n ALA 632 Cb 0.49 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.87 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 2.05 1.57 3.69 0.00 0.00 -1.26 -5.04 105.19 106.20 1ffv n GLY 633 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 3.45 0.27 0.99 1.43 -0.53 -5.13 118.68 119.16 1ffv s LEU 634 Ca 0.00 -0.23 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 1ffv s LEU 634 Cb 0.00 -2.15 -0.08 0.00 0.03 0.00 0.00 46.19 43.99 1ffv s LEU 634 CO 0.00 0.14 0.66 -1.61 0.23 0.00 0.00 176.35 175.77 1ffv s GLU 635 N -2.54 3.95 1.09 1.70 2.02 -1.26 -4.72 118.70 118.93 1ffv s GLU 635 Ca 0.27 0.53 -0.12 0.00 0.02 0.00 0.00 54.97 55.67 1ffv s GLU 635 Cb -0.11 -2.57 0.24 0.00 0.10 0.00 0.00 34.13 31.79 1ffv s GLU 635 CO 0.19 0.25 1.06 -2.14 0.02 0.00 0.00 175.26 174.63 1ffv s PRO 636 N -2.79 -0.33 0.00 0.39 0.02 -1.26 -4.89 135.00 126.14 1ffv s PRO 636 Ca 0.50 0.90 0.00 0.00 0.02 0.00 0.00 61.00 62.42 1ffv s PRO 636 Cb -0.11 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.79 1ffv s PRO 636 CO 0.19 -3.35 0.00 0.41 -0.33 0.00 0.00 177.00 173.92 1ffv n GLY 637 N 0.34 -0.38 2.65 0.52 0.00 -0.13 -4.96 105.19 103.23 1ffv n GLY 637 Ca 0.05 -1.71 -0.18 0.00 0.00 0.00 0.00 46.02 44.18 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 -2.47 0.17 0.18 0.99 0.20 -1.26 -4.84 118.68 111.65 1ffv s LEU 638 Ca 0.00 -2.02 -0.12 0.00 0.69 0.00 0.00 54.13 52.67 1ffv s LEU 638 Cb 0.00 0.45 0.01 0.00 -0.43 0.00 0.00 46.19 46.21 1ffv s LEU 638 CO 0.00 -0.21 0.39 -1.83 -0.29 0.00 0.00 176.35 174.41 1ffv s GLU 639 N 0.97 1.27 0.11 1.98 -1.05 -1.26 -1.01 118.70 119.72 1ffv s GLU 639 Ca 0.23 -1.06 -0.19 0.00 -0.15 0.00 0.00 54.97 53.80 1ffv s GLU 639 Cb -0.09 0.44 0.05 0.00 -0.44 0.00 0.00 34.13 34.08 1ffv s GLU 639 CO -0.07 -0.50 0.46 0.00 0.95 0.00 0.00 175.26 176.10 1ffv s ALA 640 N -3.94 -1.15 0.04 -0.84 0.00 -0.14 -4.79 121.76 110.94 1ffv s ALA 640 Ca 0.15 0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.36 1ffv s ALA 640 Cb 0.01 0.64 -0.02 0.00 0.00 0.00 0.00 23.12 23.75 1ffv s ALA 640 CO -0.00 -0.62 -0.11 0.08 0.00 0.00 0.00 175.76 175.10 1ffv s VAL 641 N -3.39 0.86 -0.23 0.00 1.01 -1.26 -0.96 120.40 116.43 1ffv s VAL 641 Ca 0.00 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 1ffv s VAL 641 Cb 0.01 -0.82 0.08 0.00 0.00 0.00 0.00 36.38 35.64 1ffv s VAL 641 CO -0.09 -0.12 0.53 -2.28 0.00 0.00 0.00 175.10 173.13 1ffv s HIS 642 N -0.97 -0.88 -0.28 5.22 2.46 -0.30 -4.84 115.29 115.71 1ffv s HIS 642 Ca -0.02 1.73 -0.07 0.00 0.47 0.00 0.00 55.06 57.17 1ffv s HIS 642 Cb -0.08 0.46 -0.01 0.00 -0.13 0.00 0.00 32.58 32.82 1ffv s HIS 642 CO 0.01 -0.47 0.07 0.71 -2.47 0.00 0.00 174.74 172.60 1ffv s TYR 643 N 1.89 3.11 -0.32 3.88 1.51 -1.26 -1.70 117.35 124.46 1ffv s TYR 643 Ca -0.08 -0.75 -0.11 0.00 -1.01 0.00 0.00 57.07 55.12 1ffv s TYR 643 Cb -0.08 -2.25 -0.01 0.00 -0.11 0.00 0.00 41.96 39.50 1ffv s TYR 643 CO -0.16 -0.49 0.20 -0.47 -1.11 0.00 0.00 175.55 173.52 1ffv s TYR 644 N 1.55 3.21 -0.47 2.71 5.04 0.63 -4.93 117.35 125.08 1ffv s TYR 644 Ca 0.04 -0.35 -0.14 0.00 -2.44 0.00 0.00 57.07 54.19 1ffv s TYR 644 Cb -0.16 -2.42 0.08 0.00 0.35 0.00 0.00 41.96 39.81 1ffv s TYR 644 CO 0.03 -0.39 0.39 0.34 -1.34 0.00 0.00 175.55 174.57 1ffv s ASP 645 N 1.68 6.04 0.38 4.32 2.15 -1.26 -2.42 116.67 127.56 1ffv s ASP 645 Ca 0.05 -1.46 -0.28 0.00 0.43 0.00 0.00 52.55 51.30 1ffv s ASP 645 Cb -0.17 -2.14 -0.11 0.00 -0.30 0.00 0.00 42.92 40.20 1ffv s ASP 645 CO 0.09 -0.66 1.47 -2.16 -0.17 0.00 0.00 175.17 173.73 1ffv s PRO 646 N 1.58 4.10 0.49 4.34 0.04 -1.26 -4.92 135.00 139.36 1ffv s PRO 646 Ca 0.04 2.53 0.27 0.00 0.04 0.00 0.00 61.00 63.88 1ffv s PRO 646 Cb -0.25 -2.95 0.76 0.00 0.04 0.00 0.00 34.50 32.09 1ffv s PRO 646 CO 0.05 -0.52 1.76 -1.00 0.04 0.00 0.00 177.00 177.33 1ffv h PRO 647 N 2.98 0.00 -2.37 0.56 0.13 -1.97 -3.19 132.00 128.15 1ffv h PRO 647 Ca -0.51 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 64.81 1ffv h PRO 647 Cb 1.24 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.31 1ffv h PRO 647 CO 0.64 0.00 0.56 1.21 -0.23 0.00 0.00 178.00 180.19 1ffv s ASN 648 N -6.00 -0.07 0.92 1.44 2.47 -1.26 -4.94 114.94 107.50 1ffv s ASN 648 Ca 0.05 -0.52 -0.12 0.00 0.42 0.00 0.00 52.86 52.68 1ffv s ASN 648 Cb 0.07 0.47 0.20 0.00 -1.45 0.00 0.00 41.25 40.54 1ffv s ASN 648 CO 0.62 -0.90 1.25 -0.36 -3.72 0.00 0.00 177.10 173.99 1ffv s PHE 649 N -2.64 1.29 0.00 0.43 0.40 -1.26 -4.80 117.98 111.39 1ffv s PHE 649 Ca 0.17 0.03 0.06 0.00 -0.60 0.00 0.00 56.93 56.60 1ffv s PHE 649 Cb -0.01 -3.86 -0.03 0.00 0.51 0.00 0.00 43.02 39.62 1ffv s PHE 649 CO 0.03 -2.54 -0.17 -0.08 0.70 0.00 0.00 175.22 173.16 1ffv s THR 650 N -3.72 2.82 -0.65 0.64 -1.32 0.06 -4.78 115.64 108.69 1ffv s THR 650 Ca 0.74 -1.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.27 1ffv s THR 650 Cb -0.03 -2.13 0.19 0.00 -1.51 0.00 0.00 72.50 69.02 1ffv s THR 650 CO 0.51 0.46 0.55 -1.22 -2.21 0.00 0.00 174.62 172.71 1ffv n TYR 651 N 1.93 2.83 -1.44 9.09 4.02 -1.26 -1.19 117.16 131.14 1ffv n TYR 651 Ca -0.16 -4.15 -0.31 0.00 -0.01 0.00 0.00 57.90 53.26 1ffv n TYR 651 Cb 0.52 -0.52 0.07 0.00 -0.02 0.00 0.00 39.34 39.39 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 -1.60 2.60 0.26 -0.72 0.04 -1.24 -4.71 135.00 129.63 1ffv s PRO 652 Ca 0.30 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.46 1ffv s PRO 652 Cb 0.03 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1ffv s PRO 652 CO -0.13 -1.37 0.13 -0.59 0.04 0.00 0.00 177.00 175.07 1ffv s PHE 653 N -2.91 1.48 0.19 0.56 -0.12 -0.55 -0.54 117.98 116.09 1ffv s PHE 653 Ca 0.60 -1.29 -0.18 0.00 -0.05 0.00 0.00 56.93 56.01 1ffv s PHE 653 Cb -0.16 -0.81 0.03 0.00 -0.63 0.00 0.00 43.02 41.45 1ffv s PHE 653 CO 