#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fk4 s ILE 4 N 0.00 0.02 -0.23 -0.61 2.07 -0.82 -2.51 121.20 119.13 3fk4 s ILE 4 Ca 0.00 -0.16 -0.05 0.00 -1.41 0.00 0.00 60.65 59.03 3fk4 s ILE 4 Cb 0.00 -0.26 -0.01 0.00 0.13 0.00 0.00 42.46 42.32 3fk4 s ILE 4 CO 0.00 -0.09 -0.01 -0.63 -1.91 0.00 0.00 174.94 172.30 3fk4 s ILE 5 N -0.26 3.57 -0.17 2.00 1.01 -0.45 -0.83 121.20 126.07 3fk4 s ILE 5 Ca -0.03 -0.46 -0.10 0.00 0.00 0.00 0.00 60.65 60.05 3fk4 s ILE 5 Cb -0.03 -2.65 -0.05 0.00 0.01 0.00 0.00 42.46 39.74 3fk4 s ILE 5 CO 0.00 0.38 0.17 0.00 0.00 0.00 0.00 174.94 175.49 3fk4 s ALA 6 N 1.50 3.70 -0.26 9.38 0.00 0.04 -0.25 121.76 135.88 3fk4 s ALA 6 Ca 0.06 -0.62 -0.07 0.00 0.00 0.00 0.00 51.96 51.32 3fk4 s ALA 6 Cb -0.15 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.77 3fk4 s ALA 6 CO -0.02 0.24 0.06 0.99 0.00 0.00 0.00 175.76 177.03 3fk4 s THR 7 N 0.10 4.10 0.06 0.00 2.01 0.19 -1.35 115.64 120.74 3fk4 s THR 7 Ca 0.11 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 61.84 3fk4 s THR 7 Cb -0.12 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 3fk4 s THR 7 CO 0.01 0.30 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.83 3fk4 s TYR 8 N 1.57 2.79 -0.29 4.92 2.02 0.88 -0.85 117.35 128.40 3fk4 s TYR 8 Ca 0.06 -0.11 -0.05 0.00 -0.37 0.00 0.00 57.07 56.59 3fk4 s TYR 8 Cb -0.15 -1.51 0.02 0.00 -0.40 0.00 0.00 41.96 39.91 3fk4 s TYR 8 CO 0.02 0.39 0.04 -1.17 -1.57 0.00 0.00 175.55 173.27 3fk4 s LEU 9 N -1.82 3.72 0.05 -1.29 1.98 -0.06 -0.86 118.68 120.41 3fk4 s LEU 9 Ca 0.19 -0.80 0.09 0.00 -2.89 0.00 0.00 54.13 50.72 3fk4 s LEU 9 Cb -0.11 -1.82 -0.03 0.00 0.66 0.00 0.00 46.19 44.89 3fk4 s LEU 9 CO 0.11 -0.19 -0.26 -0.51 -1.89 0.00 0.00 176.35 173.61 3fk4 s ILE 10 N 1.44 2.16 -0.89 6.68 2.07 -0.36 -1.34 121.20 130.97 3fk4 s ILE 10 Ca 0.01 -1.41 -0.01 0.00 -1.41 0.00 0.00 60.65 57.83 3fk4 s ILE 10 Cb -0.17 -1.85 0.22 0.00 0.13 0.00 0.00 42.46 40.79 3fk4 s ILE 10 CO 0.01 0.35 0.77 -1.00 -1.91 0.00 0.00 174.94 173.16 3fk4 s HIS 11 N -0.82 3.89 -0.16 3.50 3.76 -0.70 -2.04 115.29 122.71 3fk4 s HIS 11 Ca 0.12 -3.07 -0.29 0.00 -0.15 0.00 0.00 55.06 51.67 3fk4 s HIS 11 Cb -0.10 -3.20 -0.04 0.00 1.11 0.00 0.00 32.58 30.35 3fk4 s HIS 11 CO 0.02 -0.72 1.64 0.34 -0.85 0.00 0.00 174.74 175.17 3fk4 s ASP 12 N -0.26 6.46 0.00 1.40 2.15 0.24 -4.68 116.67 121.97 3fk4 s ASP 12 Ca 0.28 1.83 0.28 0.00 0.43 0.00 0.00 52.55 55.37 3fk4 s ASP 12 Cb -0.07 -2.53 1.00 0.00 -0.30 0.00 0.00 42.92 41.02 3fk4 s ASP 12 CO -0.13 -1.16 1.76 -0.90 -0.17 0.00 0.00 175.17 174.57 3fk4 n ASP 13 N 8.08 0.17 -0.13 -0.34 5.75 -1.26 0.56 116.55 129.38 3fk4 n ASP 13 Ca 0.19 0.23 0.12 0.00 -0.01 0.00 0.00 54.79 55.32 3fk4 n ASP 13 Cb 0.44 -0.25 0.20 0.00 -1.03 0.00 0.00 41.12 40.49 3fk4 n ASP 13 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3fk4 n SER 14 N -1.49 0.92 -2.08 -1.12 3.41 -1.26 -4.89 113.62 107.11 3fk4 n SER 14 Ca 0.07 -0.72 -0.20 0.00 -0.26 0.00 0.00 58.87 57.76 3fk4 n SER 14 Cb 0.34 0.36 -0.04 0.00 -0.26 0.00 0.00 64.21 64.61 3fk4 n SER 14 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3fk4 n HIS 15 N -1.06 -0.64 -3.54 7.33 8.25 -1.21 -4.93 115.22 119.41 3fk4 n HIS 15 Ca 0.08 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.27 3fk4 n HIS 15 Cb 0.35 -3.69 -0.10 0.00 1.12 0.00 0.00 29.99 27.66 3fk4 n HIS 15 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3fk4 n ASN 16 N -1.72 0.84 -0.34 0.41 2.85 -1.26 -4.98 115.26 111.06 3fk4 n ASN 16 Ca -0.23 -2.70 0.08 0.00 -0.11 0.00 0.00 54.58 51.63 3fk4 n ASN 16 Cb 0.68 -0.63 0.25 0.00 1.24 0.00 0.00 39.78 41.32 3fk4 n ASN 16 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3fk4 h LEU 17 N 5.40 0.78 0.50 1.20 3.38 -1.94 -0.74 115.31 123.88 3fk4 h LEU 17 Ca 0.22 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 3fk4 h LEU 17 Cb 0.85 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 3fk4 h LEU 17 CO 0.50 0.37 -0.29 -0.33 0.09 0.00 0.00 178.44 178.78 3fk4 h GLU 18 N 0.83 -0.72 -0.10 1.13 4.39 -1.99 0.25 114.58 118.37 3fk4 h GLU 18 Ca 0.50 0.05 0.00 0.00 0.34 0.00 0.00 59.36 60.25 3fk4 h GLU 18 Cb 0.62 0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.43 3fk4 h GLU 18 CO -0.32 -0.48 0.07 -0.22 -1.16 0.00 0.00 179.01 176.90 3fk4 h LYS 19 N -0.75 0.13 -0.39 2.33 3.64 -1.88 -1.88 116.57 117.77 3fk4 h LYS 19 Ca -0.06 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.35 3fk4 h LYS 19 Cb 0.61 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 3fk4 h LYS 19 CO 0.07 0.09 0.17 -0.22 -2.27 0.00 0.00 179.45 177.29 3fk4 h LYS 20 N 0.14 0.34 -0.65 1.90 1.63 -1.11 -0.46 116.57 118.35 3fk4 h LYS 20 Ca 0.04 -0.02 0.09 0.00 -0.85 0.00 0.00 60.65 59.91 3fk4 h LYS 20 Cb -0.02 -0.08 -0.07 0.00 -0.60 0.00 0.00 32.23 31.47 3fk4 h LYS 20 CO -0.01 0.23 0.28 0.00 -3.45 0.00 0.00 179.45 176.50 3fk4 h ALA 21 N 1.22 0.87 -0.05 5.00 0.00 -0.68 -1.17 119.26 124.46 3fk4 h ALA 21 Ca 0.17 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 3fk4 h ALA 21 Cb 0.11 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3fk4 h ALA 21 CO -0.14 -0.13 -0.41 0.93 0.00 0.00 0.00 179.25 179.50 3fk4 h GLU 22 N 0.49 0.10 -0.22 0.00 4.39 -0.55 -1.41 114.58 117.37 3fk4 h GLU 22 Ca 0.32 -0.04 -0.15 0.00 0.34 0.00 0.00 59.36 59.83 3fk4 h GLU 22 Cb 0.37 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 3fk4 h GLU 22 CO -0.29 0.49 -0.49 1.96 -1.16 0.00 0.00 179.01 179.52 3fk4 h GLN 23 N 0.08 0.61 -0.15 2.33 4.20 0.00 -1.93 115.11 120.26 3fk4 h GLN 23 Ca 0.01 -0.36 -0.06 0.00 0.06 0.00 0.00 58.65 58.30 3fk4 h GLN 23 Cb 0.76 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.57 3fk4 h GLN 23 CO 0.06 0.97 -0.14 0.82 -0.67 0.00 0.00 178.83 179.87 3fk4 h ILE 24 N 0.48 1.34 -0.91 2.54 2.04 -1.06 0.40 117.51 122.34 3fk4 h ILE 24 Ca 0.02 -1.28 0.11 0.00 1.00 0.00 0.00 64.86 64.71 3fk4 h ILE 24 Cb 1.03 1.84 -0.07 0.00 -0.74 0.00 0.00 36.82 38.88 3fk4 h ILE 24 CO 0.10 0.38 0.58 0.00 0.00 0.00 0.00 178.15 179.21 3fk4 h ALA 25 N 0.62 1.65 0.03 1.87 0.00 -1.16 -1.01 119.26 121.27 3fk4 h ALA 25 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 3fk4 h ALA 25 Cb 0.66 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3fk4 h ALA 25 CO 0.03 0.14 -0.71 -0.07 0.00 0.00 0.00 179.25 178.65 3fk4 h LEU 26 N 0.87 0.11 -1.83 0.00 3.38 -1.26 -3.27 115.31 113.32 3fk4 h LEU 26 Ca 0.43 -0.82 0.10 0.00 0.09 0.00 0.00 57.88 57.68 3fk4 h LEU 26 Cb 0.48 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3fk4 h LEU 26 CO -0.20 1.30 0.32 1.23 0.09 0.00 0.00 178.44 181.18 3fk4 h GLY 27 N -0.75 0.27 -1.47 0.83 0.00 -0.01 0.35 103.07 102.30 3fk4 h GLY 27 Ca -0.17 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3fk4 h GLY 27 CO -0.04 0.05 0.00 1.04 0.00 0.00 0.00 176.54 177.59 3fk4 n LEU 28 N -4.45 2.43 0.00 3.11 4.77 -0.40 -4.60 117.00 117.86 3fk4 n LEU 28 Ca 0.07 -1.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 3fk4 n LEU 28 Cb 0.39 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3fk4 n LEU 28 CO 0.35 0.52 0.00 0.35 -1.33 0.00 0.00 177.39 177.28 3fk4 n THR 29 N 0.82 0.00 1.26 -5.08 -2.24 -0.52 -4.98 114.28 103.55 3fk4 n THR 29 Ca 0.17 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.09 3fk4 n THR 29 Cb 0.44 0.00 0.53 0.00 -2.10 0.00 0.00 70.33 69.20 3fk4 n THR 29 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 3fk4 n ILE 30 N 0.00 0.00 0.00 2.28 -5.35 -1.18 -5.04 119.36 110.07 3fk4 n ILE 30 Ca 0.00 -0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 3fk4 n ILE 30 Cb 0.00 -0.06 0.00 0.00 -1.74 0.00 0.00 39.64 37.84 3fk4 n ILE 30 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fk4 n GLY 31 N 1.36 1.27 0.30 3.28 0.00 0.11 -5.02 105.19 106.49 3fk4 n GLY 31 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 3fk4 n GLY 31 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3fk4 h GLU 42 N 0.00 -0.73 0.00 1.61 4.22 -2.08 -3.47 114.58 114.13 3fk4 h GLU 42 Ca 0.00 0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.49 3fk4 h GLU 42 Cb 0.00 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3fk4 h GLU 42 CO 0.00 -0.49 0.00 1.04 -2.18 0.00 0.00 179.01 177.38 3fk4 n GLN 43 N -4.27 0.29 -0.02 1.92 1.13 -1.26 -1.86 117.38 113.31 3fk4 n GLN 43 Ca -0.09 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.89 3fk4 n GLN 43 Cb 0.30 -1.50 -0.13 0.00 0.11 0.00 0.00 30.24 29.01 3fk4 n GLN 43 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 3fk4 n LEU 44 N -1.00 0.86 0.20 1.08 7.94 -1.26 -3.92 117.00 120.89 3fk4 n LEU 44 Ca 0.07 0.41 0.18 0.00 -1.11 0.00 0.00 56.01 55.56 3fk4 n LEU 44 Cb 0.03 0.16 0.83 0.00 0.53 0.00 0.00 43.42 44.97 3fk4 n LEU 44 CO 0.05 0.36 1.16 0.11 -1.11 0.00 0.00 177.39 177.96 3fk4 h LYS 45 N 0.00 0.00 0.00 1.96 1.57 -1.79 0.46 116.57 118.77 3fk4 h LYS 45 Ca -0.27 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 3fk4 h LYS 45 Cb 1.97 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.28 3fk4 h LYS 45 CO 0.07 0.00 -0.01 0.37 -0.57 0.00 0.00 179.45 179.31 3fk4 h GLN 46 N 0.00 0.00 -0.05 3.15 4.15 -1.75 -2.36 115.11 118.25 3fk4 h GLN 46 Ca 0.10 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3fk4 h GLN 46 Cb 0.63 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.32 3fk4 h GLN 46 CO -0.00 0.01 0.00 0.72 -1.93 0.00 0.00 178.83 177.63 3fk4 n HIS 47 N -3.19 0.07 -2.10 3.99 8.25 0.14 -4.87 115.22 117.51 3fk4 n HIS 47 Ca -0.02 -0.13 -0.41 0.00 -0.26 0.00 0.00 57.72 56.90 3fk4 n HIS 47 Cb 0.16 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 3fk4 n HIS 47 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 3fk4 s LYS 48 N -0.64 4.33 0.36 -0.41 2.20 -0.89 -4.34 119.74 120.35 3fk4 s LYS 48 Ca 0.09 2.21 -0.24 0.00 -0.36 0.00 0.00 55.97 57.67 3fk4 s LYS 48 Cb 0.06 -3.12 -0.10 0.00 -1.51 0.00 0.00 37.83 33.15 3fk4 s LYS 48 CO 0.08 -0.31 0.94 0.20 -0.36 0.00 0.00 175.35 175.90 3fk4 s GLY 49 N 0.12 2.63 -0.10 5.54 0.00 -1.23 -4.57 107.32 109.70 3fk4 s GLY 49 Ca 0.56 0.46 0.04 0.00 0.00 0.00 0.00 44.72 45.77 3fk4 s GLY 49 CO 0.44 0.83 -0.24 -1.31 0.00 0.00 0.00 173.10 172.83 3fk4 s ASN 50 N -1.85 3.07 -0.38 1.64 0.02 -0.35 -4.71 114.94 112.38 3fk4 s ASN 50 Ca 0.55 -0.56 -0.29 0.00 -1.02 0.00 0.00 52.86 51.54 3fk4 s ASN 50 Cb -0.15 -1.40 0.01 0.00 0.02 0.00 0.00 41.25 39.74 3fk4 s ASN 50 CO 0.19 0.16 1.25 -0.69 0.02 0.00 0.00 177.10 178.03 3fk4 s VAL 51 N 0.35 4.15 -0.03 1.60 1.01 -1.26 0.01 120.40 126.22 3fk4 s VAL 51 Ca -0.19 1.25 0.04 0.00 0.00 0.00 0.00 61.98 63.08 3fk4 s VAL 51 Cb -0.18 -4.33 -0.25 0.00 0.00 0.00 0.00 36.38 31.62 3fk4 s VAL 51 CO 0.09 -0.69 0.70 0.40 0.00 0.00 0.00 175.10 175.60 3fk4 h ILE 52 N 6.13 0.95 -1.81 2.22 1.08 -0.54 -3.48 117.51 122.05 3fk4 h ILE 52 Ca -0.25 -2.71 0.00 0.00 -0.39 0.00 0.00 64.86 61.52 3fk4 h ILE 52 Cb 1.08 2.56 -0.21 0.00 -3.07 0.00 0.00 36.82 37.18 3fk4 h ILE 52 CO 1.07 0.69 0.35 -2.28 -0.69 0.00 0.00 178.15 177.29 3fk4 s HIS 53 N -2.60 -0.53 -0.04 1.37 2.46 -1.05 -4.97 115.29 109.92 3fk4 s HIS 53 Ca -0.09 0.92 0.02 0.00 0.47 0.00 0.00 55.06 56.38 3fk4 s HIS 53 Cb 0.08 0.43 0.02 0.00 -0.13 0.00 0.00 32.58 32.97 3fk4 s HIS 53 CO 0.82 -0.49 -0.07 0.08 -2.47 0.00 0.00 174.74 172.61 3fk4 s VAL 54 N -1.13 0.71 -0.15 0.89 1.01 -1.26 -0.85 120.40 119.61 3fk4 s VAL 54 Ca -0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 3fk4 s VAL 54 Cb -0.00 -0.68 0.04 0.00 0.00 0.00 0.00 36.38 35.73 3fk4 s VAL 54 CO 0.06 0.25 -0.04 -0.70 0.00 0.00 0.00 175.10 174.68 3fk4 s GLU 55 N 0.71 1.26 0.34 2.72 2.56 0.60 -4.96 118.70 121.92 3fk4 s GLU 55 Ca -0.11 -0.41 -0.27 0.00 0.00 0.00 0.00 54.97 54.18 3fk4 s GLU 55 Cb -0.14 -1.86 -0.09 0.00 2.00 0.00 0.00 34.13 34.04 3fk4 s GLU 55 CO 0.01 -0.43 1.12 -1.21 -0.56 0.00 0.00 175.26 174.19 3fk4 s GLU 56 N 1.71 4.37 0.27 4.30 2.02 -1.26 -0.15 118.70 129.95 3fk4 s GLU 56 Ca 0.01 1.77 0.07 0.00 0.02 0.00 0.00 54.97 56.85 3fk4 s GLU 56 Cb -0.15 -2.91 -0.06 0.00 0.10 0.00 0.00 34.13 31.12 3fk4 s GLU 56 CO -0.07 -0.02 -0.08 -0.51 0.02 0.00 0.00 175.26 174.59 3fk4 s LEU 57 N -2.00 2.51 0.56 1.80 1.43 -0.53 -4.89 118.68 117.57 3fk4 s LEU 57 Ca 0.51 -1.15 -0.21 0.00 -1.03 0.00 0.00 54.13 52.25 3fk4 s LEU 57 Cb -0.30 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.19 3fk4 s LEU 57 CO 0.38 -0.28 1.35 0.00 0.23 0.00 0.00 176.35 178.03 3fk4 s ALA 58 N -2.95 2.75 0.35 4.21 0.00 -1.26 -4.45 121.76 120.41 3fk4 s ALA 58 Ca 0.28 1.31 -0.23 0.00 0.00 0.00 0.00 51.96 53.32 3fk4 s ALA 58 Cb 0.02 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.48 3fk4 s ALA 58 CO 0.11 -1.40 0.92 -2.00 0.00 0.00 0.00 175.76 173.39 3fk4 s GLU 59 N -2.98 4.42 -0.29 0.00 2.12 -1.26 -4.64 118.70 116.07 3fk4 s GLU 59 Ca 0.73 1.20 0.03 0.00 0.36 0.00 0.00 54.97 57.28 3fk4 s GLU 59 Cb -0.40 -2.59 0.08 0.00 0.26 0.00 0.00 34.13 31.48 3fk4 s GLU 59 CO 0.46 0.19 -0.03 -1.01 -0.54 0.00 0.00 175.26 174.33 3fk4 s HIS 60 N -1.80 3.16 0.35 5.30 3.76 -1.26 -4.99 115.29 119.81 3fk4 s HIS 60 Ca 0.53 -2.42 0.07 0.00 -0.15 0.00 0.00 55.06 53.10 3fk4 s HIS 60 Cb -0.15 -2.20 0.64 0.00 1.11 0.00 0.00 32.58 31.98 3fk4 s HIS 60 CO 0.20 -0.88 1.85 0.93 -0.85 0.00 0.00 174.74 175.99 3fk4 h GLU 61 N 7.77 0.35 -0.44 1.40 5.08 -1.97 -1.95 114.58 124.83 3fk4 h GLU 61 Ca -0.13 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.09 3fk4 h GLU 61 Cb 1.04 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 3fk4 h GLU 61 CO 0.47 0.50 0.07 0.45 -1.00 0.00 0.00 179.01 179.50 3fk4 h HIS 62 N 0.32 0.69 -0.13 4.33 3.86 -1.99 -0.17 115.15 122.06 3fk4 h HIS 62 Ca 0.06 -0.06 -0.23 0.00 -1.16 0.00 0.00 60.37 58.98 3fk4 h HIS 62 Cb 0.46 -0.20 0.01 0.00 1.06 0.00 0.00 27.41 28.74 3fk4 h HIS 62 CO 0.01 0.61 -0.82 1.15 0.86 0.00 0.00 177.93 179.75 3fk4 h THR 63 N 0.64 1.28 -0.83 2.45 2.02 -1.87 -1.06 112.91 115.55 3fk4 h THR 63 Ca 0.14 -2.01 0.05 0.00 0.77 0.00 0.00 66.41 65.35 3fk4 h THR 63 Cb 0.30 2.04 -0.05 0.00 -1.74 0.00 0.00 68.15 68.69 3fk4 h THR 63 CO 0.00 0.64 0.52 0.78 0.37 0.00 0.00 175.52 177.83 3fk4 h ASN 64 N 0.52 0.84 -0.27 4.18 2.35 -0.89 0.19 115.58 122.49 3fk4 h ASN 64 Ca -0.06 0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.65 3fk4 h ASN 64 Cb 1.45 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.64 3fk4 h ASN 64 CO 0.17 0.56 -0.01 0.28 -1.65 0.00 0.00 177.43 176.77 3fk4 h SER 65 N 0.98 0.49 -0.92 5.81 0.02 -0.93 0.12 113.55 119.11 3fk4 h SER 65 Ca 0.34 -0.32 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 3fk4 h SER 65 Cb 0.08 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.45 3fk4 h SER 65 CO -0.14 0.69 0.51 0.22 -1.14 0.00 0.00 176.83 176.97 3fk4 h TYR 66 N 0.27 1.25 -0.01 3.45 3.20 -0.49 -2.28 116.97 122.35 3fk4 h TYR 66 Ca 0.08 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3fk4 h TYR 66 Cb 0.45 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 38.31 3fk4 h TYR 66 CO 0.04 0.85 -0.04 1.28 -1.64 0.00 0.00 178.16 178.65 3fk4 n LEU 67 N -4.33 1.31 -3.98 2.82 4.77 0.61 -4.94 117.00 113.26 3fk4 n LEU 67 Ca 0.10 -0.42 -0.28 0.00 -0.03 0.00 0.00 56.01 55.38 3fk4 n LEU 67 Cb 0.09 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 3fk4 n LEU 67 CO 0.39 0.22 -0.15 0.54 -1.33 0.00 0.00 177.39 177.06 3fk4 n ARG 68 N -0.05 -3.64 -3.62 3.23 3.00 0.30 -4.93 116.66 110.94 3fk4 n ARG 68 Ca 0.18 0.44 -0.06 0.00 -0.01 0.00 0.00 57.85 58.40 3fk4 n ARG 68 Cb 0.34 -4.79 -0.05 0.00 0.00 0.00 0.00 32.46 27.95 3fk4 n ARG 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 3fk4 s LYS 69 N -6.58 0.28 -0.01 5.56 -2.85 -0.58 -5.04 119.74 110.52 3fk4 s LYS 69 Ca 0.21 0.12 -0.29 0.00 -1.00 0.00 0.00 55.97 55.01 3fk4 s LYS 69 Cb -0.11 0.13 -0.03 0.00 -2.06 0.00 0.00 37.83 35.76 3fk4 s LYS 69 CO 0.88 -0.08 0.93 0.15 0.10 0.00 0.00 175.35 177.33 3fk4 s LYS 70 N -0.80 4.54 0.00 1.78 1.02 -1.26 -4.31 119.74 120.71 3fk4 s LYS 70 Ca 0.05 1.32 0.05 0.00 0.02 0.00 0.00 55.97 57.41 3fk4 s LYS 70 Cb -0.02 -3.46 -0.01 0.00 -0.52 0.00 0.00 37.83 33.82 3fk4 s LYS 70 CO -0.06 -0.03 -0.15 0.14 -0.92 0.00 0.00 175.35 174.33 3fk4 s VAL 71 N 0.96 1.22 -0.26 3.17 -7.23 -1.26 -4.56 120.40 112.44 3fk4 s VAL 71 Ca 0.49 -0.75 -0.13 0.00 -1.81 0.00 0.00 61.98 59.78 3fk4 s VAL 71 Cb -0.20 -1.04 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 3fk4 s VAL 71 CO 0.26 0.28 0.28 -0.75 -0.31 0.00 0.00 175.10 174.86 3fk4 s LYS 72 N -0.54 4.02 0.23 4.82 2.20 0.19 -4.75 119.74 125.91 3fk4 s LYS 72 Ca 0.05 -0.11 -0.16 0.00 -0.36 0.00 0.00 55.97 55.39 3fk4 s LYS 72 Cb -0.06 -3.63 -0.08 0.00 -1.51 0.00 0.00 37.83 32.55 3fk4 s LYS 72 CO -0.00 -0.17 0.66 1.03 -0.36 0.00 0.00 175.35 176.52 3fk4 s ARG 73 N 1.72 4.05 -0.08 4.03 0.52 -1.26 -0.59 118.95 127.34 3fk4 s ARG 73 Ca 0.12 0.64 -0.32 0.00 -0.52 0.00 0.00 55.73 55.64 3fk4 s ARG 73 Cb -0.15 -2.73 0.13 0.00 0.52 0.00 0.00 34.95 32.71 3fk4 s ARG 73 CO 0.09 0.34 1.25 0.20 0.02 0.00 0.00 175.30 177.20 3fk4 s GLY 74 N -1.94 -0.36 -0.13 -3.53 0.00 -0.87 -1.46 107.32 99.03 3fk4 s GLY 74 Ca 0.46 1.05 0.01 0.00 0.00 0.00 0.00 44.72 46.24 3fk4 s GLY 74 CO 0.20 0.29 -0.15 -0.42 0.00 0.00 0.00 173.10 173.01 3fk4 s ILE 75 N -2.43 2.80 -0.09 0.90 1.01 0.78 -1.22 121.20 122.95 3fk4 s ILE 75 Ca 0.12 -0.75 0.03 0.00 0.00 0.00 0.00 60.65 60.06 3fk4 s ILE 75 Cb 0.02 -2.16 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 3fk4 s ILE 75 CO -0.04 0.53 -0.19 -0.63 0.00 0.00 0.00 174.94 174.60 3fk4 s ILE 76 N 0.45 2.54 -0.19 2.92 1.01 -0.04 -0.29 121.20 127.60 3fk4 s ILE 76 Ca -0.11 -0.87 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 3fk4 s ILE 76 Cb -0.16 -2.00 0.01 0.00 0.01 0.00 0.00 42.46 40.32 3fk4 s ILE 76 CO 0.05 0.56 -0.14 -0.54 0.00 0.00 0.00 174.94 174.86 3fk4 s LYS 77 N -0.00 3.14 -0.04 2.79 1.02 -0.03 -0.08 119.74 126.53 3fk4 s LYS 77 Ca -0.06 -0.75 0.06 0.00 0.02 0.00 0.00 55.97 55.23 3fk4 s LYS 77 Cb -0.15 -2.72 -0.01 0.00 -0.52 0.00 0.00 37.83 34.44 3fk4 s LYS 77 CO 0.05 -0.17 -0.22 0.42 -0.92 0.00 0.00 175.35 174.50 3fk4 s ILE 78 N 1.28 1.80 -0.26 2.17 1.01 -0.46 0.27 121.20 127.00 3fk4 s ILE 78 Ca 0.04 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 3fk4 s ILE 78 Cb -0.14 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 3fk4 s ILE 78 CO -0.08 0.51 0.15 -0.70 0.00 0.00 0.00 174.94 174.81 3fk4 s GLU 79 N -0.17 3.90 -0.23 2.79 2.12 0.10 -0.78 118.70 126.43 3fk4 s GLU 79 Ca -0.01 -0.35 -0.08 0.00 0.36 0.00 0.00 54.97 54.89 3fk4 s GLU 79 Cb -0.12 -3.54 -0.03 0.00 0.26 0.00 0.00 34.13 30.70 3fk4 s GLU 79 CO 0.02 -0.12 0.08 0.71 -0.54 0.00 0.00 175.26 175.41 3fk4 s TYR 80 N 1.55 3.14 0.43 5.30 2.02 -0.01 -1.22 117.35 128.56 3fk4 s TYR 80 Ca 0.07 -0.23 -0.25 0.00 -0.37 0.00 0.00 57.07 56.29 3fk4 s TYR 80 Cb -0.15 -2.20 -0.10 0.00 -0.40 0.00 0.00 41.96 39.11 3fk4 s TYR 80 CO 0.08 -0.19 1.20 -2.30 -1.57 0.00 0.00 175.55 172.76 3fk4 n PRO 81 N 4.52 1.74 -0.05 -1.71 -0.02 -1.26 -1.94 135.00 136.28 3fk4 n PRO 81 Ca -0.16 0.62 0.11 0.00 -2.02 0.00 0.00 63.50 62.05 3fk4 n PRO 81 Cb 0.52 -2.29 0.50 0.00 -0.02 0.00 0.00 33.50 32.21 3fk4 n PRO 81 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3fk4 h LEU 82 N 1.88 0.36 -0.08 2.45 7.12 -1.93 -0.88 115.31 124.23 3fk4 h LEU 82 Ca -0.47 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.55 3fk4 h LEU 82 Cb 1.31 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 41.36 3fk4 h LEU 82 CO 0.59 0.23 0.00 0.18 -0.13 0.00 0.00 178.44 179.31 3fk4 n LEU 83 N -4.47 0.06 -0.19 2.25 4.32 -1.26 -2.96 117.00 114.74 3fk4 n LEU 83 Ca 0.08 0.52 0.14 0.00 -0.02 0.00 0.00 56.01 56.72 3fk4 n LEU 83 Cb 0.31 -0.51 0.49 0.00 -1.62 0.00 0.00 43.42 42.08 3fk4 n LEU 83 CO 0.34 -0.37 0.76 0.59 -1.22 0.00 0.00 177.39 177.49 3fk4 n ASN 84 N -1.57 0.78 -3.51 -1.43 4.13 -0.34 -4.95 115.26 108.38 3fk4 n ASN 84 Ca 0.02 -0.76 -0.15 0.00 1.68 0.00 0.00 54.58 55.38 3fk4 n ASN 84 Cb 0.12 0.04 -0.05 0.00 -1.54 0.00 0.00 39.78 38.35 3fk4 n ASN 84 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3fk4 s PHE 85 N -2.48 -0.53 0.40 3.10 -0.12 -1.16 -5.05 117.98 112.14 3fk4 s PHE 85 Ca 0.27 0.65 -0.25 0.00 -0.05 0.00 0.00 56.93 57.55 3fk4 s PHE 85 Cb 0.20 0.42 -0.09 0.00 -0.63 0.00 0.00 43.02 42.92 3fk4 s PHE 85 CO 0.49 -0.69 1.12 -1.54 -0.05 0.00 0.00 175.22 174.55 3fk4 s SER 86 N -1.93 6.61 -1.22 1.98 1.04 -1.26 -4.91 113.70 114.02 3fk4 s SER 86 Ca -0.05 2.21 -0.10 0.00 0.48 0.00 0.00 55.95 58.49 3fk4 s SER 86 Cb -0.01 -2.60 -0.07 0.00 0.10 0.00 0.00 66.02 63.45 3fk4 s SER 86 CO -0.01 -0.60 2.42 -0.81 0.98 0.00 0.00 173.24 175.22 3fk4 n PRO 87 N 0.01 2.70 -4.02 4.02 -0.04 -1.26 -4.39 135.00 132.02 3fk4 n PRO 87 Ca 0.05 -1.88 -0.09 0.00 -0.04 0.00 0.00 63.50 61.54 3fk4 n PRO 87 Cb 0.48 -2.71 -0.09 0.00 -0.04 0.00 0.00 33.50 31.14 3fk4 n PRO 87 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 3fk4 s ASP 88 N 3.09 0.27 0.27 3.54 1.47 -1.26 -4.89 116.67 119.16 3fk4 s ASP 88 Ca 0.53 -0.94 -0.03 0.00 1.18 0.00 0.00 52.55 53.29 3fk4 s ASP 88 Cb 0.14 0.30 0.36 0.00 -0.34 0.00 0.00 42.92 43.38 3fk4 s ASP 88 CO -0.03 -0.72 1.84 -0.07 0.68 0.00 0.00 175.17 176.87 3fk4 h LEU 89 N 2.87 0.86 -0.68 2.11 3.38 -1.96 -1.11 115.31 120.78 3fk4 h LEU 89 Ca -0.34 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 3fk4 h LEU 89 Cb 1.19 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 3fk4 h LEU 89 CO 0.59 0.79 0.30 -0.65 0.09 0.00 0.00 178.44 179.56 3fk4 h PRO 90 N 0.91 1.00 -0.38 1.13 0.11 -1.98 0.57 132.00 133.37 3fk4 h PRO 90 Ca 0.21 -0.17 -0.13 0.00 0.11 0.00 0.00 66.00 66.03 3fk4 h PRO 90 Cb 0.22 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 3fk4 h PRO 90 CO -0.01 0.81 -0.26 0.00 -0.21 0.00 0.00 178.00 178.33 3fk4 h ALA 91 N 1.13 0.54 -0.35 -0.75 0.00 -1.80 -1.47 119.26 116.56 3fk4 h ALA 91 Ca 0.23 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3fk4 h ALA 91 Cb 0.17 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3fk4 h ALA 91 CO -0.02 0.55 0.14 0.82 0.00 0.00 0.00 179.25 180.74 3fk4 h ILE 92 N 0.64 1.19 -0.47 0.00 2.04 -1.00 0.08 117.51 119.98 3fk4 h ILE 92 Ca 0.07 -0.56 -0.10 0.00 1.00 0.00 0.00 64.86 65.27 3fk4 h ILE 92 Cb 0.83 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 3fk4 h ILE 92 CO 0.07 0.20 -0.09 -0.07 0.00 0.00 0.00 178.15 178.26 3fk4 h LEU 93 N 0.42 0.84 -0.38 1.44 3.38 -0.88 -0.89 115.31 119.24 3fk4 h LEU 93 Ca 0.12 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 3fk4 h LEU 93 Cb 0.18 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3fk4 h LEU 93 CO -0.01 0.96 0.08 0.74 0.09 0.00 0.00 178.44 180.30 3fk4 h THR 94 N 0.77 1.23 -0.19 0.22 2.02 -1.04 0.18 112.91 116.11 3fk4 h THR 94 Ca 0.13 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.46 3fk4 h THR 94 Cb 0.60 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 3fk4 h THR 94 CO 0.04 0.28 -0.05 0.74 0.37 0.00 0.00 175.52 176.90 3fk4 h THR 95 N 0.47 1.29 0.00 3.16 2.02 -0.84 -0.41 112.91 118.59 3fk4 h THR 95 Ca 0.12 -1.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.26 3fk4 h THR 95 Cb 0.34 1.58 -0.00 0.00 -1.74 0.00 0.00 68.15 68.33 3fk4 h THR 95 CO 0.00 0.31 -0.44 0.71 0.37 0.00 0.00 175.52 176.47 3fk4 h THR 96 N 0.07 0.05 0.00 3.16 1.35 -1.17 -3.41 112.91 112.97 3fk4 h THR 96 Ca 0.05 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 3fk4 h THR 96 Cb 0.49 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3fk4 h THR 96 CO 0.02 0.03 0.00 0.33 -0.25 0.00 0.00 175.52 175.65 3fk4 n PHE 97 N -2.94 0.00 0.26 4.73 7.35 0.60 -4.80 117.46 122.66 3fk4 n PHE 97 Ca 0.02 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.55 3fk4 n PHE 97 Cb 0.56 0.03 -0.08 0.00 0.35 0.00 0.00 39.48 40.33 3fk4 n PHE 97 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 3fk4 h GLY 98 N 0.00 -0.73 0.29 7.13 0.00 -0.63 -1.54 103.07 107.59 3fk4 h GLY 98 Ca 0.00 0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 3fk4 h GLY 98 CO 0.00 -0.27 -0.10 1.70 0.00 0.00 0.00 176.54 177.87 3fk4 h LYS 99 N -0.69 0.06 -0.15 4.80 1.63 -1.90 -3.31 116.57 117.02 3fk4 h LYS 99 Ca -0.05 -0.07 0.04 0.00 -0.85 0.00 0.00 60.65 59.72 3fk4 h LYS 99 Cb 0.57 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.22 3fk4 h LYS 99 CO 0.05 0.85 0.18 -0.07 -3.45 0.00 0.00 179.45 177.01 3fk4 h LEU 100 N -0.69 0.00 -2.34 5.20 4.07 -1.87 -1.43 115.31 118.24 3fk4 h LEU 100 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3fk4 h LEU 100 Cb 0.89 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.63 3fk4 h LEU 100 CO 0.02 0.00 0.00 0.77 -1.08 0.00 0.00 178.44 178.15 3fk4 h SER 101 N 0.00 0.00 -0.04 -0.43 4.64 -1.36 -2.18 113.55 114.18 3fk4 h SER 101 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3fk4 h SER 101 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3fk4 h SER 101 CO -0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 3fk4 n LEU 102 N -2.99 2.01 -0.40 5.97 4.77 -0.55 -4.70 117.00 121.11 3fk4 n LEU 102 Ca -0.02 -1.90 0.13 0.00 -0.03 0.00 0.00 56.01 54.20 3fk4 n LEU 102 Cb 0.14 -0.02 0.45 0.00 -2.33 0.00 0.00 43.42 41.65 3fk4 n LEU 102 CO 0.21 0.50 0.77 -0.67 -1.33 0.00 0.00 177.39 176.87 3fk4 n ASP 103 N -0.33 1.35 0.00 -1.43 -0.08 -0.82 -5.06 116.55 110.18 3fk4 n ASP 103 Ca 0.01 -1.26 0.00 0.00 -1.51 0.00 0.00 54.79 52.03 3fk4 n ASP 103 Cb 0.25 0.06 0.00 0.00 2.34 0.00 0.00 41.12 43.77 3fk4 n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3fk4 n GLY 104 N 1.25 0.33 3.57 0.27 0.00 -1.26 -4.94 105.19 104.41 3fk4 n GLY 104 Ca 0.16 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 3fk4 n GLY 104 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fk4 n GLU 105 N 0.00 2.17 -3.75 1.61 4.71 -1.26 -4.85 120.64 119.27 3fk4 n GLU 105 Ca 0.00 -2.75 -0.13 0.00 -0.01 0.00 0.00 57.16 54.27 3fk4 n GLU 105 Cb 0.00 -3.64 -0.13 0.00 -1.01 0.00 0.00 31.44 26.66 3fk4 n GLU 105 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3fk4 s VAL 106 N 8.58 -0.03 -0.03 2.62 0.11 -1.06 -1.73 120.40 128.86 3fk4 s VAL 106 Ca 0.63 0.12 0.03 0.00 -2.93 0.00 0.00 61.98 59.83 3fk4 s VAL 106 Cb 0.01 -0.33 -0.00 0.00 -1.53 0.00 0.00 36.38 34.53 3fk4 s VAL 106 CO 0.12 