0.54 -0.47 0.54 0.20 -0.05 0.00 0.00 175.22 175.98 1ffv s GLY 654 N -3.30 -0.19 -0.21 1.99 0.00 -0.67 -0.71 107.32 104.24 1ffv s GLY 654 Ca 0.37 -0.10 -0.04 0.00 0.00 0.00 0.00 44.72 44.95 1ffv s GLY 654 CO 0.15 -0.19 0.13 -0.42 0.00 0.00 0.00 173.10 172.76 1ffv s ILE 655 N -3.85 -0.13 0.01 0.90 1.01 -0.34 -1.63 121.20 117.17 1ffv s ILE 655 Ca 0.08 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.47 1ffv s ILE 655 Cb -0.01 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.73 1ffv s ILE 655 CO -0.05 -0.38 -0.11 -0.31 0.00 0.00 0.00 174.94 174.10 1ffv s TYR 656 N 2.17 2.76 -0.02 3.97 2.02 0.09 -1.81 117.35 126.53 1ffv s TYR 656 Ca 0.05 -0.12 0.01 0.00 -0.37 0.00 0.00 57.07 56.63 1ffv s TYR 656 Cb -0.16 -1.57 0.02 0.00 -0.40 0.00 0.00 41.96 39.85 1ffv s TYR 656 CO -0.17 0.31 -0.01 -1.17 -1.57 0.00 0.00 175.55 172.94 1ffv s LEU 657 N -1.31 1.43 -0.03 -1.29 0.20 -0.43 -1.29 118.68 115.96 1ffv s LEU 657 Ca 0.15 -0.03 0.04 0.00 0.69 0.00 0.00 54.13 54.98 1ffv s LEU 657 Cb -0.11 -0.20 -0.00 0.00 -0.43 0.00 0.00 46.19 45.45 1ffv s LEU 657 CO 0.06 -0.06 -0.14 0.00 -0.29 0.00 0.00 176.35 175.92 1ffv s VAL 659 N 0.04 2.74 0.13 0.00 1.01 -0.22 -0.50 120.40 123.60 1ffv s VAL 659 Ca -0.02 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.29 1ffv s VAL 659 Cb -0.09 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 1ffv s VAL 659 CO 0.01 0.51 -0.17 0.68 0.00 0.00 0.00 175.10 176.13 1ffv s VAL 660 N 0.79 1.57 -0.12 2.92 -7.23 -0.10 -0.49 120.40 117.74 1ffv s VAL 660 Ca -0.05 -1.73 0.01 0.00 -1.81 0.00 0.00 61.98 58.40 1ffv s VAL 660 Cb -0.15 -1.62 0.02 0.00 0.56 0.00 0.00 36.38 35.19 1ffv s VAL 660 CO 0.00 -0.30 -0.13 -1.81 -0.31 0.00 0.00 175.10 172.56 1ffv s ASP 661 N -2.37 2.45 -0.22 4.85 1.01 -0.27 -0.49 116.67 121.63 1ffv s ASP 661 Ca 0.10 -0.42 -0.09 0.00 0.71 0.00 0.00 52.55 52.85 1ffv s ASP 661 Cb -0.07 -1.06 -0.04 0.00 1.01 0.00 0.00 42.92 42.76 1ffv s ASP 661 CO 0.04 -0.04 0.10 -0.63 0.21 0.00 0.00 175.17 174.86 1ffv s ILE 662 N 1.29 4.89 -0.38 0.77 1.01 -0.15 -0.81 121.20 127.82 1ffv s ILE 662 Ca -0.01 0.02 -0.29 0.00 0.00 0.00 0.00 60.65 60.37 1ffv s ILE 662 Cb -0.14 -3.26 0.01 0.00 0.01 0.00 0.00 42.46 39.08 1ffv s ILE 662 CO -0.06 0.38 1.37 -0.62 0.00 0.00 0.00 174.94 176.01 1ffv s ASP 663 N 0.97 6.44 0.61 3.58 -1.08 0.54 -1.43 116.67 126.29 1ffv s ASP 663 Ca 0.05 0.92 0.39 0.00 -0.52 0.00 0.00 52.55 53.39 1ffv s ASP 663 Cb -0.14 -2.54 1.92 0.00 -1.46 0.00 0.00 42.92 40.70 1ffv s ASP 663 CO 0.03 -1.33 2.18 0.03 0.52 0.00 0.00 175.17 176.60 1ffv h ARG 664 N 10.25 0.00 0.00 4.34 3.08 -1.66 0.23 114.38 130.63 1ffv h ARG 664 Ca -0.27 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.74 1ffv h ARG 664 Cb 1.10 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 1ffv h ARG 664 CO 1.07 0.00 -0.90 0.00 -1.07 0.00 0.00 179.97 179.08 1ffv h ALA 665 N 2.00 0.62 0.00 0.04 0.00 -1.84 0.26 119.26 120.34 1ffv h ALA 665 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ffv h ALA 665 Cb 0.24 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ffv h ALA 665 CO 0.00 0.21 -0.52 0.25 0.00 0.00 0.00 179.25 179.19 1ffv n THR 666 N -2.82 0.00 -0.61 0.00 -2.24 -1.09 -4.79 114.28 102.74 1ffv n THR 666 Ca -0.01 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1ffv n THR 666 Cb 0.61 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 1.45 0.74 3.70 3.38 0.00 0.79 -4.64 105.19 110.62 1ffv n GLY 667 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ffv n GLY 667 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ffv s GLU 668 N -0.39 4.38 -0.24 1.61 2.02 -1.24 -4.14 118.70 120.70 1ffv s GLU 668 Ca 0.00 1.83 -0.08 0.00 0.02 0.00 0.00 54.97 56.74 1ffv s GLU 668 Cb 0.00 -3.41 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 1ffv s GLU 668 CO 0.00 -0.37 0.08 0.99 0.02 0.00 0.00 175.26 175.98 1ffv s THR 669 N 1.48 4.48 -0.24 3.63 2.01 -1.26 -0.34 115.64 125.39 1ffv s THR 669 Ca 0.60 -0.12 -0.05 0.00 0.31 0.00 0.00 61.69 62.43 1ffv s THR 669 Cb -0.30 -3.08 -0.01 0.00 0.01 0.00 0.00 72.50 69.12 1ffv s THR 669 CO 0.28 0.35 0.01 -0.75 -0.69 0.00 0.00 174.62 173.82 1ffv s LYS 670 N 1.40 3.37 -0.31 4.92 2.47 0.01 -4.97 119.74 126.62 1ffv s LYS 670 Ca 0.05 -0.65 -0.29 0.00 -1.56 0.00 0.00 55.97 53.53 1ffv s LYS 670 Cb -0.15 -3.17 -0.00 0.00 -1.46 0.00 0.00 37.83 33.05 1ffv s LYS 670 CO 0.04 -0.26 1.43 0.08 0.16 0.00 0.00 175.35 176.81 1ffv s VAL 671 N 1.51 3.94 0.04 4.02 1.01 -1.26 -1.11 120.40 128.54 1ffv s VAL 671 Ca 0.05 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.06 1ffv s VAL 671 Cb -0.15 -4.04 -0.26 0.00 0.00 0.00 0.00 36.38 31.93 1ffv s VAL 671 CO -0.00 -0.51 0.99 -0.09 0.00 0.00 0.00 175.10 175.49 1ffv h ARG 672 N 10.20 0.18 -1.90 2.72 2.43 -1.13 -3.48 114.38 123.39 1ffv h ARG 672 Ca -0.29 -0.31 -0.02 0.00 -0.81 0.00 0.00 59.98 58.55 1ffv h ARG 672 Cb 1.12 0.11 -0.20 0.00 -0.42 0.00 0.00 29.97 30.58 1ffv h ARG 672 CO 1.04 1.05 0.26 0.50 -1.51 0.00 0.00 179.97 181.31 1ffv s ARG 673 N -2.64 0.91 -0.10 0.20 3.52 -1.04 -4.99 118.95 114.80 1ffv s ARG 673 Ca -0.05 0.40 -0.04 0.00 -0.13 0.00 0.00 55.73 55.91 1ffv s ARG 673 Cb 0.08 0.43 0.05 0.00 -1.56 0.00 0.00 34.95 33.95 1ffv s ARG 673 CO 0.85 -0.25 0.17 0.12 -0.81 0.00 0.00 175.30 175.38 1ffv s PHE 674 N -0.80 -0.20 -0.21 5.12 2.19 -1.26 -1.06 117.98 121.76 1ffv s PHE 674 Ca -0.07 0.60 -0.02 0.00 0.33 0.00 0.00 56.93 57.78 1ffv s PHE 674 Cb -0.01 -0.26 0.01 0.00 -1.31 0.00 0.00 43.02 41.45 1ffv s PHE 674 CO 0.06 -0.30 -0.09 -0.47 1.83 0.00 0.00 175.22 176.24 1ffv s TYR 675 N 2.30 2.93 -0.21 10.12 6.14 0.13 -2.05 117.35 136.72 1ffv s TYR 675 Ca 0.03 -1.29 0.01 0.00 0.64 0.00 0.00 57.07 56.46 1ffv s TYR 675 Cb -0.12 -2.04 0.03 0.00 0.42 0.00 0.00 41.96 40.25 1ffv s TYR 675 CO -0.06 -0.67 -0.16 0.00 0.64 0.00 0.00 175.55 175.30 1ffv s ALA 676 N 1.39 2.44 -0.21 3.97 0.00 0.11 -1.31 121.76 128.15 1ffv s ALA 676 Ca 0.04 -1.36 -0.04 0.00 0.00 0.00 0.00 51.96 50.60 1ffv s ALA 676 Cb -0.14 -1.34 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 1ffv s ALA 676 CO -0.06 -0.59 -0.02 -1.17 0.00 0.00 0.00 175.76 173.92 1ffv s LEU 677 N 1.26 3.08 0.00 0.00 0.20 -0.75 -0.80 118.68 121.68 1ffv s LEU 677 Ca 0.01 -0.29 0.07 0.00 0.69 0.00 0.00 54.13 54.61 1ffv s LEU 677 Cb -0.15 -1.78 -0.02 0.00 -0.43 0.00 0.00 46.19 43.81 1ffv s LEU 677 CO -0.10 0.03 -0.21 -1.81 -0.29 0.00 0.00 176.35 173.97 1ffv s ASP 678 N 1.20 2.47 -0.26 3.68 1.11 -0.85 -1.19 116.67 122.84 1ffv s ASP 678 Ca 0.03 -0.43 0.00 0.00 0.18 0.00 0.00 52.55 52.33 1ffv s ASP 678 Cb -0.14 -0.25 0.07 0.00 1.07 0.00 0.00 42.92 43.67 1ffv s ASP 678 CO 0.00 0.23 0.01 -0.62 1.18 0.00 0.00 175.17 175.97 1ffv s ASP 679 N -0.71 3.81 -0.23 0.27 -1.08 0.11 -3.52 116.67 115.33 1ffv s ASP 679 Ca 0.08 -1.32 0.12 0.00 -0.52 0.00 0.00 52.55 50.91 1ffv s ASP 679 Cb -0.08 -1.04 0.45 0.00 -1.46 0.00 0.00 42.92 40.79 1ffv s ASP 679 CO 0.00 -0.31 1.34 0.00 0.52 0.00 0.00 175.17 176.73 1ffv n GLY 681 N -1.08 0.52 3.69 0.00 0.00 -1.24 -0.21 105.19 106.87 1ffv n GLY 681 Ca 0.25 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 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 0.27 -3.40 2.61 -1.04 -0.45 -4.60 114.28 107.66 1ffv n THR 682 Ca 0.00 -0.05 -0.38 0.00 -2.04 0.00 0.00 64.05 61.58 1ffv n THR 682 Cb 0.00 -2.00 -0.08 0.00 -1.82 0.00 0.00 70.33 66.44 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 2.32 4.14 -0.06 -2.82 0.52 -1.26 -4.32 118.95 117.47 1ffv s ARG 683 Ca 0.81 0.15 -0.25 0.00 -0.52 0.00 0.00 55.73 55.93 1ffv s ARG 683 Cb -0.53 -3.56 -0.24 0.00 0.52 0.00 0.00 34.95 31.14 1ffv s ARG 683 CO 0.38 -0.08 1.01 0.82 0.02 0.00 0.00 175.30 177.45 1ffv h ILE 684 N 5.10 1.56 -2.03 1.52 2.04 -1.93 -3.16 117.51 120.60 1ffv h ILE 684 Ca -0.35 -1.98 -0.30 0.00 1.00 0.00 0.00 64.86 63.23 1ffv h ILE 684 Cb 1.16 2.82 -0.32 0.00 -0.74 0.00 0.00 36.82 39.74 1ffv h ILE 684 CO 0.70 0.54 -0.62 0.21 0.00 0.00 0.00 178.15 178.98 1ffv s ASN 685 N -6.31 1.35 0.41 1.72 3.84 -1.26 -0.67 114.94 114.02 1ffv s ASN 685 Ca -0.16 -0.78 0.17 0.00 0.21 0.00 0.00 52.86 52.31 1ffv s ASN 685 Cb 0.01 0.64 1.08 0.00 -0.55 0.00 0.00 41.25 42.42 1ffv s ASN 685 CO 0.74 -0.37 1.84 -0.65 -2.79 0.00 0.00 177.10 175.87 1ffv h PRO 686 N 8.10 0.40 -0.18 0.43 0.11 -1.80 -1.19 132.00 137.88 1ffv h PRO 686 Ca -0.10 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.97 1ffv h PRO 686 Cb 1.08 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1ffv h PRO 686 CO 0.31 0.27 0.05 1.98 -0.21 0.00 0.00 178.00 180.39 1ffv h MET 687 N 0.42 0.29 -0.12 1.05 1.85 -1.89 -1.73 114.93 114.80 1ffv h MET 687 Ca 0.49 -0.07 -0.09 0.00 -0.61 0.00 0.00 59.70 59.42 1ffv h MET 687 Cb 1.21 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 33.19 1ffv h MET 687 CO -0.20 0.42 -0.35 0.82 -0.40 0.00 0.00 176.91 177.20 1ffv h ILE 688 N 0.10 1.28 -0.44 1.77 2.04 -1.61 -2.68 117.51 117.97 1ffv h ILE 688 Ca 0.06 -1.35 -0.11 0.00 1.00 0.00 0.00 64.86 64.46 1ffv h ILE 688 Cb 0.26 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 1ffv h ILE 688 CO 0.00 0.41 -0.14 0.40 0.00 0.00 0.00 178.15 178.82 1ffv h ILE 689 N 0.20 1.27 -0.84 -0.67 2.04 -1.17 -2.67 117.51 115.67 1ffv h ILE 689 Ca 0.02 -1.26 0.02 0.00 1.00 0.00 0.00 64.86 64.64 1ffv h ILE 689 Cb 0.71 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.92 1ffv h ILE 689 CO 0.05 0.43 0.55 -0.08 0.00 0.00 0.00 178.15 179.10 1ffv h GLU 690 N 0.70 1.06 -0.64 2.37 4.81 -1.05 -1.37 114.58 120.47 1ffv h GLU 690 Ca 0.11 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1ffv h GLU 690 Cb 0.69 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 1ffv h GLU 690 CO 0.05 0.70 0.20 0.78 -0.73 0.00 0.00 179.01 180.01 1ffv h GLY 691 N 1.09 1.04 1.11 1.92 0.00 -1.33 -0.74 103.07 106.15 1ffv h GLY 691 Ca 0.33 -0.58 -0.09 0.00 0.00 0.00 0.00 47.33 46.98 1ffv h GLY 691 CO -0.10 0.55 0.01 1.46 0.00 0.00 0.00 176.54 178.47 1ffv h GLN 692 N 0.93 1.07 0.13 4.80 1.08 -1.04 -1.88 115.11 120.19 1ffv h GLN 692 Ca 0.21 -0.33 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 1ffv h GLN 692 Cb 0.26 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1ffv h GLN 692 CO -0.01 1.03 -0.06 0.82 -0.95 0.00 0.00 178.83 179.66 1ffv h ILE 693 N 0.98 1.01 -0.68 2.54 1.08 -0.93 -0.84 117.51 120.67 1ffv h ILE 693 Ca 0.18 -0.62 0.12 0.00 -0.39 0.00 0.00 64.86 64.15 1ffv h ILE 693 Cb 0.54 1.40 -0.08 0.00 -3.07 0.00 0.00 36.82 35.61 1ffv h ILE 693 CO 0.03 0.15 0.26 0.45 -0.69 0.00 0.00 178.15 178.35 1ffv h HIS 694 N -0.46 0.45 -0.35 1.37 3.86 -1.08 0.23 115.15 119.16 1ffv h HIS 694 Ca -0.02 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.17 1ffv h HIS 694 Cb 0.37 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 1ffv h HIS 694 CO 0.02 0.08 0.01 0.78 0.86 0.00 0.00 177.93 179.69 1ffv h GLY 695 N 0.43 0.66 1.13 2.45 0.00 -1.25 -2.59 103.07 103.90 1ffv h GLY 695 Ca 0.36 -0.48 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 1ffv h GLY 695 CO -0.36 0.44 -0.05 -1.33 0.00 0.00 0.00 176.54 175.24 1ffv h GLY 696 N 0.43 1.11 1.71 4.60 0.00 -0.44 -2.08 103.07 108.40 1ffv h GLY 696 Ca 0.10 -0.84 -0.06 0.00 0.00 0.00 0.00 47.33 46.52 1ffv h GLY 696 CO 0.02 0.78 -0.15 1.41 0.00 0.00 0.00 176.54 178.59 1ffv h LEU 697 N 0.93 0.34 -0.46 3.11 3.38 -0.98 -0.64 115.31 120.98 1ffv h LEU 697 Ca 0.16 -0.08 -0.15 0.00 0.09 0.00 0.00 57.88 57.89 1ffv h LEU 697 Cb 0.61 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ffv h LEU 697 CO 0.04 0.52 -0.34 0.74 0.09 0.00 0.00 178.44 179.48 1ffv h