0.05 -0.13 -0.75 -3.33 0.00 0.00 175.10 171.06 3fk4 s LYS 107 N 0.97 1.26 -0.32 1.54 2.20 -0.45 -4.02 119.74 120.91 3fk4 s LYS 107 Ca -0.07 -0.44 -0.26 0.00 -0.36 0.00 0.00 55.97 54.83 3fk4 s LYS 107 Cb -0.08 -1.15 0.01 0.00 -1.51 0.00 0.00 37.83 35.10 3fk4 s LYS 107 CO -0.06 0.19 0.95 -1.17 -0.36 0.00 0.00 175.35 174.90 3fk4 s LEU 108 N 0.03 4.00 -0.22 5.43 2.96 -0.37 -0.88 118.68 129.65 3fk4 s LEU 108 Ca -0.01 0.84 0.06 0.00 -0.22 0.00 0.00 54.13 54.80 3fk4 s LEU 108 Cb -0.09 -3.33 -0.21 0.00 0.50 0.00 0.00 46.19 43.07 3fk4 s LEU 108 CO 0.01 -0.78 -0.03 -0.38 -1.32 0.00 0.00 176.35 173.85 3fk4 n ILE 109 N 5.76 1.50 -3.63 6.68 2.08 -0.03 -0.65 119.36 131.06 3fk4 n ILE 109 Ca 0.08 -0.67 -0.10 0.00 0.56 0.00 0.00 62.75 62.61 3fk4 n ILE 109 Cb 0.48 -1.16 -0.04 0.00 -0.75 0.00 0.00 39.64 38.17 3fk4 n ILE 109 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3fk4 s ASP 110 N -6.26 -0.31 -0.05 4.38 2.15 -1.09 -4.42 116.67 111.07 3fk4 s ASP 110 Ca -0.25 -0.32 -0.01 0.00 0.43 0.00 0.00 52.55 52.40 3fk4 s ASP 110 Cb 0.08 0.54 0.03 0.00 -0.30 0.00 0.00 42.92 43.27 3fk4 s ASP 110 CO 0.70 -0.96 0.03 -0.76 -0.17 0.00 0.00 175.17 174.01 3fk4 s LEU 111 N -2.82 0.48 -0.38 -1.34 1.43 -1.26 -0.64 118.68 114.15 3fk4 s LEU 111 Ca 0.05 0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 53.06 3fk4 s LEU 111 Cb 0.00 -0.24 0.04 0.00 0.03 0.00 0.00 46.19 46.02 3fk4 s LEU 111 CO -0.08 -0.20 0.21 -0.89 0.23 0.00 0.00 176.35 175.61 3fk4 s THR 112 N 1.87 4.45 0.03 5.49 2.01 0.65 -4.95 115.64 125.19 3fk4 s THR 112 Ca 0.02 -0.99 -0.24 0.00 0.31 0.00 0.00 61.69 60.78 3fk4 s THR 112 Cb -0.12 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 3fk4 s THR 112 CO -0.03 -0.29 0.75 -0.36 -0.69 0.00 0.00 174.62 173.99 3fk4 s PHE 113 N 1.52 3.72 0.82 4.92 0.40 -1.26 -1.34 117.98 126.76 3fk4 s PHE 113 Ca 0.02 1.43 -0.11 0.00 -0.60 0.00 0.00 56.93 57.67 3fk4 s PHE 113 Cb -0.20 -2.80 0.09 0.00 0.51 0.00 0.00 43.02 40.62 3fk4 s PHE 113 CO 0.06 0.27 1.09 -1.54 0.70 0.00 0.00 175.22 175.80 3fk4 s SER 114 N -0.02 4.10 0.44 1.36 1.04 -1.04 -4.78 113.70 114.80 3fk4 s SER 114 Ca 0.38 1.66 0.11 0.00 0.48 0.00 0.00 55.95 58.58 3fk4 s SER 114 Cb -0.20 -2.35 0.99 0.00 0.10 0.00 0.00 66.02 64.56 3fk4 s SER 114 CO 0.22 -2.27 2.04 0.44 0.98 0.00 0.00 173.24 174.66 3fk4 h ASP 115 N -1.29 0.20 -0.25 7.02 3.32 -1.97 -1.35 116.42 122.10 3fk4 h ASP 115 Ca -0.46 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.52 3fk4 h ASP 115 Cb 1.25 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 3fk4 h ASP 115 CO 0.53 0.22 -0.05 -0.08 -1.72 0.00 0.00 179.24 178.14 3fk4 h GLU 116 N 0.23 0.48 -0.50 3.56 4.57 -1.94 -3.12 114.58 117.85 3fk4 h GLU 116 Ca 0.06 -0.18 -0.09 0.00 -1.18 0.00 0.00 59.36 57.97 3fk4 h GLU 116 Cb 0.11 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 3fk4 h GLU 116 CO -0.00 0.69 -0.03 1.25 -1.18 0.00 0.00 179.01 179.73 3fk4 h LEU 117 N 0.23 0.84 -2.37 1.64 5.85 -1.67 -2.74 115.31 117.08 3fk4 h LEU 117 Ca 0.07 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3fk4 h LEU 117 Cb 0.51 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 3fk4 h LEU 117 CO 0.02 0.92 0.00 0.11 -0.34 0.00 0.00 178.44 179.16 3fk4 h LYS 118 N 0.79 0.00 0.00 1.25 1.57 -1.24 -1.66 116.57 117.28 3fk4 h LYS 118 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3fk4 h LYS 118 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3fk4 h LYS 118 CO 0.03 0.00 0.00 0.87 -0.57 0.00 0.00 179.45 179.78 3fk4 h LYS 119 N 0.00 0.00 -0.01 3.15 1.57 -1.42 -2.20 116.57 117.66 3fk4 h LYS 119 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fk4 h LYS 119 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3fk4 h LYS 119 CO -0.00 0.00 -0.04 0.72 -0.57 0.00 0.00 179.45 179.56 3fk4 n HIS 120 N -2.92 0.00 -4.38 -1.35 8.25 -0.62 -4.87 115.22 109.32 3fk4 n HIS 120 Ca -0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.14 3fk4 n HIS 120 Cb 0.10 -0.03 -0.11 0.00 1.12 0.00 0.00 29.99 31.08 3fk4 n HIS 120 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3fk4 s PHE 121 N -2.09 2.61 0.09 4.41 0.08 -0.83 -5.01 117.98 117.25 3fk4 s PHE 121 Ca 0.37 -0.22 -0.05 0.00 0.12 0.00 0.00 56.93 57.15 3fk4 s PHE 121 Cb 0.21 -1.41 -0.22 0.00 -0.57 0.00 0.00 43.02 41.03 3fk4 s PHE 121 CO 0.37 0.36 1.19 -1.00 -0.10 0.00 0.00 175.22 176.04 3fk4 h PRO 122 N 3.94 0.34 -1.12 0.24 0.13 -1.85 -3.50 132.00 130.18 3fk4 h PRO 122 Ca -0.49 -0.49 0.13 0.00 -0.87 0.00 0.00 66.00 64.28 3fk4 h PRO 122 Cb 1.16 0.17 -0.04 0.00 0.13 0.00 0.00 31.00 32.42 3fk4 h PRO 122 CO 0.48 1.20 -0.25 0.41 -0.23 0.00 0.00 178.00 179.61 3fk4 n GLY 123 N 1.34 -1.86 3.75 1.56 0.00 -0.54 -4.84 105.19 104.61 3fk4 n GLY 123 Ca -0.08 -1.39 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 3fk4 n GLY 123 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fk4 s PRO 124 N -1.96 3.09 0.08 1.61 0.02 -1.22 -4.08 135.00 132.53 3fk4 s PRO 124 Ca 0.00 2.21 -0.15 0.00 0.02 0.00 0.00 61.00 63.08 3fk4 s PRO 124 Cb 0.00 -2.22 -0.19 0.00 0.02 0.00 0.00 34.50 32.11 3fk4 s PRO 124 CO 0.00 -1.22 1.24 0.87 -0.33 0.00 0.00 177.00 177.56 3fk4 h LYS 125 N 1.37 0.69 0.00 5.54 1.57 -1.88 -3.41 116.57 120.46 3fk4 h LYS 125 Ca -0.51 -0.63 -0.40 0.00 -1.87 0.00 0.00 60.65 57.24 3fk4 h LYS 125 Cb 1.30 0.15 -0.06 0.00 0.08 0.00 0.00 32.23 33.70 3fk4 h LYS 125 CO 0.57 1.23 -2.35 1.19 -0.57 0.00 0.00 179.45 179.51 3fk4 n PHE 126 N -3.99 0.00 -2.47 -1.35 3.72 -1.26 -4.97 117.46 107.13 3fk4 n PHE 126 Ca -0.09 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.38 3fk4 n PHE 126 Cb 0.75 -0.87 -0.02 0.00 -0.94 0.00 0.00 39.48 38.40 3fk4 n PHE 126 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fk4 n GLY 127 N 1.55 -1.77 0.13 1.37 0.00 -1.26 -0.94 105.19 104.26 3fk4 n GLY 127 Ca -0.47 -1.25 -0.07 0.00 0.00 0.00 0.00 46.02 44.22 3fk4 n GLY 127 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3fk4 h ILE 128 N -0.46 0.90 -0.56 -0.61 2.04 -1.44 -1.17 117.51 116.20 3fk4 h ILE 128 Ca 0.01 -0.07 -0.08 0.00 1.00 0.00 0.00 64.86 65.73 3fk4 h ILE 128 Cb 0.45 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3fk4 h ILE 128 CO 0.00 0.03 0.03 0.44 0.00 0.00 0.00 178.15 178.66 3fk4 h ASP 129 N 0.19 0.91 -0.44 1.72 3.32 -1.87 -1.37 116.42 118.88 3fk4 h ASP 129 Ca 0.13 -0.23 -0.10 0.00 0.02 0.00 0.00 57.03 56.85 3fk4 h ASP 129 Cb 0.12 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3fk4 h ASP 129 CO -0.15 0.95 -0.08 1.23 -1.72 0.00 0.00 179.24 179.47 3fk4 h GLY 130 N 1.01 0.97 0.79 2.75 0.00 -0.76 -1.15 103.07 106.68 3fk4 h GLY 130 Ca 0.17 -0.73 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 3fk4 h GLY 130 CO 0.02 0.67 -0.10 -2.22 0.00 0.00 0.00 176.54 174.91 3fk4 h ILE 131 N 0.81 1.31 -0.90 2.60 1.08 -1.02 -0.75 117.51 120.64 3fk4 h ILE 131 Ca 0.14 -1.18 -0.00 0.00 -0.39 0.00 0.00 64.86 63.43 3fk4 h ILE 131 Cb 0.60 1.68 -0.04 0.00 -3.07 0.00 0.00 36.82 35.98 3fk4 h ILE 131 CO 0.04 0.35 0.56 0.03 -0.69 0.00 0.00 178.15 178.45 3fk4 h ARG 132 N 0.09 1.22 -0.52 2.37 3.08 -1.16 0.54 114.38 120.00 3fk4 h ARG 132 Ca 0.04 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 3fk4 h ARG 132 Cb 0.60 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 3fk4 h ARG 132 CO 0.03 0.84 -0.09 -0.91 -1.07 0.00 0.00 179.97 178.77 3fk4 h ASN 133 N 1.24 0.97 -0.43 7.04 -0.26 -1.15 1.28 115.58 124.26 3fk4 h ASN 133 Ca 0.33 -0.35 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 3fk4 h ASN 133 Cb -0.08 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 36.89 3fk4 h ASN 133 CO -0.06 1.09 0.29 0.25 -1.06 0.00 0.00 177.43 177.93 3fk4 h LEU 134 N 0.84 0.50 0.00 1.61 5.85 -0.57 -2.81 115.31 120.73 3fk4 h LEU 134 Ca 0.14 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 3fk4 h LEU 134 Cb 0.65 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 3fk4 h LEU 134 CO 0.04 0.37 -0.58 -0.07 -0.34 0.00 0.00 178.44 177.86 3fk4 h LEU 135 N 0.59 0.00 -1.15 2.25 3.38 -0.73 -3.48 115.31 116.16 3fk4 h LEU 135 Ca 0.16 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.86 3fk4 h LEU 135 Cb -0.06 0.00 0.11 0.00 0.09 0.00 0.00 40.66 40.79 3fk4 h LEU 135 CO -0.03 0.13 -0.50 0.00 0.09 0.00 0.00 178.44 178.12 3fk4 n GLN 136 N -2.94 -5.43 -3.92 1.13 1.13 0.43 -4.93 117.38 102.86 3fk4 n GLN 136 Ca 0.01 0.60 -0.31 0.00 -1.94 0.00 0.00 57.00 55.36 3fk4 n GLN 136 Cb 0.60 -4.92 -0.15 0.00 0.11 0.00 0.00 30.24 25.88 3fk4 n GLN 136 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3fk4 s VAL 137 N -3.24 1.68 -0.19 5.09 1.01 -0.84 -5.03 120.40 118.88 3fk4 s VAL 137 Ca 0.30 -1.78 0.22 0.00 0.00 0.00 0.00 61.98 60.72 3fk4 s VAL 137 Cb -0.13 -2.16 -0.08 0.00 0.00 0.00 0.00 36.38 34.01 3fk4 s VAL 137 CO 0.52 -0.49 0.91 1.41 0.00 0.00 0.00 175.10 177.45 3fk4 n HIS 138 N 4.53 0.81 0.01 5.22 8.25 -1.26 -4.61 115.22 128.17 3fk4 n HIS 138 Ca -0.02 0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.68 3fk4 n HIS 138 Cb 0.42 -0.91 0.00 0.00 1.12 0.00 0.00 29.99 30.63 3fk4 n HIS 138 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3fk4 n ASP 139 N -2.64 0.19 -4.74 0.41 2.03 -1.26 -5.10 116.55 105.44 3fk4 n ASP 139 Ca -0.02 0.04 -0.32 0.00 0.52 0.00 0.00 54.79 55.00 3fk4 n ASP 139 Cb 0.60 -0.05 0.09 0.00 -0.72 0.00 0.00 41.12 41.05 3fk4 n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fk4 s ARG 140 N -2.00 2.15 0.68 -0.67 1.70 -1.26 -4.72 118.95 114.83 3fk4 s ARG 140 Ca 0.00 1.46 -0.16 0.00 -0.47 0.00 0.00 55.73 56.55 3fk4 s ARG 140 Cb 0.00 -1.86 0.01 0.00 -0.57 0.00 0.00 34.95 32.53 3fk4 s ARG 140 CO 0.00 -1.77 1.21 -2.14 -1.08 0.00 0.00 175.30 171.52 3fk4 s PRO 141 N -4.37 2.43 0.55 3.89 0.02 -1.18 -4.90 135.00 131.43 3fk4 s PRO 141 Ca 0.67 1.78 -0.05 0.00 0.02 0.00 0.00 61.00 63.42 3fk4 s PRO 141 Cb -0.22 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 3fk4 s PRO 141 CO 0.49 -1.62 0.85 -0.51 -0.33 0.00 0.00 177.00 175.89 3fk4 s LEU 142 N -4.79 3.39 -0.08 -5.54 1.43 -0.42 -4.88 118.68 107.78 3fk4 s LEU 142 Ca 0.75 0.77 0.03 0.00 -1.03 0.00 0.00 54.13 54.65 3fk4 s LEU 142 Cb -0.30 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.29 3fk4 s LEU 142 CO 0.41 -0.88 -0.18 -0.22 0.23 0.00 0.00 176.35 175.72 3fk4 s LEU 143 N -4.88 1.86 0.09 1.79 2.96 -1.26 0.33 118.68 119.56 3fk4 s LEU 143 Ca 0.51 -0.43 0.05 0.00 -0.22 0.00 0.00 54.13 54.05 3fk4 s LEU 143 Cb -0.10 -1.11 -0.03 0.00 0.50 0.00 0.00 46.19 45.44 3fk4 s LEU 143 CO 0.45 0.09 -0.14 -0.32 -1.32 0.00 0.00 176.35 175.10 3fk4 s MET 144 N 0.53 0.90 0.31 1.98 -2.45 -0.02 -0.29 119.30 120.26 3fk4 s MET 144 Ca -0.16 -1.06 0.02 0.00 -1.25 0.00 0.00 55.69 53.24 3fk4 s MET 144 Cb -0.17 -0.87 -0.02 0.00 1.25 0.00 0.00 34.83 35.02 3fk4 s MET 144 CO 0.06 0.18 0.31 -1.54 1.05 0.00 0.00 175.02 175.08 3fk4 s SER 145 N -2.01 1.10 0.04 1.11 1.04 -0.62 0.11 113.70 114.48 3fk4 s SER 145 Ca 0.02 -1.58 0.03 0.00 0.48 0.00 0.00 55.95 54.90 3fk4 s SER 145 Cb -0.08 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.57 3fk4 s SER 145 CO 0.02 -1.09 -0.08 -0.63 0.98 0.00 0.00 173.24 172.44 3fk4 s ILE 146 N -3.50 0.60 0.61 -1.02 1.01 -0.11 -1.92 121.20 116.87 3fk4 s ILE 146 Ca 0.37 -0.96 -0.19 0.00 0.00 0.00 0.00 60.65 59.88 3fk4 s ILE 146 Cb 0.02 -0.63 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 3fk4 s ILE 146 CO 0.22 -0.27 1.25 -0.36 0.00 0.00 0.00 174.94 175.78 3fk4 s PHE 147 N -1.14 2.29 -0.12 3.97 0.08 -1.16 -4.21 117.98 117.69 3fk4 s PHE 147 Ca -0.07 1.50 0.01 0.00 0.12 0.00 0.00 56.93 58.49 3fk4 s PHE 147 Cb -0.09 -3.57 0.02 0.00 -0.57 0.00 0.00 43.02 38.81 3fk4 s PHE 147 CO 0.01 -2.49 -0.14 0.21 -0.10 0.00 0.00 175.22 172.70 3fk4 s LYS 148 N -3.31 2.19 -0.45 0.44 2.20 -1.26 -4.61 119.74 114.95 3fk4 s LYS 148 Ca 0.79 -0.54 -0.03 0.00 -0.36 0.00 0.00 55.97 55.83 3fk4 s LYS 148 Cb -0.33 -1.93 0.00 0.00 -1.51 0.00 0.00 37.83 34.06 3fk4 s LYS 148 CO 0.36 -0.13 0.39 0.41 -0.36 0.00 0.00 175.35 176.03 3fk4 n GLY 149 N 4.41 0.45 0.21 5.54 0.00 -1.26 -4.98 105.19 109.56 3fk4 n GLY 149 Ca -0.18 -0.37 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 3fk4 n GLY 149 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3fk4 h MET 150 N -0.89 0.46 -6.54 1.61 2.86 -1.96 -3.42 114.93 107.05 3fk4 h MET 150 Ca -0.19 -0.26 -0.55 0.00 -2.06 0.00 0.00 59.70 56.65 3fk4 h MET 150 Cb 1.12 0.02 0.05 0.00 0.06 0.00 0.00 31.60 32.85 3fk4 h MET 150 CO 0.18 0.84 0.99 -0.89 1.06 0.00 0.00 176.91 179.09 3fk4 n ILE 151 N -3.98 0.16 -0.16 -1.22 2.08 -1.26 -1.41 119.36 113.56 3fk4 n ILE 151 Ca -0.02 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.26 3fk4 n ILE 151 Cb 0.55 -1.89 0.00 0.00 -0.75 0.00 0.00 39.64 37.54 3fk4 n ILE 151 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3fk4 n GLY 152 N 3.93 2.15 3.95 7.39 0.00 -1.26 -5.03 105.19 116.32 3fk4 n GLY 152 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 3fk4 n GLY 152 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fk4 s ARG 153 N -0.18 3.44 0.65 1.61 1.81 -0.50 -5.11 118.95 120.66 3fk4 s ARG 153 Ca 0.00 -0.65 -0.05 0.00 -1.72 0.00 0.00 55.73 53.32 3fk4 s ARG 153 Cb 0.00 -2.94 0.14 0.00 -0.45 0.00 0.00 34.95 31.70 3fk4 s ARG 153 CO 0.00 0.49 0.89 0.27 -0.68 0.00 0.00 175.30 176.27 3fk4 n ASN 154 N -0.80 0.75 -0.06 0.23 6.94 -1.26 -4.62 115.26 116.43 3fk4 n ASN 154 Ca -0.08 -1.74 -0.00 0.00 -0.02 0.00 0.00 54.58 52.75 3fk4 n ASN 154 Cb 0.55 -0.62 0.28 0.00 -2.36 0.00 0.00 39.78 37.63 3fk4 n ASN 154 CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 3fk4 h ILE 155 N -0.92 1.19 -0.61 1.53 6.09 -1.99 -2.26 117.51 120.54 3fk4 h ILE 155 Ca -0.29 -0.66 -0.02 0.00 -1.37 0.00 0.00 64.86 62.52 3fk4 h ILE 155 Cb 0.97 0.72 -0.03 0.00 0.47 0.00 0.00 36.82 38.95 3fk4 h ILE 155 CO 0.27 0.24 0.31 1.23 -3.07 0.00 0.00 178.15 177.13 3fk4 h GLY 156 N 0.84 0.91 0.92 8.18 0.00 -1.95 0.04 103.07 112.01 3fk4 h GLY 156 Ca 0.15 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 47.02 3fk4 h GLY 156 CO -0.01 0.39 0.04 -1.82 0.00 0.00 0.00 176.54 175.14 3fk4 h TYR 157 N 0.85 0.66 -0.07 5.60 3.20 -1.79 -2.14 116.97 123.28 3fk4 h TYR 157 Ca 0.21 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 3fk4 h TYR 157 Cb 0.06 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 3fk4 h TYR 157 CO 0.01 0.69 0.04 1.25 -1.64 0.00 0.00 178.16 178.50 3fk4 h LEU 158 N 0.44 0.09 -0.93 2.82 6.46 -1.09 -2.18 115.31 120.92 3fk4 h LEU 158 Ca 0.11 -0.05 0.08 0.00 -0.12 0.00 0.00 57.88 57.89 3fk4 h LEU 158 Cb 0.40 -0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.24 3fk4 h LEU 158 CO 0.01 0.11 0.58 0.11 -0.62 0.00 0.00 178.44 178.63 3fk4 h LYS 159 N 0.05 1.00 -0.29 1.25 1.57 -0.90 0.47 116.57 119.72 3fk4 h LYS 159 Ca 0.03 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 3fk4 h LYS 159 Cb 0.04 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 3fk4 h LYS 159 CO -0.00 0.66 -0.08 1.15 -0.57 0.00 0.00 179.45 180.60 3fk4 h THR 160 N 1.03 1.28 -0.67 -0.16 2.02 -1.24 -0.73 112.91 114.44 3fk4 h THR 160 Ca 0.42 -1.13 -0.07 0.00 0.77 0.00 0.00 66.41 66.40 3fk4 h THR 160 Cb 0.24 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 3fk4 h THR 160 CO -0.20 0.36 0.14 1.56 0.37 0.00 0.00 175.52 177.75 3fk4 h GLN 161 N 0.34 1.10 -0.35 6.66 4.20 -0.94 -1.91 115.11 124.21 3fk4 h GLN 161 Ca 0.07 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.49 3fk4 h GLN 161 Cb 0.57 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 3fk4 h GLN 161 CO 0.03 0.99 0.17 1.25 -0.67 0.00 0.00 178.83 180.60 3fk4 h LEU 162 N 1.03 0.45 -0.42 1.46 5.85 -0.83 -1.74 115.31 121.12 3fk4 h LEU 162 Ca 0.21 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.83 3fk4 h LEU 162 Cb 0.41 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3fk4 h LEU 162 CO 0.01 0.45 0.23 -0.09 -0.34 0.00 0.00 178.44 178.70 3fk4 h ARG 163 N 0.43 0.45 -0.78 1.25 2.43 -0.92 -1.47 114.38 115.78 3fk4 h ARG 163 Ca 0.12 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3fk4 h ARG 163 Cb 0.11 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.53 3fk4 h ARG 163 CO -0.02 0.30 0.36 -0.44 -1.51 0.00 0.00 179.97 178.66 3fk4 h ASP 164 N 0.47 1.04 -0.55 -3.80 3.32 -1.17 0.23 116.42 115.96 3fk4 h ASP 164 Ca 0.17 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 3fk4 h ASP 164 Cb 0.04 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 3fk4 h ASP 164 CO -0.09 0.89 0.01 1.56 -1.72 0.00 0.00 179.24 179.89 3fk4 h GLN 165 N 1.11 0.96 -0.17 3.56 4.20 -1.03 -0.02 115.11 123.72 3fk4 h GLN 165 Ca 0.27 -0.30 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 3fk4 h GLN 165 Cb 0.15 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3fk4 h GLN 165 CO -0.03 0.97 -0.01 0.00 -0.67 0.00 0.00 178.83 179.08 3fk4 h ALA 166 N 0.96 0.23 -0.34 3.87 0.00 -1.04 -2.29 119.26 120.65 3fk4 h ALA 166 Ca 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3fk4 h ALA 166 Cb 0.53 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3fk4 h ALA 166 CO 0.03 -0.05 0.21 0.82 0.00 0.00 0.00 179.25 180.26 3fk4 h ILE 167 N 0.04 1.10 0.00 0.00 2.04 -0.88 0.38 117.51 120.18 3fk4 h ILE 167 Ca 0.05 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3fk4 h ILE 167 Cb 0.41 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 3fk4 h ILE 167 CO 0.01 0.10 0.00 0.61 0.00 0.00 0.00 178.15 178.87 3fk4 n GLY 168 N -1.43 -1.04 0.00 5.37 0.00 -0.03 -4.87 105.19 103.19 3fk4 n GLY 168 Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3fk4 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fk4 n GLY 169 N -0.52 0.90 3.76 -0.02 0.00 0.12 -2.18 105.19 107.26 3fk4 n GLY 169 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3fk4 n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fk4 s VAL 170 N -2.00 2.82 -0.01 1.61 1.01 -0.95 -4.90 120.40 117.99 3fk4 s VAL 170 Ca 0.00 0.80 0.03 0.00 0.00 0.00 0.00 61.98 62.81 3fk4 s VAL 170 Cb 0.00 -3.51 -0.25 0.00 0.00 0.00 0.00 36.38 32.62 3fk4 s VAL 170 CO 0.00 0.18 0.81 0.44 0.00 0.00 0.00 175.10 176.53 3fk4 h ASP 171 N 3.70 0.21 -3.52 3.32 3.32 -0.97 -3.42 116.42 119.07 3fk4 h ASP 171 Ca -0.48 -0.33 -0.30 0.00 0.02 0.00 0.00 57.03 55.94 3fk4 h ASP 171 Cb 1.22 -0.07 -0.34 0.00 0.22 0.00 0.00 39.33 40.37 3fk4 h ASP 171 CO 0.67 1.28 -0.73 -0.63 -1.72 0.00 0.00 179.24 178.12 3fk4 s ILE 172 N -2.62 -0.06 -0.11 0.35 1.01 -0.83 -0.70 121.20 118.24 3fk4 s ILE 172 Ca -0.07 0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.80 3fk4 s ILE 172 Cb 0.08 -0.09 -0.02 0.00 0.01 0.00 0.00 42.46 42.44 3fk4 s ILE 172 CO 0.83 0.09 -0.12 -0.69 0.00 0.00 0.00 174.94 175.05 3fk4 s VAL 173 N 1.08 3.22 0.15 2.92 1.01 -0.15 -1.59 120.40 127.05 3fk4 s VAL 173 Ca -0.09 -0.62 0.10 0.00 0.00 0.00 0.00 61.98 61.37 3fk4 s VAL 173 Cb -0.13 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3fk4 s VAL 173 CO -0.03 0.55 -0.21 -1.59 0.00 0.00 0.00 175.10 173.81 3fk4 s LYS 174 N -0.04 1.64 0.82 2.72 -2.85 -0.81 -0.38 119.74 120.84 3fk4 s LYS 174 Ca -0.02 -1.35 -0.12 0.00 -1.00 0.00 0.00 55.97 53.48 3fk4 s LYS 174 Cb -0.14 -1.98 0.09 0.00 -2.06 0.00 0.00 37.83 33.74 3fk4 s LYS 174 CO 0.04 0.44 1.17 -0.51 0.10 0.00 0.00 175.35 176.59 3fk4 s ASP 175 N -2.40 3.60 0.33 0.03 1.01 -0.71 -2.98 116.67 115.56 3fk4 s ASP 175 Ca 0.19 2.24 -0.29 0.00 0.71 0.00 0.00 52.55 55.41 3fk4 s ASP 175 Cb -0.09 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.16 3fk4 s ASP 175 CO 0.10 -2.65 1.35 -0.62 0.21 0.00 0.00 175.17 173.55 3fk4 s ASP 176 N -2.44 6.69 0.41 0.27 3.68 -1.26 -4.79 116.67 119.22 3fk4 s ASP 176 Ca 0.70 2.75 0.18 0.00 2.13 0.00 0.00 52.55 58.31 3fk4 s ASP 176 Cb -0.25 -2.65 1.09 0.00 -1.45 0.00 0.00 42.92 39.66 3fk4 s ASP 176 CO 0.52 -0.61 1.81 -0.08 0.13 0.00 0.00 175.17 176.94 3fk4 h GLU 177 N 3.42 0.39 -0.65 4.34 4.57 -1.93 -2.18 114.58 122.54 3fk4 h GLU 177 Ca -0.49 -0.02 -0.16 0.00 -1.18 0.00 0.00 59.36 57.51 3fk4 h GLU 177 Cb 1.23 -0.09 -0.10 0.00 -0.16 0.00 0.00 28.75 29.63 3fk4 h GLU 177 CO 0.66 0.26 0.18 0.44 -1.18 0.00 0.00 179.01 179.38 3fk4 n ILE 178 N -4.57 2.83 -2.90 2.32 -5.35 -1.26 -4.92 119.36 105.52 3fk4 n ILE 178 Ca 0.23 -1.69 -0.43 0.00 -0.27 0.00 0.00 62.75 60.59 3fk4 n ILE 178 Cb 0.80 -0.33 -0.05 0.00 -1.74 0.00 0.00 39.64 38.32 3fk4 n ILE 178 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 3fk4 s LEU 179 N -2.96 4.11 0.44 7.28 2.96 -0.82 -5.03 118.68 124.65 3fk4 s LEU 179 Ca 0.53 0.21 0.07 0.00 -0.22 0.00 0.00 54.13 54.73 3fk4 s LEU 179 Cb 0.43 -3.09 -0.02 0.00 0.50 0.00 0.00 46.19 44.01 3fk4 s LEU 179 CO 0.13 -0.88 0.35 -0.36 -1.32 0.00 0.00 176.35 174.27 3fk4 s PHE 180 N 3.38 2.50 0.20 5.38 0.08 -1.26 -4.89 117.98 123.36 3fk4 s PHE 180 Ca 0.33 -0.57 -0.33 0.00 0.12 0.00 0.00 56.93 56.49 3fk4 s PHE 180 Cb -0.12 -2.09 -0.14 0.00 -0.57 0.00 0.00 43.02 40.10 3fk4 s PHE 180 CO 0.21 -0.13 1.52 -1.91 -0.10 0.00 0.00 175.22 174.81 3fk4 n GLU 181 N -1.53 2.13 -3.92 0.44 4.07 -1.26 -4.94 120.64 115.64 3fk4 n GLU 181 Ca 0.02 0.77 -0.09 0.00 -0.06 0.00 0.00 57.16 57.80 3fk4 n GLU 181 Cb 0.63 -2.49 -0.05 0.00 -0.06 0.00 0.00 31.44 29.46 3fk4 n GLU 181 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3fk4 s ASN 182 N 0.66 -0.13 0.44 4.31 4.22 -1.26 -5.04 114.94 118.15 3fk4 s ASN 182 Ca 0.74 -0.79 0.22 0.00 -2.14 0.00 0.00 52.86 50.89 3fk4 s ASN 182 Cb -0.66 0.57 1.00 0.00 1.28 0.00 0.00 41.25 43.44 3fk4 s ASN 182 CO 0.43 -1.10 1.88 0.00 -2.04 0.00 0.00 177.10 176.27 3fk4 h ALA 183 N 2.26 1.17 0.04 3.54 0.00 -2.01 -2.91 119.26 121.36 3fk4 h ALA 183 Ca -0.27 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.24 3fk4 h ALA 183 Cb 1.25 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3fk4 h ALA 183 CO 0.37 0.32 -0.84 -0.07 0.00 0.00 0.00 179.25 179.03 3fk4 h LEU 184 N 0.00 0.14 -5.68 0.00 3.38 -1.97 -3.41 115.31 107.77 3fk4 h LEU 184 Ca -0.00 -0.80 -0.57 0.00 0.09 0.00 0.00 57.88 56.59 3fk4 h LEU 184 Cb 0.63 -0.05 -0.41 0.00 0.09 0.00 0.00 40.66 40.92 3fk4 h LEU 184 CO 0.03 1.35 -0.77 0.35 0.09 0.00 0.00 178.44 179.49 3fk4 n THR 185 N -4.33 2.01 -1.62 0.22 -2.24 -1.25 -4.22 114.28 102.86 3fk4 n THR 185 Ca -0.21 -5.20 -0.33 0.00 -2.27 0.00 0.00 64.05 56.04 3fk4 n THR 185 Cb 0.69 -1.38 0.07 0.00 -2.10 0.00 0.00 70.33 67.60 3fk4 n THR 185 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3fk4 s PRO 186 N -2.88 2.53 0.00 -0.78 0.04 -1.10 -4.55 135.00 128.26 3fk4 s PRO 186 Ca 0.44 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.00 3fk4 s PRO 186 Cb 0.26 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.89 3fk4 s PRO 186 CO -0.10 -1.48 0.72 -0.11 0.04 0.00 0.00 177.00 176.07 3fk4 n LEU 187 N -2.57 0.00 0.11 -3.56 0.00 -1.26 -1.05 117.00 108.67 3fk4 n LEU 187 Ca 0.11 0.72 0.08 0.00 0.00 0.00 0.00 56.01 56.93 3fk4 n LEU 187 Cb 0.51 -0.35 0.56 0.00 0.00 0.00 0.00 43.42 44.14 3fk4 n LEU 187 CO 0.48 -0.35 1.12 0.71 0.00 0.00 0.00 177.39 179.35 3fk4 h THR 188 N 0.00 1.00 -0.14 1.96 1.35 -1.94 -0.62 112.91 114.51 3fk4 h THR 188 Ca 0.00 -0.08 -0.11 0.00 -0.55 0.00 0.00 66.41 65.67 3fk4 h THR 188 Cb 0.00 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 3fk4 h THR 188 CO 0.00 0.04 -0.34 0.50 -0.25 0.00 0.00 175.52 175.47 3fk4 h LYS 189 N 0.23 0.48 -0.56 4.72 3.64 -1.68 -0.64 116.57 122.76 3fk4 h LYS 189 Ca 0.11 -0.33 0.04 0.00 -1.27 0.00 0.00 60.65 59.20 3fk4 h LYS 189 Cb 0.14 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 3fk4 h LYS 189 CO -0.02 0.94 0.31 0.00 -2.27 0.00 0.00 179.45 178.41 3fk4 h ARG 190 N 0.09 0.57 0.21 1.90 3.08 -0.33 0.01 114.38 119.93 3fk4 h ARG 190 Ca -0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3fk4 h ARG 190 Cb 0.95 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.87 3fk4 h ARG 190 CO 0.07 0.38 -0.10 0.82 -1.07 0.00 0.00 179.97 180.07 3fk4 h ILE 191 N 0.59 0.86 -0.08 2.04 2.04 -1.08 0.60 117.51 122.47 3fk4 h ILE 191 Ca 0.24 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.65 3fk4 h ILE 191 Cb 0.11 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 3fk4 h ILE 191 CO -0.14 0.10 0.05 0.58 0.00 0.00 0.00 178.15 178.74 3fk4 h VAL 192 N -0.51 1.03 -0.61 1.67 2.07 -0.98 0.12 116.25 119.04 3fk4 h VAL 192 Ca -0.03 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 3fk4 h VAL 192 Cb 0.39 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 3fk4 h VAL 192 CO 0.05 0.02 0.23 0.28 0.02 0.00 0.00 177.57 178.17 3fk4 h SER 193 N 0.11 0.85 -0.51 0.57 0.02 -1.03 -2.57 113.55 110.99 3fk4 h SER 193 Ca 0.03 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.75 3fk4 h SER 193 Cb -0.01 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 3fk4 h SER 193 CO -0.01 0.80 0.12 1.23 -1.14 0.00 0.00 176.83 177.84 3fk4 h GLY 194 N 0.85 0.88 0.77 -3.77 0.00 -0.61 -2.14 103.07 99.05 3fk4 h GLY 194 Ca 0.20 -0.55 0.05 0.00 0.00 0.00 0.00 47.33 47.02 3fk4 h GLY 194 CO -0.01 0.52 0.46 1.70 0.00 0.00 0.00 176.54 179.20 3fk4 h LYS 195 N 0.71 0.83 -0.54 4.80 3.64 -0.60 -1.45 116.57 123.98 3fk4 h LYS 195 Ca 0.16 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.40 3fk4 h LYS 195 Cb 0.33 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3fk4 h LYS 195 CO 0.00 0.55 -0.03 1.49 -2.27 0.00 0.00 179.45 179.20 3fk4 h GLU 196 N 0.86 0.94 0.01 1.90 4.57 -1.24 -0.90 114.58 120.72 3fk4 h GLU 196 Ca 0.32 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3fk4 h GLU 196 Cb 0.11 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 3fk4 h GLU 196 CO -0.15 0.95 -0.00 0.28 -1.18 0.00 0.00 179.01 178.90 3fk4 h VAL 197 N 0.86 1.07 -0.11 0.32 2.07 -0.79 -1.55 116.25 118.11 3fk4 h VAL 197 Ca 0.15 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 3fk4 h VAL 197 Cb 0.55 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3fk4 h VAL 197 CO 0.03 0.06 -0.33 -0.07 0.02 0.00 0.00 177.57 177.28 3fk4 h LEU 198 N -0.11 0.22 -0.36 2.57 3.38 -1.18 -0.93 115.31 118.89 3fk4 h LEU 198 Ca -0.00 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 3fk4 h LEU 198 Cb 0.11 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3fk4 h LEU 198 CO 0.00 0.54 -0.17 -0.61 0.09 0.00 0.00 178.44 178.29 3fk4 h GLN 199 N 0.19 0.76 -0.40 1.13 5.75 -1.06 -0.81 115.11 120.67 3fk4 h GLN 199 Ca 0.02 -0.33 -0.00 0.00 -0.15 0.00 0.00 58.65 58.19 3fk4 h GLN 199 Cb 0.68 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.19 3fk4 h GLN 199 CO 0.05 0.94 0.25 0.77 -2.65 0.00 0.00 178.83 178.19 3fk4 h SER 200 N 0.55 0.47 -0.47 -0.69 0.02 -0.87 0.71 113.55 113.27 3fk4 h SER 200 Ca 0.08 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 3fk4 h SER 200 Cb 0.71 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.11 3fk4 h SER 200 CO 0.05 0.38 0.16 0.58 -1.14 0.00 0.00 176.83 176.86 3fk4 h VAL 201 N 0.53 1.21 -0.04 2.27 2.07 -1.09 -2.22 116.25 118.97 3fk4 h VAL 201 Ca 0.14 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 3fk4 h VAL 201 Cb -0.01 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3fk4 h VAL 201 CO -0.03 0.27 0.00 0.22 0.02 0.00 0.00 177.57 178.06 3fk4 h TYR 202 N 0.76 0.08 -0.85 1.57 3.20 -0.44 0.40 116.97 121.69 3fk4 h TYR 202 Ca 0.17 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.16 3fk4 h TYR 202 Cb 0.23 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.42 3fk4 h TYR 202 CO 0.01 0.34 0.55 0.93 -1.64 0.00 0.00 178.16 178.35 3fk4 h GLU 203 N -0.20 0.67 0.04 1.82 5.08 -0.62 0.11 114.58 121.48 3fk4 h GLU 203 Ca 0.01 -0.04 -0.38 0.00 -1.00 0.00 0.00 59.36 57.95 3fk4 h GLU 203 Cb 0.30 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 3fk4 h GLU 203 CO 0.00 0.44 -2.29 2.41 -1.00 0.00 0.00 179.01 178.57 3fk4 n THR 204 N -4.53 1.59 0.66 1.13 -1.04 -0.86 -4.63 114.28 106.60 3fk4 n THR 204 Ca 0.16 -0.57 0.11 0.00 -2.04 0.00 0.00 64.05 61.71 3fk4 n THR 204 Cb 0.42 -1.58 -0.06 0.00 -1.82 0.00 0.00 70.33 67.30 3fk4 n THR 204 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3fk4 n TYR 205 N -3.44 0.09 -1.00 -1.42 4.01 0.14 -4.98 117.16 110.55 3fk4 n TYR 205 Ca -0.42 0.03 -0.00 0.00 -0.16 0.00 0.00 57.90 57.35 3fk4 n TYR 205 Cb 0.99 -0.26 -0.00 0.00 -0.31 0.00 0.00 39.34 39.76 3fk4 n TYR 205 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fk4 n GLY 206 N 1.41 0.36 3.32 2.72 0.00 0.38 -5.00 105.19 108.39 3fk4 n GLY 206 Ca 0.02 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3fk4 n GLY 206 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3fk4 s HIS 207 N -1.71 2.89 -0.25 1.61 5.04 -1.26 -5.01 115.29 116.59 3fk4 s HIS 207 Ca 0.00 -0.86 -0.13 0.00 -1.54 0.00 0.00 55.06 52.52 3fk4 s HIS 207 Cb 0.00 -1.98 -0.04 0.00 0.04 0.00 0.00 32.58 30.60 3fk4 s HIS 207 CO 0.00 -0.42 0.29 0.21 -2.34 0.00 0.00 174.74 172.48 3fk4 s LYS 208 N 0.96 4.04 0.04 2.88 2.47 -1.26 -3.83 119.74 125.04 3fk4 s LYS 208 Ca -0.01 -0.08 0.04 0.00 -1.56 0.00 0.00 55.97 54.36 3fk4 s LYS 208 Cb -0.15 -3.61 -0.04 0.00 -1.46 0.00 0.00 37.83 32.57 3fk4 s LYS 208 CO -0.01 -0.14 -0.05 0.99 0.16 0.00 0.00 175.35 176.30 3fk4 s THR 209 N 1.66 3.72 0.07 3.43 2.01 -1.26 -4.83 115.64 120.44 3fk4 s THR 209 Ca 0.12 -0.89 0.05 0.00 0.31 0.00 0.00 61.69 61.28 3fk4 s THR 209 Cb -0.15 -2.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 3fk4 s THR 209 CO 0.09 0.29 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.51 3fk4 s LEU 210 N -1.74 3.31 -0.25 4.42 1.43 0.12 -4.94 118.68 121.03 3fk4 s LEU 210 Ca 0.20 -0.21 -0.03 0.00 -1.03 0.00 0.00 54.13 53.05 3fk4 s LEU 210 Cb -0.11 -2.03 0.01 0.00 0.03 0.00 0.00 46.19 44.09 3fk4 s LEU 210 CO 0.11 0.20 -0.03 -0.47 0.23 0.00 0.00 176.35 176.40 3fk4 s TYR 211 N -1.21 3.04 -0.45 0.29 5.04 -1.26 -0.97 117.35 121.82 3fk4 s TYR 211 Ca 0.23 -1.24 -0.19 0.00 -2.44 0.00 0.00 57.07 53.43 3fk4 s TYR 211 Cb -0.11 -2.11 0.03 0.00 0.35 0.00 0.00 41.96 40.11 3fk4 s TYR 211 CO 0.15 -0.64 0.59 0.00 -1.34 0.00 0.00 175.55 174.30 3fk4 s ALA 212 N 1.41 3.37 -0.11 3.97 0.00 0.49 -2.70 121.76 128.19 3fk4 s ALA 212 Ca 0.03 -1.42 -0.09 0.00 0.00 0.00 0.00 51.96 50.48 3fk4 s ALA 212 Cb -0.16 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 3fk4 s ALA 212 CO -0.03 -1.79 0.19 0.54 0.00 0.00 0.00 175.76 174.67 3fk4 s VAL 213 N 2.60 5.41 0.09 0.00 0.11 -0.61 -1.74 120.40 126.26 3fk4 s VAL 213 Ca 0.18 0.32 -0.31 0.00 -2.93 0.00 0.00 61.98 59.25 3fk4 s VAL 213 Cb -0.16 -3.47 -0.09 0.00 -1.53 0.00 0.00 36.38 31.13 3fk4 s VAL 213 CO 0.16 0.58 1.68 0.21 -3.33 0.00 0.00 175.10 174.40 3fk4 s ASN 214 N -0.76 6.56 -0.40 3.54 3.04 -1.26 -0.29 114.94 125.37 3fk4 s ASN 214 Ca 0.16 2.56 -0.08 0.00 0.04 0.00 0.00 52.86 55.53 3fk4 s ASN 214 Cb -0.13 -2.57 0.07 0.00 -1.54 0.00 0.00 41.25 37.09 3fk4 s ASN 214 CO 0.05 -0.91 0.23 -0.22 -3.04 0.00 0.00 177.10 173.21 3fk4 s LEU 215 N 2.54 5.01 0.00 3.21 2.96 -0.19 -4.89 118.68 127.32 3fk4 s LEU 215 Ca 0.75 -1.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.18 3fk4 s LEU 215 Cb -0.41 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.32 3fk4 s LEU 215 CO 0.33 -0.50 0.00 0.35 -1.32 0.00 0.00 176.35 175.21 3fk4 n THR 216 N 4.87 0.00 0.00 3.68 -2.24 -1.26 -4.66 114.28 114.67 3fk4 n THR 216 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3fk4 n THR 216 Cb 0.43 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 3fk4 n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fk4 n GLY 217 N 3.56 -1.24 3.77 3.38 0.00 -1.26 -4.84 105.19 108.56 3fk4 n GLY 217 Ca 0.00 -2.11 -0.38 0.00 0.00 0.00 0.00 46.02 43.53 3fk4 n GLY 217 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fk4 s ARG 218 N 0.00 4.18 0.20 1.61 1.81 -1.26 -4.94 118.95 120.55 3fk4 s ARG 218 Ca 0.00 1.74 -0.13 0.00 -1.72 0.00 0.00 55.73 55.61 3fk4 s ARG 218 Cb 0.00 -2.71 0.22 0.00 -0.45 0.00 0.00 34.95 32.00 3fk4 s ARG 218 CO 0.00 -0.19 1.65 1.15 -0.68 0.00 0.00 175.30 177.23 3fk4 h THR 219 N 2.40 0.47 0.00 0.02 2.02 -2.00 -0.18 112.91 115.65 3fk4 h THR 219 Ca -0.48 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 66.68 3fk4 h THR 219 Cb 1.23 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3fk4 h THR 219 CO 0.63 0.01 0.00 0.49 0.37 0.00 0.00 175.52 177.02 3fk4 n PHE 220 N -5.34 0.00 0.42 3.16 3.72 -1.26 -2.16 117.46 116.00 3fk4 n PHE 220 Ca 0.07 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.51 3fk4 n PHE 220 Cb 0.31 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.82 3fk4 n PHE 220 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3fk4 n ASP 221 N -0.85 0.82 -0.24 4.37 8.00 -0.11 -4.72 116.55 123.82 3fk4 n ASP 221 Ca 0.11 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.70 3fk4 n ASP 221 Cb 0.05 0.72 0.12 0.00 -0.02 0.00 0.00 41.12 41.99 3fk4 n ASP 221 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3fk4 h LEU 222 N 0.56 0.48 -0.59 0.64 3.38 -1.08 0.21 115.31 118.91 3fk4 h LEU 222 Ca 0.00 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3fk4 h LEU 222 Cb 0.27 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3fk4 h LEU 222 CO 0.00 0.29 0.19 0.11 0.09 0.00 0.00 178.44 179.12 3fk4 h LYS 223 N 0.62 0.92 -0.33 1.13 1.57 -1.85 0.28 116.57 118.91 3fk4 h LYS 223 Ca 0.33 -0.19 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3fk4 h LYS 223 Cb 0.31 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3fk4 h LYS 223 CO -0.24 0.82 0.10 1.49 -0.57 0.00 0.00 179.45 181.04 3fk4 h GLU 224 N 0.84 0.52 -0.45 3.15 4.81 -1.75 -1.11 114.58 120.59 3fk4 h GLU 224 Ca 0.19 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 3fk4 h GLU 224 Cb 0.28 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3fk4 h GLU 224 CO -0.01 0.57 -0.10 -0.91 -0.73 0.00 0.00 179.01 177.83 3fk4 h ASN 225 N 0.38 0.79 -0.77 1.04 -0.26 -0.81 -0.57 115.58 115.39 3fk4 h ASN 225 Ca 0.11 -0.23 -0.04 0.00 -0.56 0.00 0.00 56.30 55.57 3fk4 h ASN 225 Cb 0.27 -0.21 -0.03 0.00 -1.06 0.00 0.00 38.32 37.28 3fk4 h ASN 225 CO -0.00 0.91 0.31 0.00 -1.06 0.00 0.00 177.43 177.60 3fk4 h ALA 226 N 1.16 0.99 -0.04 -0.83 0.00 -0.23 0.65 119.26 120.96 3fk4 h ALA 226 Ca 0.12 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 3fk4 h ALA 226 Cb 0.58 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3fk4 h ALA 226 CO 0.04 0.61 -0.67 0.87 0.00 0.00 0.00 179.25 180.09 3fk4 h LYS 227 N 1.10 0.18 -0.56 0.00 1.57 -0.86 -0.48 116.57 117.53 3fk4 h LYS 227 Ca 0.26 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.80 3fk4 h LYS 227 Cb 0.20 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3fk4 h LYS 227 CO -0.02 0.78 -0.05 0.00 -0.57 0.00 0.00 179.45 179.59 3fk4 h ARG 228 N 0.13 1.00 -0.21 3.15 3.08 -0.72 -0.76 114.38 120.04 3fk4 h ARG 228 Ca -0.01 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.69 3fk4 h ARG 228 Cb 1.20 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 3fk4 h ARG 228 CO 0.10 1.01 0.07 0.00 -1.07 0.00 0.00 179.97 180.08 3fk4 h ALA 229 N 1.03 0.28 -0.31 0.04 0.00 -0.53 -0.95 119.26 118.81 3fk4 h ALA 229 Ca 0.15 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3fk4 h ALA 229 Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3fk4 h ALA 229 CO 0.04 -0.11 0.16 0.28 0.00 0.00 0.00 179.25 179.62 3fk4 h VAL 230 N 0.17 1.00 -0.86 0.00 2.07 -0.95 -0.98 116.25 116.70 3fk4 h VAL 230 Ca 0.07 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.53 3fk4 h VAL 230 Cb 0.22 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 3fk4 h VAL 230 CO -0.00 0.06 0.56 -0.61 0.02 0.00 0.00 177.57 177.60 3fk4 h GLN 231 N 0.33 0.95 0.00 1.57 4.15 -0.93 0.38 115.11 121.56 3fk4 h GLN 231 Ca 0.13 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.49 3fk4 h GLN 231 Cb 0.03 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.51 3fk4 h GLN 231 CO -0.08 0.63 0.00 0.00 -1.93 0.00 0.00 178.83 177.45 3fk4 n ALA 232 N -2.41 1.85 0.00 3.38 0.00 -0.38 -4.89 120.51 118.06 3fk4 n ALA 232 Ca 0.13 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.58 3fk4 n ALA 232 Cb 0.19 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.26 3fk4 n ALA 232 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fk4 n GLY 233 N 0.40 1.51 3.76 0.00 0.00 0.12 -4.39 105.19 106.60 3fk4 n GLY 233 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3fk4 n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fk4 n ALA 234 N -1.29 1.91 -0.09 4.61 0.00 -0.44 -4.90 120.51 120.31 3fk4 n ALA 234 Ca 0.00 0.22 -0.16 0.00 0.00 0.00 0.00 53.44 53.50 3fk4 n ALA 234 Cb 0.00 -2.38 -0.08 0.00 0.00 0.00 0.00 19.45 16.99 3fk4 n ALA 234 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3fk4 h ASP 235 N 2.05 0.00 -4.26 0.00 3.32 -1.91 -3.45 116.42 112.16 3fk4 h ASP 235 Ca -0.51 -0.36 -0.32 0.00 0.02 0.00 0.00 57.03 55.87 3fk4 h ASP 235 Cb 1.28 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.57 3fk4 h ASP 235 CO 0.60 1.22 -0.75 -0.63 -1.72 0.00 0.00 179.24 177.96 3fk4 s ILE 236 N -2.30 0.53 -0.25 0.35 -1.09 -1.10 -4.06 121.20 113.29 3fk4 s ILE 236 Ca -0.23 -0.61 -0.09 0.00 -2.23 0.00 0.00 60.65 57.48 3fk4 s ILE 236 Cb 0.04 -0.51 -0.04 0.00 -1.58 0.00 0.00 42.46 40.37 3fk4 s ILE 236 CO 0.47 -0.07 0.13 -0.76 -1.23 0.00 0.00 174.94 173.48 3fk4 s LEU 237 N -0.74 3.86 -0.17 2.97 1.43 -0.32 -1.58 118.68 124.13 3fk4 s LEU 237 Ca -0.02 -0.02 -0.19 0.00 -1.03 0.00 0.00 54.13 52.87 3fk4 s LEU 237 Cb -0.05 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 3fk4 s LEU 237 CO 0.00 0.02 0.52 -0.22 0.23 0.00 0.00 176.35 176.89 3fk4 s LEU 238 N 1.34 4.20 -0.05 1.79 2.96 0.60 -0.42 118.68 129.10 3fk4 s LEU 238 Ca 0.06 0.75 0.01 0.00 -0.22 0.00 0.00 54.13 54.73 3fk4 s LEU 238 Cb -0.15 -2.73 0.02 0.00 0.50 0.00 0.00 46.19 43.84 3fk4 s LEU 238 CO 0.06 -0.12 -0.05 0.12 -1.32 0.00 0.00 176.35 175.04 3fk4 s PHE 239 N 1.27 0.82 -1.32 5.38 5.36 0.14 -1.02 117.98 128.61 3fk4 s PHE 239 Ca 0.25 -0.25 -0.14 0.00 -0.96 0.00 0.00 56.93 55.84 3fk4 s PHE 239 Cb -0.15 -0.73 0.11 0.00 -0.34 0.00 0.00 43.02 41.90 3fk4 s PHE 239 CO 0.10 -0.23 1.85 0.09 -1.46 0.00 0.00 175.22 175.57 3fk4 n ASN 240 N 4.21 4.73 -0.28 6.13 3.02 -1.26 -0.80 115.26 131.01 3fk4 n ASN 240 Ca -0.22 -2.96 0.07 0.00 -0.03 0.00 0.00 54.58 51.45 3fk4 n ASN 240 Cb 0.51 -1.62 0.19 0.00 -0.61 0.00 0.00 39.78 38.25 3fk4 n ASN 240 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3fk4 h VAL 241 N 4.49 0.26 0.00 2.41 2.07 -1.88 -0.93 116.25 122.67 3fk4 h VAL 241 Ca 0.44 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.93 3fk4 h VAL 241 Cb 0.75 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3fk4 h VAL 241 CO 1.58 0.02 0.00 0.49 0.02 0.00 0.00 177.57 179.67 3fk4 n PHE 242 N -5.38 0.00 0.62 1.57 3.72 -1.26 0.10 117.46 116.83 3fk4 n PHE 242 Ca 0.16 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.68 3fk4 n PHE 242 Cb 0.54 -0.11 0.13 0.00 -0.94 0.00 0.00 39.48 39.10 3fk4 n PHE 242 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fk4 n ALA 243 N -1.11 3.14 -0.01 4.37 0.00 -0.36 -4.53 120.51 122.02 3fk4 n ALA 243 Ca 0.17 -0.31 -0.03 0.00 0.00 0.00 0.00 53.44 53.27 3fk4 n ALA 243 Cb 0.14 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 3fk4 n ALA 243 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3fk4 n TYR 244 N -2.00 0.00 0.00 0.00 4.01 -0.72 -5.12 117.16 113.34 3fk4 n TYR 244 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 3fk4 n TYR 244 Cb 0.43 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 3fk4 n TYR 244 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fk4 n GLY 245 N 2.86 4.64 0.37 2.72 0.00 0.29 -4.84 105.19 111.23 3fk4 n GLY 245 Ca -0.06 -1.12 0.10 0.00 0.00 0.00 0.00 46.02 44.94 3fk4 n GLY 245 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fk4 h LEU 246 N 0.00 0.71 -1.63 0.99 3.38 -1.96 -0.98 115.31 115.82 3fk4 h LEU 246 Ca 0.00 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3fk4 h LEU 246 Cb 0.00 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3fk4 h LEU 246 CO 0.00 0.38 -0.21 -0.78 0.09 0.00 0.00 178.44 177.93 3fk4 h ASP 247 N 0.76 0.00 -0.06 -0.43 3.58 -1.94 -0.79 116.42 117.54 3fk4 h ASP 247 Ca 0.43 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.71 3fk4 h ASP 247 Cb 0.58 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.64 3fk4 h ASP 247 CO -0.19 0.21 -0.60 0.58 -2.88 0.00 0.00 179.24 176.36 3fk4 h VAL 248 N 0.00 1.38 -0.33 2.25 2.07 -1.51 -2.29 116.25 117.81 3fk4 h VAL 248 Ca -0.00 -1.96 0.04 0.00 0.82 0.00 0.00 66.70 65.60 3fk4 h VAL 248 Cb 0.41 2.