THR 698 N 0.33 1.27 -0.53 0.22 2.02 -1.19 -0.81 112.91 114.22 1ffv h THR 698 Ca 0.06 -1.51 -0.08 0.00 0.77 0.00 0.00 66.41 65.65 1ffv h THR 698 Cb 0.46 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 1ffv h THR 698 CO 0.03 0.51 0.01 -0.33 0.37 0.00 0.00 175.52 176.11 1ffv h GLU 699 N 0.76 0.89 -0.43 6.66 5.08 -0.94 -1.24 114.58 125.36 1ffv h GLU 699 Ca 0.07 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1ffv h GLU 699 Cb 0.92 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 1ffv h GLU 699 CO 0.09 0.88 0.28 0.78 -1.00 0.00 0.00 179.01 180.03 1ffv h GLY 700 N 0.99 0.60 0.98 -3.84 0.00 -0.79 0.37 103.07 101.38 1ffv h GLY 700 Ca 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 1ffv h GLY 700 CO 0.02 0.21 0.24 -1.82 0.00 0.00 0.00 176.54 175.19 1ffv h TYR 701 N 0.56 0.56 -0.46 5.60 5.03 -0.82 -0.39 116.97 127.04 1ffv h TYR 701 Ca 0.16 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.47 1ffv h TYR 701 Cb -0.05 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 38.03 1ffv h TYR 701 CO -0.05 0.42 0.30 0.00 -1.32 0.00 0.00 178.16 177.50 1ffv h ALA 702 N 1.10 0.59 0.13 1.82 0.00 -0.75 0.51 119.26 122.65 1ffv h ALA 702 Ca 0.15 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ffv h ALA 702 Cb 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1ffv h ALA 702 CO -0.03 0.05 -0.06 0.28 0.00 0.00 0.00 179.25 179.49 1ffv h VAL 703 N 0.63 1.04 -0.40 0.00 2.07 -0.69 0.28 116.25 119.17 1ffv h VAL 703 Ca 0.17 -0.74 -0.10 0.00 0.82 0.00 0.00 66.70 66.86 1ffv h VAL 703 Cb -0.05 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1ffv h VAL 703 CO -0.04 0.17 -0.12 0.00 0.02 0.00 0.00 177.57 177.60 1ffv h ALA 704 N 0.29 0.56 0.00 1.67 0.00 -1.05 -3.31 119.26 117.42 1ffv h ALA 704 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ffv h ALA 704 Cb 0.41 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1ffv h ALA 704 CO 0.03 0.46 -1.22 -1.33 0.00 0.00 0.00 179.25 177.19 1ffv n MET 705 N -4.30 0.57 0.00 0.00 2.00 0.17 0.19 117.12 115.74 1ffv n MET 705 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.72 1ffv n MET 705 Cb 0.38 -1.73 0.00 0.00 0.00 0.00 0.00 33.22 31.87 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 1.23 0.02 3.79 3.03 0.00 -0.35 -3.34 105.19 109.57 1ffv n GLY 706 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 4.51 -0.07 1.61 -0.21 0.84 -4.55 119.66 121.79 1ffv s GLN 707 Ca 0.00 1.18 -0.31 0.00 0.02 0.00 0.00 55.36 56.25 1ffv s GLN 707 Cb 0.00 -2.95 0.12 0.00 1.00 0.00 0.00 33.01 31.17 1ffv s GLN 707 CO 0.00 0.39 1.10 1.14 -2.12 0.00 0.00 175.29 175.80 1ffv s GLN 708 N -1.78 0.58 -0.47 2.91 -2.07 -1.26 -4.37 119.66 113.19 1ffv s GLN 708 Ca 0.45 -0.25 0.06 0.00 -1.82 0.00 0.00 55.36 53.79 1ffv s GLN 708 Cb -0.20 0.24 0.21 0.00 -1.09 0.00 0.00 33.01 32.18 1ffv s GLN 708 CO 0.24 -0.26 0.49 -1.33 -1.32 0.00 0.00 175.29 173.12 1ffv n MET 709 N -0.25 0.95 -2.34 9.60 2.81 -1.12 -4.91 117.12 121.86 1ffv n MET 709 Ca -0.05 -3.58 -0.36 0.00 -1.81 0.00 0.00 57.70 51.90 1ffv n MET 709 Cb 0.60 -1.65 -0.01 0.00 -0.71 0.00 0.00 33.22 31.45 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 -1.01 3.73 -0.07 0.03 0.04 -1.26 -4.89 135.00 131.57 1ffv s PRO 710 Ca 0.34 1.63 0.05 0.00 0.04 0.00 0.00 61.00 63.06 1ffv s PRO 710 Cb 0.10 -2.28 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 1ffv s PRO 710 CO -0.13 -0.54 -0.21 -0.06 0.04 0.00 0.00 177.00 176.09 1ffv s PHE 711 N -1.68 2.14 1.01 0.56 0.40 -1.26 -1.09 117.98 118.06 1ffv s PHE 711 Ca 0.65 -0.73 -0.16 0.00 -0.60 0.00 0.00 56.93 56.10 1ffv s PHE 711 Cb -0.25 -1.44 0.21 0.00 0.51 0.00 0.00 43.02 42.06 1ffv s PHE 711 CO 0.29 -0.27 1.26 0.16 0.70 0.00 0.00 175.22 177.37 1ffv s ASP 712 N 0.14 2.71 0.53 1.36 1.47 -0.71 -4.87 116.67 117.31 1ffv s ASP 712 Ca -0.09 0.41 0.23 0.00 1.18 0.00 0.00 52.55 54.27 1ffv s ASP 712 Cb -0.15 -0.54 1.38 0.00 -0.34 0.00 0.00 42.92 43.28 1ffv s ASP 712 CO 0.05 -3.00 2.04 0.00 0.68 0.00 0.00 175.17 174.94 1ffv h ALA 713 N -1.82 2.32 -0.32 2.11 0.00 -2.01 0.44 119.26 119.97 1ffv h ALA 713 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ffv h ALA 713 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ffv h ALA 713 CO 0.40 -0.46 0.00 1.04 0.00 0.00 0.00 179.25 180.23 1ffv n GLN 714 N -4.37 1.77 -1.16 0.00 6.02 -1.26 -4.84 117.38 113.54 1ffv n GLN 714 Ca 0.06 -1.20 -0.06 0.00 -0.01 0.00 0.00 57.00 55.79 1ffv n GLN 714 Cb 0.45 -1.28 -0.02 0.00 1.02 0.00 0.00 30.24 30.41 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 1.05 0.80 3.74 1.08 0.00 0.14 -4.41 105.19 107.59 1ffv n GLY 715 Ca 0.12 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.89 7.17 -0.07 1.61 0.01 -1.26 -4.61 114.94 114.91 1ffv s ASN 716 Ca 0.00 1.40 -0.30 0.00 -0.71 0.00 0.00 52.86 53.25 1ffv s ASN 716 Cb 0.00 -2.46 -0.03 0.00 0.41 0.00 0.00 41.25 39.17 1ffv s ASN 716 CO 0.00 -0.00 1.21 -0.22 -1.51 0.00 0.00 177.10 176.57 1ffv s LEU 717 N 0.08 4.27 0.02 0.60 0.20 -1.26 -1.74 118.68 120.85 1ffv s LEU 717 Ca 0.38 1.80 -0.01 0.00 0.69 0.00 0.00 54.13 57.00 1ffv s LEU 717 Cb -0.20 -3.56 -0.04 0.00 -0.43 0.00 0.00 46.19 41.96 1ffv s LEU 717 CO 0.22 -0.60 0.16 -0.76 -0.29 0.00 0.00 176.35 175.08 1ffv s LEU 718 N 2.33 4.21 -1.19 -0.68 1.43 -0.25 -4.60 118.68 119.93 1ffv s LEU 718 Ca 0.56 0.25 -0.01 0.00 -1.03 0.00 0.00 54.13 53.89 1ffv s LEU 718 Cb -0.24 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.36 1ffv s LEU 718 CO 0.21 0.23 1.00 0.61 0.23 0.00 0.00 176.35 178.63 1ffv n GLY 719 N 0.77 -0.36 1.94 -3.19 0.00 -1.26 -4.19 105.19 98.90 1ffv n GLY 719 Ca -0.10 0.11 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.04 5.18 -4.11 1.61 6.94 -1.26 -3.78 115.26 116.79 1ffv n ASN 720 Ca -0.24 -3.07 -0.14 0.00 -0.02 0.00 0.00 