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 3fk4 h VAL 248 CO 0.03 0.58 0.12 0.25 0.02 0.00 0.00 177.57 178.57 3fk4 h LEU 249 N 0.09 0.13 -0.63 2.57 5.85 -1.09 -2.19 115.31 120.05 3fk4 h LEU 249 Ca -0.06 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.78 3fk4 h LEU 249 Cb 1.26 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.25 3fk4 h LEU 249 CO 0.12 0.11 0.27 -0.61 -0.34 0.00 0.00 178.44 177.99 3fk4 h GLN 250 N 0.26 0.46 -0.43 1.25 4.15 -1.10 0.85 115.11 120.56 3fk4 h GLN 250 Ca 0.15 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.49 3fk4 h GLN 250 Cb 0.12 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 3fk4 h GLN 250 CO -0.15 0.30 0.07 0.77 -1.93 0.00 0.00 178.83 177.90 3fk4 h SER 251 N 0.47 0.60 -0.17 -0.69 0.02 -0.97 0.50 113.55 113.32 3fk4 h SER 251 Ca 0.31 -0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 3fk4 h SER 251 Cb 0.35 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 3fk4 h SER 251 CO -0.28 0.63 -0.10 -0.07 -1.14 0.00 0.00 176.83 175.87 3fk4 h LEU 252 N 0.63 0.38 -1.75 5.07 3.38 -0.58 -2.85 115.31 119.59 3fk4 h LEU 252 Ca 0.14 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 3fk4 h LEU 252 Cb 0.29 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 3fk4 h LEU 252 CO 0.00 0.72 -0.12 0.00 0.09 0.00 0.00 178.44 179.13 3fk4 h ALA 253 N 0.67 1.79 0.00 1.53 0.00 -0.56 -2.47 119.26 120.22 3fk4 h ALA 253 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3fk4 h ALA 253 Cb 0.58 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3fk4 h ALA 253 CO 0.03 0.16 0.00 0.93 0.00 0.00 0.00 179.25 180.36 3fk4 h GLU 254 N 0.00 0.00 -6.15 0.00 5.08 -0.76 -3.45 114.58 109.30 3fk4 h GLU 254 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.77 3fk4 h GLU 254 Cb 0.22 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 3fk4 h GLU 254 CO 0.02 0.00 0.68 0.34 -1.00 0.00 0.00 179.01 179.05 3fk4 s ASP 255 N -4.62 6.77 0.00 1.42 -1.08 -0.93 -4.90 116.67 113.33 3fk4 s ASP 255 Ca 0.09 0.77 0.24 0.00 -0.52 0.00 0.00 52.55 53.13 3fk4 s ASP 255 Cb 0.11 -2.49 1.32 0.00 -1.46 0.00 0.00 42.92 40.40 3fk4 s ASP 255 CO 0.56 -0.85 1.80 -0.90 0.52 0.00 0.00 175.17 176.30 3fk4 n ASP 256 N 6.78 0.00 -0.98 -0.34 5.75 -1.26 -1.98 116.55 124.51 3fk4 n ASP 256 Ca 0.09 -0.39 0.07 0.00 -0.01 0.00 0.00 54.79 54.55 3fk4 n ASP 256 Cb 0.48 -0.15 0.22 0.00 -1.03 0.00 0.00 41.12 40.64 3fk4 n ASP 256 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3fk4 n GLU 257 N -1.15 2.34 -3.36 0.11 1.02 -1.26 -4.01 120.64 114.33 3fk4 n GLU 257 Ca 0.15 -1.81 -0.26 0.00 -0.02 0.00 0.00 57.16 55.21 3fk4 n GLU 257 Cb 0.14 -1.47 -0.08 0.00 -0.02 0.00 0.00 31.44 30.01 3fk4 n GLU 257 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3fk4 n ILE 258 N 0.87 0.76 -0.55 -3.67 5.41 -0.84 -4.82 119.36 116.51 3fk4 n ILE 258 Ca 0.17 -4.55 -0.02 0.00 1.00 0.00 0.00 62.75 59.35 3fk4 n ILE 258 Cb 0.48 -2.01 -0.03 0.00 -0.71 0.00 0.00 39.64 37.37 3fk4 n ILE 258 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3fk4 n PRO 259 N 1.32 1.10 -4.20 0.38 -0.04 -1.26 -4.85 135.00 127.45 3fk4 n PRO 259 Ca 0.25 -0.16 -0.12 0.00 -0.04 0.00 0.00 63.50 63.44 3fk4 n PRO 259 Cb 0.46 -1.18 -0.10 0.00 -0.04 0.00 0.00 33.50 32.64 3fk4 n PRO 259 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3fk4 s VAL 260 N 0.27 0.90 0.76 0.52 -7.23 -1.26 -5.14 120.40 109.23 3fk4 s VAL 260 Ca 0.10 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.21 3fk4 s VAL 260 Cb 0.05 -1.71 0.05 0.00 0.56 0.00 0.00 36.38 35.34 3fk4 s VAL 260 CO 0.00 -0.79 1.10 -2.84 -0.31 0.00 0.00 175.10 172.26 3fk4 s PRO 261 N -3.68 2.25 -0.09 4.82 0.02 -1.26 -4.85 135.00 132.21 3fk4 s PRO 261 Ca 0.13 1.26 0.03 0.00 0.02 0.00 0.00 61.00 62.44 3fk4 s PRO 261 Cb 0.03 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.67 3fk4 s PRO 261 CO -0.02 -1.66 -0.19 0.42 -0.33 0.00 0.00 177.00 175.22 3fk4 s ILE 262 N -2.75 1.68 -0.26 2.83 1.01 -1.26 -1.17 121.20 121.27 3fk4 s ILE 262 Ca 0.63 -0.78 -0.07 0.00 0.00 0.00 0.00 60.65 60.43 3fk4 s ILE 262 Cb -0.19 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 3fk4 s ILE 262 CO 0.53 0.48 0.06 -0.32 0.00 0.00 0.00 174.94 175.68 3fk4 s MET 263 N 0.60 3.37 0.06 2.79 -2.45 0.44 -0.85 119.30 123.25 3fk4 s MET 263 Ca -0.14 -0.66 -0.22 0.00 -1.25 0.00 0.00 55.69 53.42 3fk4 s MET 263 Cb -0.17 -3.30 -0.06 0.00 1.25 0.00 0.00 34.83 32.56 3fk4 s MET 263 CO 0.05 -0.30 0.65 0.00 1.05 0.00 0.00 175.02 176.46 3fk4 s ALA 264 N 1.55 3.49 -0.10 4.11 0.00 -0.36 -0.68 121.76 129.76 3fk4 s ALA 264 Ca 0.05 0.13 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 3fk4 s ALA 264 Cb -0.16 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.15 3fk4 s ALA 264 CO 0.02 0.24 -0.07 -1.58 0.00 0.00 0.00 175.76 174.37 3fk4 s HIS 265 N -0.61 2.94 -2.00 0.00 2.46 0.02 -2.19 115.29 115.91 3fk4 s HIS 265 Ca 0.32 -0.17 0.13 0.00 0.47 0.00 0.00 55.06 55.82 3fk4 s HIS 265 Cb -0.20 -1.80 0.80 0.00 -0.13 0.00 0.00 32.58 31.25 3fk4 s HIS 265 CO 0.20 0.15 1.33 -0.35 -2.47 0.00 0.00 174.74 173.60 3fk4 n PRO 266 N 2.78 0.74 -1.56 2.88 -0.04 -1.25 -3.67 135.00 134.87 3fk4 n PRO 266 Ca -0.18 0.00 -0.52 0.00 -0.04 0.00 0.00 63.50 62.76 3fk4 n PRO 266 Cb 0.53 -1.28 -0.05 0.00 -0.04 0.00 0.00 33.50 32.65 3fk4 n PRO 266 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fk4 n ALA 267 N -0.78 -1.46 0.00 0.55 0.00 -1.26 -1.07 120.51 116.49 3fk4 n ALA 267 Ca 0.10 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.05 3fk4 n ALA 267 Cb 0.05 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.51 3fk4 n ALA 267 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3fk4 n VAL 268 N 1.85 0.00 0.32 0.00 0.31 -1.26 -4.23 118.33 115.32 3fk4 n VAL 268 Ca 0.17 0.00 0.19 0.00 -0.01 0.00 0.00 64.34 64.69 3fk4 n VAL 268 Cb 0.19 0.00 1.05 0.00 -0.91 0.00 0.00 33.84 34.17 3fk4 n VAL 268 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3fk4 h SER 269 N 0.00 0.00 0.08 4.52 4.64 -1.41 -1.15 113.55 120.22 3fk4 h SER 269 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3fk4 h SER 269 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3fk4 h SER 269 CO 0.00 0.01 -0.05 1.23 -0.87 0.00 0.00 176.83 177.14 3fk4 h GLY 270 N 0.08 0.00 2.00 -0.77 0.00 -1.88 -0.23 103.07 102.26 3fk4 h GLY 270 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3fk4 h GLY 270 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.49 3fk4 h ALA 271 N 1.95 1.61 0.10 3.60 0.00 -1.60 -0.47 119.26 124.45 3fk4 h ALA 271 Ca -0.00 -0.05 -0.36 0.00 0.00 0.00 0.00 54.91 54.50 3fk4 h ALA 271 Cb 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3fk4 h ALA 271 CO 0.01 0.07 -2.03 0.66 0.00 0.00 0.00 179.25 177.95 3fk4 n TYR 272 N -4.04 1.10 0.77 0.00 4.01 -0.17 -4.68 117.16 114.15 3fk4 n TYR 272 Ca -0.03 0.24 0.08 0.00 -0.16 0.00 0.00 57.90 58.04 3fk4 n TYR 272 Cb 0.14 -1.15 -0.06 0.00 -0.31 0.00 0.00 39.34 37.97 3fk4 n TYR 272 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3fk4 n SER 273 N -3.41 1.14 -0.16 7.72 3.41 -0.77 -1.27 113.62 120.28 3fk4 n SER 273 Ca -0.32 -1.07 0.04 0.00 -0.26 0.00 0.00 58.87 57.26 3fk4 n SER 273 Cb 1.04 0.79 0.34 0.00 -0.26 0.00 0.00 64.21 66.12 3fk4 n SER 273 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fk4 h ALA 274 N 2.58 1.64 -2.21 7.33 0.00 -1.35 -3.44 119.26 123.81 3fk4 h ALA 274 Ca 0.00 -0.03 -0.46 0.00 0.00 0.00 0.00 54.91 54.42 3fk4 h ALA 274 Cb 0.46 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3fk4 h ALA 274 CO 0.00 0.29 0.28 0.45 0.00 0.00 0.00 179.25 180.27 3fk4 s SER 275 N -6.34 6.99 0.00 0.00 0.15 -1.26 -4.97 113.70 108.27 3fk4 s SER 275 Ca -0.10 1.62 0.23 0.00 0.70 0.00 0.00 55.95 58.41 3fk4 s SER 275 Cb 0.18 -2.51 0.17 0.00 -1.71 0.00 0.00 66.02 62.16 3fk4 s SER 275 CO 0.77 -0.25 1.18 0.29 1.20 0.00 0.00 173.24 176.43 3fk4 n LYS 276 N -0.27 0.01 -0.07 5.44 5.02 -1.26 -4.32 118.16 122.70 3fk4 n LYS 276 Ca 0.05 -0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.27 3fk4 n LYS 276 Cb 0.53 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.91 3fk4 n LYS 276 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3fk4 n LEU 277 N -1.51 0.00 0.00 -0.35 4.77 -1.26 -4.94 117.00 113.70 3fk4 n LEU 277 Ca 0.05 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.86 3fk4 n LEU 277 Cb 0.34 0.37 -0.04 0.00 -2.33 0.00 0.00 43.42 41.75 3fk4 n LEU 277 CO 0.39 0.37 -0.11 -1.22 -1.33 0.00 0.00 177.39 175.49 3fk4 n TYR 278 N -2.56 0.17 -3.81 -1.77 4.01 -1.26 -2.55 117.16 109.38 3fk4 n TYR 278 Ca -0.25 -1.64 0.00 0.00 -0.16 0.00 0.00 57.90 55.86 3fk4 n TYR 278 Cb 0.99 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.99 3fk4 n TYR 278 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fk4 n GLY 279 N 0.47 -0.76 3.09 2.72 0.00 -1.26 -4.53 105.19 104.93 3fk4 n GLY 279 Ca -0.05 -1.21 -0.23 0.00 0.00 0.00 0.00 46.02 44.53 3fk4 n GLY 279 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fk4 s VAL 280 N 0.00 1.13 0.52 1.61 1.01 -0.40 -1.23 120.40 123.04 3fk4 s VAL 280 Ca 0.00 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.19 3fk4 s VAL 280 Cb 0.00 -0.97 -0.06 0.00 0.00 0.00 0.00 36.38 35.36 3fk4 s VAL 280 CO 0.00 0.33 1.22 -0.94 0.00 0.00 0.00 175.10 175.71 3fk4 s SER 281 N -0.08 5.65 0.21 3.32 1.04 0.18 -3.57 113.70 120.45 3fk4 s SER 281 Ca 0.00 2.43 -0.10 0.00 0.48 0.00 0.00 55.95 58.77 3fk4 s SER 281 Cb -0.08 -2.61 0.16 0.00 0.10 0.00 0.00 66.02 63.59 3fk4 s SER 281 CO 0.01 -1.28 1.88 -1.28 0.98 0.00 0.00 173.24 173.54 3fk4 h SER 282 N 1.53 0.90 -0.78 7.02 0.87 -1.92 -2.32 113.55 118.86 3fk4 h SER 282 Ca -0.50 -0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.04 3fk4 h SER 282 Cb 1.27 -0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 62.97 3fk4 h SER 282 CO 0.58 0.67 0.51 -0.65 -0.53 0.00 0.00 176.83 177.41 3fk4 h PRO 283 N 1.06 0.99 -0.14 2.24 0.11 -1.91 0.21 132.00 134.56 3fk4 h PRO 283 Ca 0.28 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.25 3fk4 h PRO 283 Cb -0.10 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 30.79 3fk4 h PRO 283 CO -0.06 0.66 -0.25 1.25 -0.21 0.00 0.00 178.00 179.38 3fk4 h LEU 284 N 1.02 0.47 0.53 2.35 5.85 -1.71 -1.09 115.31 122.73 3fk4 h LEU 284 Ca 0.29 -0.54 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 3fk4 h LEU 284 Cb -0.07 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 40.83 3fk4 h LEU 284 CO -0.07 0.93 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.63 3fk4 h LEU 285 N 0.04 -0.60 0.00 2.25 3.38 -1.12 0.27 115.31 119.52 3fk4 h LEU 285 Ca 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3fk4 h LEU 285 Cb 0.84 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3fk4 h LEU 285 CO 0.06 -0.19 -0.20 0.18 0.09 0.00 0.00 178.44 178.37 3fk4 n LEU 286 N -5.26 0.35 0.00 1.67 4.77 0.71 -2.73 117.00 116.52 3fk4 n LEU 286 Ca -0.10 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 3fk4 n LEU 286 Cb 0.30 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3fk4 n LEU 286 CO 0.25 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3fk4 n GLY 287 N 1.45 -0.12 0.37 -0.72 0.00 -0.48 -4.67 105.19 101.02 3fk4 n GLY 287 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 3fk4 n GLY 287 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3fk4 h LYS 288 N 0.00 -0.87 -0.69 1.61 3.64 -1.27 -2.44 116.57 116.55 3fk4 h LYS 288 Ca 0.00 0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3fk4 h LYS 288 Cb 0.00 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 3fk4 h LYS 288 CO 0.00 -0.58 0.26 -0.07 -2.27 0.00 0.00 179.45 176.79 3fk4 h LEU 289 N -0.91 0.95 -0.53 5.20 3.38 -0.61 -0.70 115.31 122.09 3fk4 h LEU 289 Ca -0.09 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3fk4 h LEU 289 Cb 0.69 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3fk4 h LEU 289 CO 0.15 0.86 0.21 -0.07 0.09 0.00 0.00 178.44 179.68 3fk4 h LEU 290 N 1.01 0.74 -0.01 1.67 3.38 -1.55 -0.60 115.31 119.95 3fk4 h LEU 290 Ca 0.23 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3fk4 h LEU 290 Cb 0.22 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3fk4 h LEU 290 CO -0.02 0.71 0.00 -0.09 0.09 0.00 0.00 178.44 179.14 3fk4 h ARG 291 N 0.72 0.01 -0.55 1.13 2.43 -1.00 -1.42 114.38 115.70 3fk4 h ARG 291 Ca 0.18 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 3fk4 h ARG 291 Cb 0.21 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 3fk4 h ARG 291 CO -0.01 0.10 0.28 1.88 -1.51 0.00 0.00 179.97 180.71 3fk4 h TYR 292 N -0.09 0.74 0.00 2.20 -1.99 -1.00 -2.11 116.97 114.73 3fk4 h TYR 292 Ca 0.00 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.72 3fk4 h TYR 292 Cb 0.09 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 38.58 3fk4 h TYR 292 CO -0.05 0.53 0.00 0.00 -0.00 0.00 0.00 178.16 178.65 3fk4 h ALA 293 N 1.55 1.00 0.00 3.88 0.00 -0.88 -1.42 119.26 123.39 3fk4 h ALA 293 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3fk4 h ALA 293 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3fk4 h ALA 293 CO -0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.63 3fk4 n GLY 294 N 0.27 1.39 3.71 0.00 0.00 -0.77 -3.40 105.19 106.39 3fk4 n GLY 294 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3fk4 n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fk4 s ALA 295 N -2.00 3.39 -0.25 4.61 0.00 -0.60 -4.30 121.76 122.62 3fk4 s ALA 295 Ca 0.00 0.83 0.19 0.00 0.00 0.00 0.00 51.96 52.98 3fk4 s ALA 295 Cb 0.00 -3.45 0.11 0.00 0.00 0.00 0.00 23.12 19.78 3fk4 s ALA 295 CO 0.00 -0.46 1.34 -0.44 0.00 0.00 0.00 175.76 176.20 3fk4 h ASP 296 N 6.86 0.00 -4.49 0.00 3.32 -1.34 -3.42 116.42 117.35 3fk4 h ASP 296 Ca -0.41 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.38 3fk4 h ASP 296 Cb 1.21 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.52 3fk4 h ASP 296 CO 0.82 0.29 -0.73 -0.36 -1.72 0.00 0.00 179.24 177.53 3fk4 s PHE 297 N -3.09 0.46 -0.11 4.55 0.08 -1.12 -1.01 117.98 117.74 3fk4 s PHE 297 Ca 0.03 -0.35 -0.01 0.00 0.12 0.00 0.00 56.93 56.72 3fk4 s PHE 297 Cb 0.07 -0.29 0.03 0.00 -0.57 0.00 0.00 43.02 42.27 3fk4 s PHE 297 CO 0.74 -0.08 -0.03 0.45 -0.10 0.00 0.00 175.22 176.20 3fk4 s SER 298 N -1.03 2.12 -0.02 1.36 0.15 -0.72 -1.23 113.70 114.33 3fk4 s SER 298 Ca -0.07 -0.32 -0.16 0.00 0.70 0.00 0.00 55.95 56.09 3fk4 s SER 298 Cb -0.07 -0.68 -0.05 0.00 -1.71 0.00 0.00 66.02 63.50 3fk4 s SER 298 CO -0.00 -0.17 0.45 -0.76 1.20 0.00 0.00 173.24 173.96 3fk4 s LEU 299 N 1.81 4.43 0.02 3.45 1.02 -0.93 -1.62 118.68 126.86 3fk4 s LEU 299 Ca 0.04 0.98 -0.19 0.00 0.02 0.00 0.00 54.13 54.97 3fk4 s LEU 299 Cb -0.13 -2.67 0.04 0.00 0.02 0.00 0.00 46.19 43.45 3fk4 s LEU 299 CO -0.07 0.23 0.43 0.72 0.02 0.00 0.00 176.35 177.68 3fk4 s PHE 300 N -0.63 -0.31 0.22 0.29 -0.12 -1.01 -3.92 117.98 112.51 3fk4 s PHE 300 Ca 0.25 0.35 -0.31 0.00 -0.05 0.00 0.00 56.93 57.17 3fk4 s PHE 300 Cb -0.17 0.23 -0.14 0.00 -0.63 0.00 0.00 43.02 42.31 3fk4 s PHE 300 CO 0.13 -0.55 1.26 -2.30 -0.05 0.00 0.00 175.22 173.71 3fk4 n PRO 301 N 0.67 1.61 -2.36 1.99 -0.02 -1.26 0.30 135.00 135.93 3fk4 n PRO 301 Ca -0.19 0.57 -0.28 0.00 -2.02 0.00 0.00 63.50 61.58 3fk4 n PRO 301 Cb 0.59 -2.13 0.02 0.00 -0.02 0.00 0.00 33.50 31.96 3fk4 n PRO 301 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3fk4 s SER 302 N 0.04 5.85 -0.17 2.55 1.04 -0.44 -4.55 113.70 118.02 3fk4 s SER 302 Ca 0.68 0.90 0.04 0.00 0.48 0.00 0.00 55.95 58.06 3fk4 s SER 302 Cb -0.73 -1.97 0.37 0.00 0.10 0.00 0.00 66.02 63.78 3fk4 s SER 302 CO 0.52 -0.93 1.29 -0.81 0.98 0.00 0.00 173.24 174.30 3fk4 n PRO 303 N -2.55 2.28 -2.23 4.02 -0.04 -1.26 -4.93 135.00 130.28 3fk4 n PRO 303 Ca 0.04 -1.53 -0.28 0.00 -0.04 0.00 0.00 63.50 61.69 3fk4 n PRO 303 Cb 0.56 -1.73 0.01 0.00 -0.04 0.00 0.00 33.50 32.31 3fk4 n PRO 303 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3fk4 n TYR 304 N -0.00 3.18 0.00 0.54 4.01 -1.26 -5.12 117.16 118.50 3fk4 n TYR 304 Ca 0.22 -2.78 0.00 0.00 -0.16 0.00 0.00 57.90 55.17 3fk4 n TYR 304 Cb 0.90 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 3fk4 n TYR 304 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3fk4 n LYS 311 N -0.57 0.00 0.23 -0.72 5.02 -1.26 -4.53 118.16 116.33 3fk4 n LYS 311 Ca 0.43 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.83 3fk4 n LYS 311 Cb 0.70 0.00 0.54 0.00 -0.02 0.00 0.00 35.03 36.24 3fk4 n LYS 311 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3fk4 h GLU 312 N 0.00 0.00 -0.01 1.97 5.08 -2.00 -2.99 114.58 116.63 3fk4 h GLU 312 Ca 0.00 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3fk4 h GLU 312 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 3fk4 h GLU 312 CO 0.00 0.21 -0.20 1.49 -1.00 0.00 0.00 179.01 179.51 3fk4 h GLU 313 N 0.00 -0.30 -0.57 2.33 4.57 -1.99 0.18 114.58 118.79 3fk4 h GLU 313 Ca -0.00 0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.21 3fk4 h GLU 313 Cb 0.62 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 3fk4 h GLU 313 CO 0.03 -0.20 0.37 0.00 -1.18 0.00 0.00 179.01 178.02 3fk4 h ALA 314 N 0.59 0.73 0.00 2.92 0.00 -1.81 -1.95 119.26 119.73 3fk4 h ALA 314 Ca 0.06 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3fk4 h ALA 314 Cb 0.40 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3fk4 h ALA 314 CO -0.19 0.13 -0.29 -0.07 0.00 0.00 0.00 179.25 178.83 3fk4 h LEU 315 N 0.75 0.00 -0.10 0.00 3.38 -1.42 -2.57 115.31 115.33 3fk4 h LEU 315 Ca 0.22 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 3fk4 h LEU 315 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3fk4 h LEU 315 CO -0.06 0.29 -0.23 0.00 0.09 0.00 0.00 178.44 178.53 3fk4 h ALA 316 N 1.71 0.17 -0.06 1.53 0.00 -0.03 -0.81 119.26 121.76 3fk4 h ALA 316 Ca -0.00 -0.39 0.04 0.00 0.00 0.00 0.00 54.91 54.56 3fk4 h ALA 316 Cb 0.59 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 3fk4 h ALA 316 CO 0.04 0.14 -0.27 0.82 0.00 0.00 0.00 179.25 179.97 3fk4 h ILE 317 N -0.10 0.38 -0.83 0.00 2.04 -1.22 -1.42 117.51 116.36 3fk4 h ILE 317 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.97 3fk4 h ILE 317 Cb 0.83 0.38 -0.08 0.00 -0.74 0.00 0.00 36.82 37.21 3fk4 h ILE 317 CO 0.05 0.00 0.46 -1.28 0.00 0.00 0.00 178.15 177.38 3fk4 h SER 318 N -0.38 0.63 -0.44 1.72 0.87 -1.45 -1.45 113.55 113.05 3fk4 h SER 318 Ca 0.08 0.06 0.07 0.00 -1.23 0.00 0.00 61.79 60.77 3fk4 h SER 318 Cb 0.49 -0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 62.34 3fk4 h SER 318 CO -0.28 0.34 0.11 0.50 -0.53 0.00 0.00 176.83 176.97 3fk4 h LYS 319 N 0.74 0.24 0.00 2.24 3.11 -0.09 -1.64 116.57 121.18 3fk4 h LYS 319 Ca 0.42 -0.01 -0.11 0.00 -2.81 0.00 0.00 60.65 58.13 3fk4 h LYS 319 Cb 0.45 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.60 3fk4 h LYS 319 CO -0.28 0.16 -0.54 1.88 -2.81 0.00 0.00 179.45 177.87 3fk4 h TYR 320 N 0.25 0.00 0.00 1.91 0.05 -0.65 0.32 116.97 118.85 3fk4 h TYR 320 Ca 0.21 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.92 3fk4 h TYR 320 Cb 0.25 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 3fk4 h TYR 320 CO -0.19 0.54 -0.32 -0.07 -1.05 0.00 0.00 178.16 177.06 3fk4 h LEU 321 N 0.00 0.00 -0.46 3.88 3.38 -0.69 -3.34 115.31 118.08 3fk4 h LEU 321 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3fk4 h LEU 321 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3fk4 h LEU 321 CO 0.07 0.32 0.00 0.35 0.09 0.00 0.00 178.44 179.27 3fk4 n THR 322 N -3.76 0.00 -1.69 0.22 -2.24 -0.67 -0.93 114.28 105.21 3fk4 n THR 322 Ca -0.01 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 60.86 3fk4 n THR 322 Cb 0.42 1.00 0.01 0.00 -2.10 0.00 0.00 70.33 69.66 3fk4 n THR 322 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3fk4 n GLU 323 N -0.53 1.86 -1.78 -0.78 0.28 0.11 -4.86 120.64 114.94 3fk4 n GLU 323 Ca 0.00 0.66 -0.41 0.00 -0.16 0.00 0.00 57.16 57.25 3fk4 n GLU 323 Cb 0.00 -2.33 -0.01 0.00 1.43 0.00 0.00 31.44 30.52 3fk4 n GLU 323 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3fk4 s ASP 324 N -0.55 6.36 -0.29 -1.84 1.01 -1.26 -4.94 116.67 115.16 3fk4 s ASP 324 Ca 0.61 2.97 -0.07 0.00 0.71 0.00 0.00 52.55 56.77 3fk4 s ASP 324 Cb -0.52 -2.64 0.15 0.00 1.01 0.00 0.00 42.92 40.92 3fk4 s ASP 324 CO 0.58 -0.91 0.62 -0.62 0.21 0.00 0.00 175.17 175.05 3fk4 s ASP 325 N 0.39 -1.16 0.30 0.27 -1.08 -1.26 -5.03 116.67 109.10 3fk4 s ASP 325 Ca 0.62 1.31 0.23 0.00 -0.52 0.00 0.00 52.55 54.19 3fk4 s ASP 325 Cb -0.48 2.20 1.11 0.00 -1.46 0.00 0.00 42.92 44.30 3fk4 s ASP 325 CO 0.50 -0.23 1.70 0.00 0.52 0.00 0.00 175.17 177.66 3fk4 n ALA 326 N 5.44 1.30 0.07 3.66 0.00 -1.26 -2.54 120.51 127.19 3fk4 n ALA 326 Ca -0.08 0.16 0.04 0.00 0.00 0.00 0.00 53.44 53.56 3fk4 n ALA 326 Cb 0.50 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 3fk4 n ALA 326 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3fk4 h SER 327 N 0.00 0.00 -4.39 0.00 0.02 -1.97 -3.48 113.55 103.74 3fk4 h SER 327 Ca 0.00 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.67 3fk4 h SER 327 Cb 0.16 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 62.45 3fk4 h SER 327 CO 0.00 0.37 -0.74 -0.36 -1.14 0.00 0.00 176.83 174.96 3fk4 s PHE 328 N -3.08 0.52 0.72 3.45 0.08 -1.05 -4.82 117.98 113.80 3fk4 s PHE 328 Ca -0.01 -0.31 -0.11 0.00 0.12 0.00 0.00 56.93 56.61 3fk4 s PHE 328 Cb 0.09 -0.32 0.03 0.00 -0.57 0.00 0.00 43.02 42.24 3fk4 s PHE 328 CO 0.80 -0.06 1.08 0.15 -0.10 0.00 0.00 175.22 177.09 3fk4 s LYS 329 N -0.91 2.64 0.40 0.44 1.02 -1.26 -4.55 119.74 117.52 3fk4 s LYS 329 Ca -0.05 1.09 -0.17 0.00 0.02 0.00 0.00 55.97 56.86 3fk4 s LYS 329 Cb -0.06 -1.95 -0.09 0.00 -0.52 0.00 0.00 37.83 35.21 3fk4 s LYS 329 CO 0.00 -1.34 0.86 0.15 -0.92 0.00 0.00 175.35 174.10 3fk4 s LYS 330 N -4.86 4.05 0.10 1.68 1.02 -1.26 -4.45 119.74 116.02 3fk4 s LYS 330 Ca 0.60 0.86 0.04 0.00 0.02 0.00 0.00 55.97 57.49 3fk4 s LYS 330 Cb -0.16 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.83 3fk4 s LYS 330 CO 0.53 -0.01 0.08 -1.12 -0.92 0.00 0.00 175.35 173.92 3fk4 s SER 331 N -2.48 5.45 0.00 2.83 0.01 -0.11 -1.18 113.70 118.23 3fk4 s SER 331 Ca 0.57 -0.07 -0.30 0.00 1.31 0.00 0.00 55.95 57.47 3fk4 s SER 331 Cb -0.10 -1.43 -0.04 0.00 0.21 0.00 0.00 66.02 64.66 3fk4 s SER 331 CO 0.20 0.14 1.13 -0.36 0.41 0.00 0.00 173.24 174.77 3fk4 s PHE 332 N -1.48 3.43 0.09 2.43 0.40 -0.18 -4.53 117.98 118.14 3fk4 s PHE 332 Ca 0.29 1.39 -0.26 0.00 -0.60 0.00 0.00 56.93 57.76 3fk4 s PHE 332 Cb -0.12 -3.33 -0.06 0.00 0.51 0.00 0.00 43.02 40.02 3fk4 s PHE 332 CO 0.22 -0.92 0.79 -1.12 0.70 0.00 0.00 175.22 174.89 3fk4 s SER 333 N 1.16 7.30 -0.49 1.36 0.01 -1.26 -1.76 113.70 120.01 3fk4 s SER 333 Ca 0.56 1.54 0.05 0.00 1.31 0.00 0.00 55.95 59.41 3fk4 s SER 333 Cb -0.25 -2.49 0.19 0.00 0.21 0.00 0.00 66.02 63.68 3fk4 s SER 333 CO 0.26 0.07 0.44 0.52 0.41 0.00 0.00 173.24 174.94 3fk4 n VAL 334 N 2.43 -0.19 -1.73 3.43 0.31 -0.64 -1.63 118.33 120.32 3fk4 n VAL 334 Ca -0.03 -4.00 -0.42 0.00 -0.01 0.00 0.00 64.34 59.88 3fk4 n VAL 334 Cb 0.50 -1.86 -0.02 0.00 -0.91 0.00 0.00 33.84 31.54 3fk4 n VAL 334 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3fk4 n PRO 335 N 2.22 2.67 -4.25 5.55 -0.02 -1.26 -2.39 135.00 137.52 3fk4 n PRO 335 Ca 0.26 0.95 -0.19 0.00 -2.02 0.00 0.00 63.50 62.51 3fk4 n PRO 335 Cb 0.45 -2.74 -0.11 0.00 -0.02 0.00 0.00 33.50 31.08 3fk4 n PRO 335 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3fk4 s SER 336 N 0.63 2.08 0.01 2.55 0.01 0.15 -4.18 113.70 114.94 3fk4 s SER 336 Ca 0.67 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 57.13 3fk4 s SER 336 Cb -0.51 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 65.64 3fk4 s SER 336 CO 0.45 -0.12 0.00 0.00 0.41 0.00 0.00 173.24 173.98 3fk4 n ALA 337 N 0.57 -1.31 -2.90 1.44 0.00 -1.26 -1.32 120.51 115.73 3fk4 n ALA 337 Ca -0.16 0.01 -0.17 0.00 0.00 0.00 0.00 53.44 53.12 3fk4 n ALA 337 Cb 0.57 -0.52 0.03 0.00 0.00 0.00 0.00 19.45 19.53 3fk4 n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fk4 n GLY 338 N -1.10 -0.22 3.24 0.00 0.00 -1.26 -4.51 105.19 101.34 3fk4 n GLY 338 Ca 0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 3fk4 n GLY 338 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fk4 s ILE 339 N -3.05 2.04 0.18 -0.61 1.01 -1.26 -4.84 121.20 114.67 3fk4 s ILE 339 Ca 0.26 -1.04 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 3fk4 s ILE 339 Cb -0.11 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 3fk4 s ILE 339 CO 0.32 0.56 0.14 -1.38 0.00 0.00 0.00 174.94 174.58 3fk4 s HIS 340 N 0.09 0.97 0.36 3.97 -3.43 -1.26 -4.82 115.29 111.16 3fk4 s HIS 340 Ca -0.11 -1.25 0.17 0.00 -0.80 0.00 0.00 55.06 53.06 3fk4 s HIS 340 Cb -0.16 -0.45 1.15 0.00 -1.43 0.00 0.00 32.58 31.69 3fk4 s HIS 340 CO 0.06 -0.63 1.65 -1.35 -2.00 0.00 0.00 174.74 172.48 3fk4 h PRO 341 N 2.67 0.26 0.00 -0.38 0.11 -1.93 -0.23 132.00 132.50 3fk4 h PRO 341 Ca -0.35 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.74 3fk4 h PRO 341 Cb 1.23 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3fk4 