54.58 51.12 1ffv n ASN 720 Cb 0.65 -0.72 -0.10 0.00 -2.36 0.00 0.00 39.78 37.25 1ffv n ASN 720 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1ffv s THR 721 N -2.84 0.08 -1.66 5.53 -4.23 -1.26 -4.27 115.64 106.99 1ffv s THR 721 Ca 0.54 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.17 1ffv s THR 721 Cb 0.42 -2.52 0.27 0.00 1.34 0.00 0.00 72.50 72.01 1ffv s THR 721 CO 0.14 0.00 1.24 0.18 -0.54 0.00 0.00 174.62 175.65 1ffv n LEU 722 N -0.35 0.00 -0.17 4.79 4.77 -1.26 -0.69 117.00 124.09 1ffv n LEU 722 Ca 0.02 0.17 -0.09 0.00 -0.03 0.00 0.00 56.01 56.08 1ffv n LEU 722 Cb 0.66 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1ffv n LEU 722 CO 0.33 -0.10 0.90 0.24 -1.33 0.00 0.00 177.39 177.43 1ffv h MET 723 N 0.00 0.78 0.00 3.23 2.86 -1.95 -3.38 114.93 116.46 1ffv h MET 723 Ca 0.00 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1ffv h MET 723 Cb 0.07 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.62 1ffv h MET 723 CO 0.00 0.74 -0.96 -0.25 1.06 0.00 0.00 176.91 177.50 1ffv n ASP 724 N -4.48 4.79 -4.62 1.22 8.00 -1.05 -4.98 116.55 115.44 1ffv n ASP 724 Ca 0.01 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.08 1ffv n ASP 724 Cb 0.21 0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 41.77 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 -1.96 1.96 0.14 1.24 5.04 0.13 -4.93 117.35 118.98 1ffv s TYR 725 Ca 0.00 0.55 -0.31 0.00 -2.44 0.00 0.00 57.07 54.87 1ffv s TYR 725 Cb 0.00 -4.06 -0.10 0.00 0.35 0.00 0.00 41.96 38.15 1ffv s TYR 725 CO 0.00 -3.00 1.57 0.12 -1.34 0.00 0.00 175.55 172.90 1ffv s PHE 726 N 5.92 2.97 -0.15 4.97 5.36 -1.26 -4.57 117.98 131.22 1ffv s PHE 726 Ca 0.75 0.60 -0.04 0.00 -0.96 0.00 0.00 56.93 57.29 1ffv s PHE 726 Cb -0.24 -3.91 0.07 0.00 -0.34 0.00 0.00 43.02 38.60 1ffv s PHE 726 CO 0.32 -3.41 0.22 -0.51 -1.46 0.00 0.00 175.22 170.38 1ffv s LEU 727 N 1.39 -0.17 0.46 6.12 1.43 -1.26 -4.74 118.68 121.91 1ffv s LEU 727 Ca 0.70 0.19 -0.23 0.00 -1.03 0.00 0.00 54.13 53.76 1ffv s LEU 727 Cb -0.42 0.46 -0.07 0.00 0.03 0.00 0.00 46.19 46.18 1ffv s LEU 727 CO 0.31 -0.28 1.17 -2.16 0.23 0.00 0.00 176.35 175.62 1ffv s PRO 728 N 2.35 3.77 0.55 1.29 0.04 -1.26 -5.07 135.00 136.68 1ffv s PRO 728 Ca 0.04 1.79 0.09 0.00 0.04 0.00 0.00 61.00 62.96 1ffv s PRO 728 Cb -0.14 -2.43 0.09 0.00 0.04 0.00 0.00 34.50 32.07 1ffv s PRO 728 CO -0.09 -0.55 0.76 0.25 0.04 0.00 0.00 177.00 177.41 1ffv n THR 729 N -0.45 0.00 0.23 1.26 -2.24 -1.26 -4.91 114.28 106.91 1ffv n THR 729 Ca 0.07 -1.86 0.17 0.00 -2.27 0.00 0.00 64.05 60.16 1ffv n THR 729 Cb 0.48 -0.52 0.85 0.00 -2.10 0.00 0.00 70.33 69.04 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 0.15 1.72 -0.06 6.98 0.00 -1.97 -1.93 119.26 124.15 1ffv h ALA 730 Ca -0.26 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.40 1ffv h ALA 730 Cb 1.20 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.01 1ffv h ALA 730 CO 0.37 -0.21 -0.91 0.28 0.00 0.00 0.00 179.25 178.78 1ffv h VAL 731 N 0.00 1.30 0.00 0.00 2.07 -2.02 -3.28 116.25 114.32 1ffv h VAL 731 Ca 0.06 -2.16 -0.04 0.00 0.82 0.00 0.00 66.70 65.38 1ffv h VAL 731 Cb 0.36 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 1ffv h VAL 731 CO -0.00 0.67 -0.31 -0.33 0.02 0.00 0.00 177.57 177.62 1ffv h GLU 732 N 0.42 0.00 -6.31 1.57 3.07 -1.74 -3.44 114.58 108.15 1ffv h GLU 732 Ca -0.09 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.20 1ffv h GLU 732 Cb 1.54 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.39 1ffv h GLU 732 CO 0.18 0.17 0.86 0.99 -1.40 0.00 0.00 179.01 179.81 1ffv s THR 733 N -3.14 4.46 0.78 1.13 2.01 -0.84 -4.96 115.64 115.09 1ffv s THR 733 Ca 0.05 1.68 -0.11 0.00 0.31 0.00 0.00 61.69 63.62 1ffv s THR 733 Cb 0.06 -4.37 0.07 0.00 0.01 0.00 0.00 72.50 68.27 1ffv s THR 733 CO 0.71 -0.47 1.11 -2.16 -0.69 0.00 0.00 174.62 173.12 1ffv s PRO 734 N 3.71 2.08 0.05 4.92 0.04 -1.26 -4.95 135.00 139.59 1ffv s PRO 734 Ca 0.47 1.30 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 1ffv s PRO 734 Cb -0.13 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 1ffv s PRO 734 CO 0.16 -1.80 1.14 -1.58 0.04 0.00 0.00 177.00 174.96 1ffv s HIS 735 N -2.74 3.50 -0.07 0.56 5.65 -1.26 -5.02 115.29 115.91 1ffv s HIS 735 Ca 0.64 1.42 -0.11 0.00 0.25 0.00 0.00 55.06 57.25 1ffv s HIS 735 Cb -0.19 -3.34 -0.05 0.00 -1.18 0.00 0.00 32.58 27.82 1ffv s HIS 735 CO 0.54 -0.92 0.27 -1.58 -0.65 0.00 0.00 174.74 172.40 1ffv s TRP 736 N 0.98 3.64 -0.19 3.88 0.52 -1.26 -4.52 118.94 121.98 1ffv s TRP 736 Ca 0.57 0.74 -0.04 0.00 0.02 0.00 0.00 56.10 57.39 1ffv s TRP 736 Cb -0.27 -2.14 -0.02 0.00 -1.15 0.00 0.00 33.47 29.89 1ffv s TRP 736 CO 0.29 0.64 -0.04 -1.21 0.02 0.00 0.00 176.95 176.65 1ffv s GLU 737 N -0.87 3.50 0.19 4.98 2.02 -0.87 -5.05 118.70 122.61 1ffv s GLU 737 Ca 0.19 -0.58 0.10 0.00 0.02 0.00 0.00 54.97 54.70 1ffv s GLU 737 Cb -0.14 -2.98 -0.04 0.00 0.10 0.00 0.00 34.13 31.06 1ffv s GLU 737 CO 0.08 -0.02 -0.17 0.95 0.02 0.00 0.00 175.26 176.12 1ffv s THR 738 N 1.03 2.74 0.29 3.63 -4.23 -1.26 0.07 115.64 117.91 1ffv s THR 738 Ca 0.01 -1.88 -0.13 0.00 -1.18 0.00 0.00 61.69 58.50 1ffv s THR 738 Cb -0.15 -2.34 0.01 0.00 1.34 0.00 0.00 72.50 71.37 1ffv s THR 738 CO 0.01 -0.13 0.58 -0.62 -0.54 0.00 0.00 174.62 173.92 1ffv s ASP 739 N -2.78 0.04 0.17 3.99 -1.08 0.02 -4.91 116.67 112.13 1ffv s ASP 739 Ca 0.23 -0.98 -0.24 0.00 -0.52 0.00 0.00 52.55 51.03 1ffv s ASP 739 Cb -0.08 0.67 0.06 0.00 -1.46 0.00 0.00 42.92 42.11 1ffv s ASP 739 CO 0.12 -1.30 0.89 -1.38 0.52 0.00 0.00 175.17 174.02 1ffv s HIS 740 N -3.56 -0.17 0.12 -5.34 -3.43 -1.26 -2.00 115.29 99.65 1ffv s HIS 740 Ca 0.20 -0.15 -0.01 0.00 -0.80 0.00 0.00 55.06 54.30 1ffv s HIS 740 Cb -0.03 0.65 -0.04 0.00 -1.43 0.00 0.00 32.58 31.73 1ffv s HIS 740 CO 0.11 -0.90 0.03 0.95 -2.00 0.00 0.00 174.74 172.93 1ffv s THR 741 N -3.43 0.19 -0.30 -5.38 -4.23 -1.23 -4.96 115.64 96.31 1ffv s THR 741 Ca 0.11 -1.90 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 1ffv s THR 741 Cb -0.02 -1.96 0.09 0.00 1.34 0.00 0.00 72.50 71.95 1ffv s THR 741 CO 0.02 -0.57 0.02 -0.69 -0.54 0.00 0.00 174.62 172.86 1ffv s VAL 742 N -3.98 1.82 -0.46 2.29 1.01 -1.26 -4.39 120.40 115.44 1ffv s VAL 742 Ca 0.21 -1.84 0.03 0.00 0.00 0.00 0.00 61.98 60.38 1ffv s VAL 742 Cb 0.07 -2.25 0.12 0.00 0.00 0.00 0.00 36.38 34.33 1ffv s VAL 742 CO -0.00 -0.45 0.20 -0.89 0.00 0.00 0.00 175.10 173.96 1ffv s THR 743 N 1.17 2.22 0.68 3.92 2.01 -1.26 -4.93 115.64 119.45 1ffv s THR 743 Ca 0.05 -2.88 -0.17 0.00 0.31 0.00 0.00 61.69 59.01 1ffv s THR 743 Cb -0.19 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.74 1ffv s THR 743 CO -0.11 -0.77 0.96 -2.65 -0.69 0.00 0.00 174.62 171.36 1ffv n PRO 744 N 3.52 0.63 -2.93 4.92 -0.02 -1.26 -3.68 135.00 136.18 1ffv n PRO 744 Ca 0.05 0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 1ffv n PRO 744 Cb 0.35 -2.20 -0.05 0.00 -0.02 0.00 0.00 33.50 31.58 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 -1.51 6.59 0.30 2.55 0.15 -0.82 -4.73 113.70 116.22 1ffv s SER 745 Ca 0.74 0.44 0.04 0.00 0.70 0.00 0.00 55.95 57.88 1ffv s SER 745 Cb -0.37 -2.41 0.66 0.00 -1.71 0.00 0.00 66.02 62.19 1ffv s SER 745 CO 0.49 -0.73 1.81 -0.65 1.20 0.00 0.00 173.24 175.36 1ffv h PRO 746 N 8.41 0.84 0.00 5.44 0.11 -1.91 -2.45 132.00 142.45 1ffv h PRO 746 Ca -0.24 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1ffv h PRO 746 Cb 1.09 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1ffv h PRO 746 CO 0.92 0.56 -0.18 1.12 -0.21 0.00 0.00 178.00 180.20 1ffv h HIS 747 N 0.87 0.00 -3.52 0.65 2.07 -1.94 -3.46 115.15 109.81 1ffv h HIS 747 Ca 0.54 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 57.53 1ffv h HIS 747 Cb 0.71 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.66 1ffv h HIS 747 CO -0.00 0.00 0.29 -1.58 -3.07 0.00 0.00 177.93 173.57 1ffv s HIS 748 N -3.14 3.79 0.46 6.12 5.04 -0.92 -4.96 115.29 121.69 1ffv s HIS 748 Ca 0.09 1.69 0.28 0.00 -1.54 0.00 0.00 55.06 55.57 1ffv s HIS 748 Cb 0.11 -2.97 1.33 0.00 0.04 0.00 0.00 32.58 31.10 1ffv s HIS 748 CO 0.64 0.24 1.77 -1.35 -2.34 0.00 0.00 174.74 173.70 1ffv h PRO 749 N 5.55 0.19 0.00 2.88 0.11 -1.89 -1.67 132.00 137.16 1ffv h PRO 749 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1ffv h PRO 749 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ffv h PRO 749 CO 0.71 0.12 -0.03 0.44 -0.21 0.00 0.00 178.00 179.03 1ffv n ILE 750 N -4.44 1.16 -1.09 4.15 -5.35 -1.26 -4.99 119.36 107.54 1ffv n ILE 750 Ca 0.27 -1.29 -0.03 0.00 -0.27 0.00 0.00 62.75 61.43 1ffv n ILE 750 Cb 1.11 0.28 -0.01 0.00 -1.74 0.00 0.00 39.64 39.28 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 -0.75 0.42 3.72 3.28 0.00 -0.63 -4.58 105.19 106.65 1ffv n GLY 751 Ca 0.06 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.53 3.47 0.35 4.61 0.00 -1.26 -1.35 121.76 126.04 1ffv s ALA 752 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 51.96 51.85 1ffv s ALA 752 Cb 0.00 -2.67 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 1ffv s ALA 752 CO 0.00 -0.02 0.36 0.15 0.00 0.00 0.00 175.76 176.25 1ffv s LYS 753 N 0.67 2.82 0.81 0.00 1.02 0.71 -4.45 119.74 121.33 1ffv s LYS 753 Ca 0.26 -1.23 -0.12 0.00 0.02 0.00 0.00 55.97 54.90 1ffv s LYS 753 Cb -0.15 -2.57 0.08 0.00 -0.52 0.00 0.00 37.83 34.66 1ffv s LYS 753 CO 0.11 0.05 1.11 0.20 -0.92 0.00 0.00 175.35 175.89 1ffv s GLY 754 N -4.07 1.61 0.00 -3.33 0.00 -1.26 -4.75 107.32 95.52 1ffv s GLY 754 Ca 0.43 -0.28 0.00 0.00 0.00 0.00 0.00 44.72 44.87 1ffv s GLY 754 CO 0.28 0.17 0.00 1.55 0.00 0.00 0.00 173.10 175.10 1ffv n VAL 755 N -3.46 0.00 -0.24 1.40 3.14 -1.26 -4.64 118.33 113.26 1ffv n VAL 755 Ca 0.07 0.00 0.26 0.00 -2.96 0.00 0.00 64.34 61.71 1ffv n VAL 755 Cb 0.57 0.00 0.64 0.00 -1.06 0.00 0.00 33.84 33.99 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 2.62 0.00 1.55 0.00 -1.93 -2.05 119.26 119.44 1ffv h ALA 756 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ffv h ALA 756 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1ffv h ALA 756 CO 0.00 -0.92 -1.14 0.39 0.00 0.00 0.00 179.25 177.57 1ffv n GLU 757 N -4.38 0.55 -0.24 0.00 1.02 -1.26 -4.37 120.64 111.95 1ffv n GLU 757 Ca 0.21 0.05 0.05 0.00 -0.02 0.00 0.00 57.16 57.45 1ffv n GLU 757 Cb 0.93 -1.74 0.17 0.00 -0.02 0.00 0.00 31.44 30.78 1ffv n GLU 757 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1ffv h SER 758 N 0.00 0.01 -0.16 1.62 0.02 -1.75 -1.01 113.55 112.27 1ffv h SER 758 Ca 0.00 0.14 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1ffv h SER 758 Cb 0.95 0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1ffv h SER 758 CO 0.00 -0.03 0.06 1.55 -1.14 0.00 0.00 176.83 177.27 1ffv h PRO 759 N 0.27 0.32 0.06 3.45 0.13 -1.76 -0.51 132.00 133.95 1ffv h PRO 759 Ca 0.40 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.49 1ffv h PRO 759 Cb 0.66 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1ffv h PRO 759 CO -0.49 0.29 -0.03 1.25 -0.23 0.00 0.00 178.00 178.79 1ffv h HIS 760 N 0.32 -0.08 -0.14 1.56 -0.00 -1.39 -2.40 115.15 113.01 1ffv h HIS 760 Ca 0.08 -0.00 0.05 0.00 -0.00 0.00 0.00 60.37 60.49 1ffv h HIS 760 Cb 0.12 0.03 -0.06 0.00 -0.00 0.00 0.00 27.41 27.50 1ffv h HIS 760 CO 0.00 0.50 -0.22 0.28 -0.00 0.00 0.00 177.93 178.50 1ffv h VAL 761 N -0.90 0.46 -0.02 5.26 2.07 -1.14 -3.10 116.25 118.88 1ffv h VAL 761 Ca -0.01 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.33 1ffv h VAL 761 Cb 0.61 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1ffv h VAL 761 CO 0.01 0.00 -0.78 1.23 0.02 0.00 0.00 177.57 178.05 1ffv h GLY 762 N -0.27 0.22 1.36 2.17 0.00 -1.22 -3.35 103.07 101.99 1ffv h GLY 762 Ca 0.10 -0.35 -0.15 0.00 0.00 0.00 0.00 47.33 46.94 1ffv h GLY 762 CO -0.30 0.31 -0.44 1.48 0.00 0.00 0.00 176.54 177.59 1ffv h SER 763 N 0.12 0.74 -0.13 0.19 4.64 -1.37 -3.12 113.55 114.63 1ffv h SER 763 Ca -0.03 -0.35 0.04 0.00 -0.47 0.00 0.00 61.79 60.98 1ffv h SER 763 Cb 1.37 -0.21 -0.05 0.00 -0.31 0.00 0.00 62.40 63.20 1ffv h SER 763 CO 0.12 1.08 -0.20 0.40 -0.87 0.00 0.00 176.83 177.35 1ffv h ILE 764 N 0.56 0.49 0.00 0.95 2.04 -1.67 -0.31 117.51 119.57 1ffv h ILE 764 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1ffv h ILE 764 Cb 0.98 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1ffv h ILE 764 CO 0.09 0.00 0.00 1.55 0.00 0.00 0.00 178.15 179.79 1ffv h PRO 765 N -0.26 0.00 -0.34 2.37 0.13 -1.75 -2.34 132.00 129.81 1ffv h PRO 765 Ca 0.10 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.08 1ffv h PRO 765 Cb 0.40 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.52 1ffv h PRO 765 CO -0.28 0.00 -0.38 1.15 -0.23 0.00 0.00 178.00 178.26 1ffv h THR 766 N 0.00 1.28 -0.10 1.56 2.02 -1.05 0.10 112.91 116.72 1ffv h THR 766 Ca 0.00 -1.55 -0.03 0.00 0.77 0.00 0.00 66.41 65.60 1ffv h THR 766 Cb 0.53 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 68.37 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 0.65 0.25 -0.88 3.16 0.04 -0.79 -1.65 116.94 117.72 1ffv h PHE 767 Ca 0.06 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 1ffv h PHE 767 Cb 0.94 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.99 1ffv h PHE 767 CO 0.05 0.57 0.49 1.15 -0.60 0.00 0.00 178.31 179.98 1ffv h THR 768 N -0.15 1.25 -0.51 -1.55 2.02 -1.38 -1.62 112.91 110.98 1ffv h THR 768 Ca 0.02 -0.60 0.03 0.00 0.77 0.00 0.00 66.41 66.63 1ffv h THR 768 Cb 0.51 0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.93 1ffv h THR 768 CO 0.02 0.28 0.30 0.00 0.37 0.00 0.00 175.52 176.48 1ffv h ALA 769 N 1.32 0.65 -0.61 6.16 0.00 -0.67 0.27 119.26 126.38 1ffv h ALA 769 Ca 0.31 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 1ffv h ALA 769 Cb 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1ffv h ALA 769 CO -0.05 -0.01 0.07 0.00 0.00 0.00 0.00 179.25 179.26 1ffv h ALA 770 N 1.23 0.82 -0.04 0.00 0.00 -0.87 0.10 119.26 120.50 1ffv h ALA 770 Ca 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ffv h ALA 770 Cb 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ffv h ALA 770 CO -0.10 0.61 -0.01 0.28 0.00 0.00 0.00 179.25 180.02 1ffv h VAL 771 N 0.95 1.31 -0.60 0.00 2.07 -0.96 -2.43 116.25 116.59 1ffv h VAL 771 Ca 0.18 -0.95 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 1ffv h VAL 771 Cb 0.47 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 1ffv h VAL 771 CO 0.02 0.26 0.23 0.58 0.02 0.00 0.00 177.57 178.67 1ffv h VAL 772 N -0.28 1.23 -0.32 2.57 2.07 -0.92 -2.13 116.25 118.46 1ffv h VAL 772 Ca 0.01 -0.74 0.09 0.00 0.82 0.00 0.00 66.70 66.87 1ffv h VAL 772 Cb 0.42 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1ffv h VAL 772 CO 0.00 0.29 0.23 -0.78 0.02 0.00 0.00 177.57 177.33 1ffv h ASP 773 N 0.84 0.03 0.48 0.57 3.58 -0.76 0.22 116.42 121.38 1ffv h ASP 773 Ca 0.20 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.61 1ffv h ASP 773 Cb 0.23 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.26 1ffv h ASP 773 CO -0.01 0.02 -0.16 0.00 -2.88 0.00 0.00 179.24 176.20 1ffv h ALA 774 N 1.84 1.24 -0.00 -0.78 0.00 -0.86 -2.89 119.26 117.80 1ffv h ALA 774 Ca 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ffv h ALA 774 Cb 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ffv h ALA 774 CO -0.01 0.20 -0.57 1.19 0.00 0.00 0.00 179.25 180.07 1ffv n PHE 775 N -3.63 0.00 -0.34 0.00 3.01 0.57 -4.68 117.46 112.39 1ffv n PHE 775 Ca -0.01 0.00 0.20 0.00 1.01 0.00 0.00 57.45 58.65 1ffv n PHE 775 Cb 0.29 0.00 0.44 0.00 -0.01 0.00 0.00 39.48 40.20 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 2.40 1.98 0.00 4.37 0.00 -0.70 -1.35 119.26 125.96 1ffv h ALA 776 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ffv h ALA 776 Cb 0.43 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ffv h ALA 776 CO 0.00 -0.44 0.00 1.12 0.00 0.00 0.00 179.25 179.93 1ffv h HIS 777 N 0.49 0.00 -0.44 0.00 2.07 -1.83 -0.91 115.15 114.53 1ffv h HIS 777 Ca 0.63 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.15 1ffv h HIS 777 Cb 1.37 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.35 1ffv h HIS 777 CO -0.00 0.00 0.00 1.33 -3.07 0.00 0.00 177.93 176.19 1ffv n VAL 778 N -2.42 2.34 -0.56 6.12 0.24 -0.51 -4.95 118.33 118.59 1ffv n VAL 778 Ca 0.00 -1.55 0.00 0.00 -2.04 0.00 0.00 64.34 60.75 1ffv n VAL 778 Cb 0.15 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.35 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 0.22 0.75 3.69 7.63 0.00 -0.34 -5.04 105.19 112.10 1ffv n GLY 779 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.62 3.85 -0.13 1.61 1.01 -1.19 -4.91 120.40 118.02 1ffv s VAL 780 Ca 0.00 1.24 0.16 0.00 0.00 0.00 0.00 61.98 63.37 1ffv s VAL 780 Cb 0.00 -3.80 -0.22 0.00 0.00 0.00 0.00 36.38 32.36 1ffv s VAL 780 CO 0.00 0.01 0.14 0.35 0.00 0.00 0.00 175.10 175.61 1ffv n THR 781 N 4.54 0.85 -3.55 3.92 -2.24 -1.26 -4.12 114.28 112.42 1ffv n THR 781 Ca 0.12 -0.63 -0.15 0.00 -2.27 0.00 0.00 64.05 61.12 1ffv n THR 781 Cb 0.44 -0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 68.22 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 -2.62 -0.58 -0.03 4.78 5.65 -1.26 -4.77 115.29 116.46 1ffv s HIS 782 Ca -0.08 1.05 -0.01 0.00 0.25 0.00 0.00 55.06 56.27 1ffv s HIS 782 Cb 0.07 0.41 0.03 0.00 -1.18 0.00 0.00 32.58 31.90 1ffv s HIS 782 CO 0.70 -0.50 0.04 -0.51 -0.65 0.00 0.00 174.74 173.82 1ffv s LEU 783 N -0.98 0.59 0.42 8.88 1.43 -1.26 -5.09 118.68 122.66 1ffv s LEU 783 Ca -0.07 0.05 -0.24 0.00 -1.03 0.00 0.00 54.13 52.84 1ffv s LEU 783 Cb -0.01 -0.13 -0.08 0.00 0.03 0.00 0.00 46.19 46.00 1ffv s LEU 783 CO 0.06 -0.19 1.14 -1.81 0.23 0.00 0.00 176.35 175.78 1ffv s ASP 784 N 1.66 6.45 0.68 2.29 1.01 -1.26 -5.00 116.67 122.51 1ffv s ASP 784 Ca -0.01 2.27 -0.12 0.00 0.71 0.00 0.00 52.55 55.39 1ffv s ASP 784 Cb -0.13 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.21 1ffv s ASP 784 CO -0.03 -0.72 1.07 -0.04 0.21 0.00 0.00 175.17 175.66 1ffv s MET 785 N -2.47 2.87 0.46 8.23 -1.94 -1.26 -4.55 119.30 120.64 1ffv s MET 785 Ca 0.59 1.12 -0.20 0.00 -1.71 0.00 0.00 55.69 55.49 1ffv s MET 785 Cb -0.28 -1.98 -0.10 0.00 2.01 0.00 0.00 34.83 34.49 1ffv s MET 785 CO 0.35 -1.16 0.98 -1.25 -0.01 0.00 0.00 175.02 173.92 1ffv s PRO 786 N -4.65 4.07 -1.32 2.03 0.05 -1.26 -4.73 135.00 129.18 1ffv s PRO 786 Ca 0.61 1.15 -0.06 0.00 0.05 0.00 0.00 61.00 62.76 1ffv s PRO 786 Cb -0.16 -2.15 0.12 0.00 0.05 0.00 0.00 34.50 32.36 1ffv s PRO 786 CO 0.49 -0.18 2.36 0.72 0.05 0.00 0.00 177.00 180.44 1ffv n HIS 787 N -0.89 2.61 -2.00 0.56 8.25 0.13 -4.80 115.22 119.09 1ffv n HIS 787 Ca 0.07 -2.82 -0.34 0.00 -0.26 0.00 0.00 57.72 54.37 1ffv n HIS 787 Cb 0.54 -1.85 0.02 0.00 1.12 0.00 0.00 29.99 29.82 1ffv n HIS 787 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ffv s THR 788 N -1.04 3.28 0.37 1.59 2.01 -1.21 -4.76 115.64 115.86 1ffv s THR 788 Ca 0.53 0.67 0.04 0.00 0.31 0.00 0.00 61.69 63.25 1ffv s THR 788 Cb 0.18 -3.21 0.24 0.00 0.01 0.00 0.00 72.50 69.72 1ffv s THR 788 CO -0.09 -0.29 1.99 0.77 -0.69 0.00 0.00 174.62 176.31 1ffv h SER 789 N 0.56 0.59 0.55 3.53 4.64 -1.86 0.27 113.55 121.83 1ffv h SER 789 Ca -0.48 -0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 60.77 1ffv h SER 789 Cb 1.25 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1ffv h SER 789 CO 0.56 0.48 -0.27 0.22 -0.87 0.00 0.00 176.83 176.95 1ffv h TYR 790 N 0.67 -0.69 -0.62 4.77 3.20 -1.85 -0.30 116.97 122.15 1ffv h TYR 790 Ca 0.17 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 1ffv h TYR 790 Cb 0.02 0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 1ffv h TYR 790 CO 0.00 -0.37 0.16 0.00 -1.64 0.00 0.00 178.16 176.31 1ffv h ARG 791 N -0.91 0.96 -0.26 1.82 3.08 -1.81 -2.19 114.38 115.07 1ffv h ARG 791 Ca -0.08 -0.20 -0.14 0.00 0.07 0.00 0.00 59.98 59.63 1ffv h ARG 791 Cb 0.63 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1ffv h ARG 791 CO 0.13 0.84 -0.41 0.28 -1.07 0.00 0.00 179.97 179.74 1ffv h VAL 792 N 0.92 1.30 -0.80 2.04 2.07 -0.45 -2.83 116.25 118.50 1ffv h VAL 792 Ca 0.20 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.10 1ffv h VAL 792 Cb 0.31 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.59 1ffv h VAL 792 CO -0.00 0.50 0.35 -0.25 0.02 0.00 0.00 177.57 178.19 1ffv h TRP 793 N 0.51 1.19 -0.78 1.57 7.01 -0.76 -0.15 115.95 124.53 1ffv h TRP 793 Ca 0.04 -0.08 0.08 0.00 2.11 0.00 0.00 58.89 61.04 1ffv h TRP 793 Cb 0.93 -0.36 -0.07 0.00 -2.10 0.00 0.00 29.16 27.56 1ffv h TRP 793 CO 0.04 0.89 0.45 -0.22 -2.79 0.00 0.00 178.44 176.80 1ffv h LYS 794 N 1.15 0.76 -0.23 2.65 1.63 -1.23 -0.56 116.57 120.73 1ffv h LYS 794 Ca 0.27 -0.05 -0.15 0.00 -0.85 0.00 0.00 60.65 59.87 1ffv h LYS 794 Cb 0.18 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1ffv h LYS 794 CO -0.03 0.50 -0.47 0.77 -3.45 0.00 0.00 179.45 176.77 1ffv h SER 795 N 0.78 0.67 -0.89 4.20 0.02 -1.15 -1.71 113.55 115.47 1ffv h SER 795 Ca 0.36 -0.32 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1ffv h SER 795 Cb 0.28 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.58 1ffv h SER 795 CO -0.22 1.03 0.57 -0.07 -1.14 0.00 0.00 176.83 177.00 1ffv h LEU 796 N 0.49 0.94 -0.39 5.07 -0.00 0.14 -1.16 115.31 120.40 1ffv h LEU 796 Ca 0.03 -0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.74 1ffv h LEU 796 Cb 1.00 -0.21 -0.00 0.00 -0.00 0.00 0.00 40.66 41.45 1ffv h LEU 796 CO 0.09 0.64 -0.46 0.50 -0.00 0.00 0.00 178.44 179.21 1ffv h LYS 797 N 1.10 0.86 -0.59 1.13 3.64 -0.97 0.65 116.57 122.38 1ffv h LYS 797 Ca 0.36 -0.49 -0.06 0.00 -1.27 0.00 0.00 60.65 59.18 1ffv h LYS 797 Cb 0.03 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1ffv h LYS 797 CO -0.13 1.13 0.12 1.49 -2.27 0.00 0.00 179.45 179.80 1ffv h GLU 798 N 0.68 0.96 -0.74 1.90 4.81 -0.86 -3.00 114.58 118.33 1ffv h GLU 798 Ca 0.04 -0.24 -0.12 0.00 -0.13 0.00 0.00 59.36 58.90 1ffv h GLU 798 Cb 1.05 -0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.24 1ffv h GLU 798 CO 0.11 0.89 0.16 0.72 -0.73 0.00 0.00 179.01 180.16 1ffv n HIS 799 N -4.34 2.06 -3.50 0.92 8.25 -0.48 -4.93 115.22 113.20 1ffv n HIS 799 Ca 0.03 -0.92 -0.26 0.00 -0.26 0.00 0.00 57.72 56.31 1ffv n HIS 799 Cb 0.25 -0.57 0.01 0.00 1.12 0.00 0.00 29.99 30.80 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 0.14 -4.26 -0.22 0.41 4.13 -0.99 -4.87 115.26 109.61 1ffv n ASN 800 Ca 0.32 -0.51 0.06 0.00 1.68 0.00 0.00 54.58 56.13 1ffv n ASN 800 Cb 1.20 -3.48 -0.01 0.00 -1.54 0.00 0.00 39.78 35.96 1ffv n ASN 800 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1ffv n LEU 801 N -4.03 1.19 -4.73 3.41 4.77 0.22 -5.00 117.00 112.83 1ffv n LEU 801 Ca -0.01 -0.72 -0.42 0.00 -0.03 0.00 0.00 56.01 54.83 1ffv n LEU 801 Cb 0.54 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.61 1ffv n LEU 801 CO 0.59 0.24 1.16 0.00 -1.33 0.00 0.00 177.39 178.05 1ffv s ALA 802 N -1.60 3.70 0.00 -1.18 0.00 -0.77 -4.84 121.76 117.08 1ffv s ALA 802 Ca 0.09 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.37 1ffv s ALA 802 Cb 0.09 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.62 1ffv s ALA 802 CO 0.32 -0.74 0.00 1.28 0.00 0.00 0.00 175.76 176.62