h PRO 341 CO 0.53 0.17 -0.01 0.78 -0.21 0.00 0.00 178.00 179.26 3fk4 h GLY 342 N 0.27 0.00 1.82 -0.55 0.00 -1.93 -2.28 103.07 100.41 3fk4 h GLY 342 Ca 0.75 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.08 3fk4 h GLY 342 CO -0.60 0.00 -0.03 0.69 0.00 0.00 0.00 176.54 176.60 3fk4 n PHE 343 N -4.41 0.00 -0.28 5.60 3.72 -0.10 -4.08 117.46 117.91 3fk4 n PHE 343 Ca -0.03 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.45 3fk4 n PHE 343 Cb 0.10 -0.43 0.23 0.00 -0.94 0.00 0.00 39.48 38.44 3fk4 n PHE 343 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3fk4 h VAL 344 N 0.02 0.63 -0.41 -4.37 2.07 -1.49 -0.48 116.25 112.21 3fk4 h VAL 344 Ca 0.00 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.37 3fk4 h VAL 344 Cb 0.45 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 3fk4 h VAL 344 CO 0.00 0.09 0.24 -0.65 0.02 0.00 0.00 177.57 177.27 3fk4 h PRO 345 N 0.49 0.47 -0.82 1.57 0.11 -1.81 -1.49 132.00 130.53 3fk4 h PRO 345 Ca 0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.54 3fk4 h PRO 345 Cb 0.75 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.72 3fk4 h PRO 345 CO -0.43 0.31 0.46 0.74 -0.21 0.00 0.00 178.00 178.87 3fk4 h PHE 346 N 0.49 1.12 -0.27 0.65 -1.00 -1.50 -1.83 116.94 114.60 3fk4 h PHE 346 Ca 0.16 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.91 3fk4 h PHE 346 Cb 0.01 -0.36 -0.01 0.00 3.61 0.00 0.00 35.95 39.19 3fk4 h PHE 346 CO -0.07 0.77 0.12 0.82 -1.61 0.00 0.00 178.31 178.34 3fk4 h ILE 347 N 1.14 1.16 -0.20 -0.55 2.04 -0.68 -0.34 117.51 120.07 3fk4 h ILE 347 Ca 0.29 -0.48 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 3fk4 h ILE 347 Cb 0.02 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 3fk4 h ILE 347 CO -0.05 0.16 -0.38 0.58 0.00 0.00 0.00 178.15 178.47 3fk4 h VAL 348 N 0.29 1.30 -0.21 1.67 2.07 -1.17 0.37 116.25 120.56 3fk4 h VAL 348 Ca 0.09 -1.50 -0.06 0.00 0.82 0.00 0.00 66.70 66.05 3fk4 h VAL 348 Cb 0.15 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3fk4 h VAL 348 CO -0.01 0.47 -0.10 0.08 0.02 0.00 0.00 177.57 178.03 3fk4 h ARG 349 N 0.38 0.44 -0.31 1.57 0.11 -1.19 0.21 114.38 115.59 3fk4 h ARG 349 Ca 0.04 -0.19 -0.16 0.00 0.10 0.00 0.00 59.98 59.77 3fk4 h ARG 349 Cb 0.84 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.90 3fk4 h ARG 349 CO 0.07 0.72 -0.42 -0.44 0.10 0.00 0.00 179.97 180.00 3fk4 h ASP 350 N 0.14 0.90 0.00 0.08 3.32 -0.91 -3.37 116.42 116.58 3fk4 h ASP 350 Ca 0.05 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3fk4 h ASP 350 Cb 0.59 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.88 3fk4 h ASP 350 CO 0.03 1.22 -0.83 0.49 -1.72 0.00 0.00 179.24 178.43 3fk4 n PHE 351 N -4.12 0.00 -0.66 4.55 3.72 0.13 -5.04 117.46 116.04 3fk4 n PHE 351 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 3fk4 n PHE 351 Cb 0.55 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 3fk4 n PHE 351 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fk4 n GLY 352 N 1.40 -2.87 0.10 1.37 0.00 0.74 -4.58 105.19 101.36 3fk4 n GLY 352 Ca 0.01 -1.82 -0.03 0.00 0.00 0.00 0.00 46.02 44.18 3fk4 n GLY 352 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fk4 h LYS 353 N 0.00 0.00 -3.41 1.61 1.57 -1.91 -3.37 116.57 111.06 3fk4 h LYS 353 Ca 0.00 0.00 -0.72 0.00 -1.87 0.00 0.00 60.65 58.06 3fk4 h LYS 353 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 3fk4 h LYS 353 CO 0.00 0.79 2.95 -0.25 -0.57 0.00 0.00 179.45 182.37 3fk4 n ASP 354 N -3.45 6.06 -4.13 0.86 8.00 -1.26 -3.10 116.55 119.53 3fk4 n ASP 354 Ca -0.00 -2.88 -0.09 0.00 0.71 0.00 0.00 54.79 52.53 3fk4 n ASP 354 Cb 0.80 -1.54 -0.10 0.00 -0.02 0.00 0.00 41.12 40.26 3fk4 n ASP 354 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3fk4 s VAL 355 N 1.59 0.39 -0.22 2.53 0.11 -1.26 -4.41 120.40 119.13 3fk4 s VAL 355 Ca 0.52 -1.87 -0.06 0.00 -2.93 0.00 0.00 61.98 57.65 3fk4 s VAL 355 Cb 0.15 -1.64 -0.02 0.00 -1.53 0.00 0.00 36.38 33.33 3fk4 s VAL 355 CO -0.06 -0.90 0.02 -0.69 -3.33 0.00 0.00 175.10 170.15 3fk4 s VAL 356 N -3.82 4.03 -0.36 2.04 1.01 -0.64 -1.30 120.40 121.36 3fk4 s VAL 356 Ca 0.11 -0.28 -0.28 0.00 0.00 0.00 0.00 61.98 61.53 3fk4 s VAL 356 Cb 0.07 -2.85 0.02 0.00 0.00 0.00 0.00 36.38 33.62 3fk4 s VAL 356 CO -0.07 0.39 1.02 -0.63 0.00 0.00 0.00 175.10 175.81 3fk4 s ILE 357 N 1.34 4.50 -0.59 2.22 -1.09 0.15 -4.32 121.20 123.40 3fk4 s ILE 357 Ca 0.04 1.44 -0.19 0.00 -2.23 0.00 0.00 60.65 59.71 3fk4 s ILE 357 Cb -0.15 -4.41 0.10 0.00 -1.58 0.00 0.00 42.46 36.42 3fk4 s ILE 357 CO 0.02 -0.58 0.73 0.21 -1.23 0.00 0.00 174.94 174.09 3fk4 s ASN 358 N 1.86 6.18 0.35 3.58 3.84 -1.26 -0.84 114.94 128.66 3fk4 s ASN 358 Ca 0.43 -1.34 0.27 0.00 0.21 0.00 0.00 52.86 52.43 3fk4 s ASN 358 Cb -0.11 -2.32 1.05 0.00 -0.55 0.00 0.00 41.25 39.32 3fk4 s ASN 358 CO 0.19 -1.14 1.80 0.00 -2.79 0.00 0.00 177.10 175.15 3fk4 h ALA 359 N 9.22 1.00 -0.84 1.71 0.00 -0.65 -3.43 119.26 126.27 3fk4 h ALA 359 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3fk4 h ALA 359 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3fk4 h ALA 359 CO 1.10 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.76 3fk4 n GLY 360 N 0.21 0.69 0.14 0.00 0.00 -1.25 -3.09 105.19 101.89 3fk4 n GLY 360 Ca 0.02 -0.79 0.13 0.00 0.00 0.00 0.00 46.02 45.39 3fk4 n GLY 360 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fk4 n GLY 361 N 0.00 -0.90 0.20 -0.02 0.00 -1.26 -0.93 105.19 102.27 3fk4 n GLY 361 Ca 0.00 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.84 3fk4 n GLY 361 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3fk4 h GLY 362 N 4.96 0.00 2.00 -0.02 0.00 -1.86 -2.86 103.07 105.29 3fk4 h GLY 362 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fk4 h GLY 362 CO 0.00 0.00 -0.01 1.19 0.00 0.00 0.00 176.54 177.72 3fk4 h ILE 363 N 0.00 0.92 0.00 2.60 2.10 -1.69 -0.80 117.51 120.65 3fk4 h ILE 363 Ca 0.00 -0.05 0.00 0.00 1.08 0.00 0.00 64.86 65.89 3fk4 h ILE 363 Cb 0.22 1.03 0.00 0.00 -1.09 0.00 0.00 36.82 36.98 3fk4 h ILE 363 CO 0.00 0.01 0.00 1.41 -1.08 0.00 0.00 178.15 178.49 3fk4 n HIS 364 N -4.40 0.28 0.93 2.19 8.25 -1.08 -3.10 115.22 118.29 3fk4 n HIS 364 Ca -0.03 0.09 0.13 0.00 -0.26 0.00 0.00 57.72 57.65 3fk4 n HIS 364 Cb 0.10 -0.65 0.39 0.00 1.12 0.00 0.00 29.99 30.95 3fk4 n HIS 364 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fk4 n GLY 365 N 0.77 -1.39 3.77 -1.41 0.00 -0.30 -4.51 105.19 102.12 3fk4 n GLY 365 Ca 0.05 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 3fk4 n GLY 365 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3fk4 s HIS 366 N -3.03 2.52 0.55 1.61 5.04 -1.18 -4.86 115.29 115.93 3fk4 s HIS 366 Ca 0.12 1.20 0.34 0.00 -1.54 0.00 0.00 55.06 55.18 3fk4 s HIS 366 Cb 0.17 -3.99 1.51 0.00 0.04 0.00 0.00 32.58 30.31 3fk4 s HIS 366 CO 0.63 -3.01 1.83 -1.00 -2.34 0.00 0.00 174.74 170.85 3fk4 h PRO 367 N 2.71 0.00 -0.85 2.88 0.13 -1.93 0.71 132.00 135.65 3fk4 h PRO 367 Ca -0.51 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.12 3fk4 h PRO 367 Cb 1.25 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.11 3fk4 h PRO 367 CO 0.63 0.00 0.46 0.09 -0.23 0.00 0.00 178.00 178.94 3fk4 n ASN 368 N -4.16 4.79 -0.77 1.44 3.02 -1.26 -5.06 115.26 113.25 3fk4 n ASN 368 Ca 0.22 -3.72 0.00 0.00 -0.03 0.00 0.00 54.58 51.05 3fk4 n ASN 368 Cb 1.11 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 3fk4 n ASN 368 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fk4 n GLY 369 N -1.04 -1.16 0.28 7.41 0.00 0.24 -1.95 105.19 108.98 3fk4 n GLY 369 Ca 0.54 -1.08 0.03 0.00 0.00 0.00 0.00 46.02 45.51 3fk4 n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fk4 h ALA 370 N -0.78 1.65 -0.44 4.61 0.00 -1.79 -1.36 119.26 121.16 3fk4 h ALA 370 Ca 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3fk4 h ALA 370 Cb 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3fk4 h ALA 370 CO 0.00 0.28 0.26 1.96 0.00 0.00 0.00 179.25 181.75 3fk4 h GLN 371 N 0.42 0.59 -0.38 0.00 4.20 -1.66 -0.00 115.11 118.28 3fk4 h GLN 371 Ca 0.11 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.61 3fk4 h GLN 371 Cb 0.08 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3fk4 h GLN 371 CO -0.01 0.44 -0.38 0.78 -0.67 0.00 0.00 178.83 178.99 3fk4 h GLY 372 N 0.58 0.99 1.01 3.46 0.00 -0.89 -2.46 103.07 105.76 3fk4 h GLY 372 Ca 0.16 -1.01 -0.03 0.00 0.00 0.00 0.00 47.33 46.45 3fk4 h GLY 372 CO -0.03 0.91 0.31 -1.33 0.00 0.00 0.00 176.54 176.40 3fk4 h GLY 373 N 0.81 1.08 1.18 4.60 0.00 -1.03 -1.10 103.07 108.61 3fk4 h GLY 373 Ca 0.06 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 3fk4 h GLY 373 CO 0.09 0.53 -0.01 -1.33 0.00 0.00 0.00 176.54 175.82 3fk4 h GLY 374 N 0.97 1.06 1.28 4.60 0.00 -0.94 -2.04 103.07 108.01 3fk4 h GLY 374 Ca 0.23 -0.77 -0.10 0.00 0.00 0.00 0.00 47.33 46.70 3fk4 h GLY 374 CO -0.03 0.71 -0.12 0.50 0.00 0.00 0.00 176.54 177.60 3fk4 h LYS 375 N 0.90 0.85 -0.37 4.80 1.57 -0.95 0.17 116.57 123.55 3fk4 h LYS 375 Ca 0.16 -0.30 0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3fk4 h LYS 375 Cb 0.54 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 3fk4 h LYS 375 CO 0.03 0.92 0.20 0.00 -0.57 0.00 0.00 179.45 180.04 3fk4 h ALA 376 N 1.10 0.46 -0.25 3.86 0.00 -0.92 0.12 119.26 123.63 3fk4 h ALA 376 Ca 0.12 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3fk4 h ALA 376 Cb 0.62 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3fk4 h ALA 376 CO 0.04 -0.15 0.01 0.74 0.00 0.00 0.00 179.25 179.89 3fk4 h PHE 377 N 0.42 0.46 -0.65 0.00 0.04 -1.07 -0.10 116.94 116.04 3fk4 h PHE 377 Ca 0.15 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 3fk4 h PHE 377 Cb 0.02 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.02 3fk4 h PHE 377 CO -0.08 0.58 0.37 0.00 -0.60 0.00 0.00 178.31 178.59 3fk4 h ARG 378 N 0.21 0.89 -0.34 1.51 2.47 -0.74 0.13 114.38 118.52 3fk4 h ARG 378 Ca 0.07 -0.09 -0.05 0.00 -1.26 0.00 0.00 59.98 58.65 3fk4 h ARG 378 Cb 0.39 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 3fk4 h ARG 378 CO 0.01 0.66 0.02 1.15 0.56 0.00 0.00 179.97 182.37 3fk4 h THR 379 N 0.88 1.25 -0.80 2.04 2.02 -0.72 -2.23 112.91 115.36 3fk4 h THR 379 Ca 0.23 -0.91 0.04 0.00 0.77 0.00 0.00 66.41 66.54 3fk4 h THR 379 Cb 0.01 1.19 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 3fk4 h THR 379 CO -0.04 0.30 0.50 0.00 0.37 0.00 0.00 175.52 176.65 3fk4 h ALA 380 N 0.87 1.06 0.07 6.16 0.00 -0.58 -1.02 119.26 125.83 3fk4 h ALA 380 Ca 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3fk4 h ALA 380 Cb 0.41 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3fk4 h ALA 380 CO 0.01 0.27 -0.04 0.82 0.00 0.00 0.00 179.25 180.32 3fk4 h ILE 381 N 0.94 0.97 -0.84 0.00 2.04 -0.51 -1.43 117.51 118.67 3fk4 h ILE 381 Ca 0.33 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 66.06 3fk4 h ILE 381 Cb 0.08 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 3fk4 h ILE 381 CO -0.14 0.03 0.52 0.44 0.00 0.00 0.00 178.15 179.00 3fk4 h ASP 382 N -0.16 1.00 -0.02 1.72 3.32 -1.03 -1.75 116.42 119.50 3fk4 h ASP 382 Ca -0.01 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3fk4 h ASP 382 Cb 0.13 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 3fk4 h ASP 382 CO 0.02 0.76 0.01 0.00 -1.72 0.00 0.00 179.24 178.31 3fk4 h ALA 383 N 1.41 0.03 -0.72 3.45 0.00 -1.02 -2.72 119.26 119.69 3fk4 h ALA 383 Ca 0.30 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.29 3fk4 h ALA 383 Cb -0.07 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.62 3fk4 h ALA 383 CO -0.06 -0.42 0.28 1.15 0.00 0.00 0.00 179.25 180.20 3fk4 h THR 384 N -0.07 0.68 0.00 0.00 2.02 -0.84 0.18 112.91 114.88 3fk4 h THR 384 Ca 0.01 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.04 3fk4 h THR 384 Cb 0.10 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 3fk4 h THR 384 CO -0.00 0.08 0.00 -0.07 0.37 0.00 0.00 175.52 175.90 3fk4 h LEU 385 N 0.44 0.00 -2.75 2.58 3.38 -1.06 -0.87 115.31 117.03 3fk4 h LEU 385 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 3fk4 h LEU 385 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3fk4 h LEU 385 CO -0.38 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.15 3fk4 n GLN 386 N -2.39 2.71 -1.47 1.13 6.02 0.51 -4.94 117.38 118.94 3fk4 n GLN 386 Ca 0.01 -2.24 -0.17 0.00 -0.01 0.00 0.00 57.00 54.59 3fk4 n GLN 386 Cb 0.18 -1.38 -0.07 0.00 1.02 0.00 0.00 30.24 29.99 3fk4 n GLN 386 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3fk4 n ASN 387 N 0.96 -5.41 -4.70 1.08 4.13 -0.33 -4.94 115.26 106.04 3fk4 n ASN 387 Ca 0.16 0.41 -0.40 0.00 1.68 0.00 0.00 54.58 56.43 3fk4 n ASN 387 Cb 0.50 -4.48 -0.05 0.00 -1.54 0.00 0.00 39.78 34.21 3fk4 n ASN 387 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3fk4 s LYS 388 N -3.39 4.39 0.61 3.52 1.02 -0.52 -4.99 119.74 120.38 3fk4 s LYS 388 Ca 0.00 0.88 -0.18 0.00 0.02 0.00 0.00 55.97 56.69 3fk4 s LYS 388 Cb 0.00 -3.49 -0.04 0.00 -0.52 0.00 0.00 37.83 33.78 3fk4 s LYS 388 CO 0.00 -0.05 0.96 -2.30 -0.92 0.00 0.00 175.35 173.05 3fk4 n PRO 389 N 4.20 0.86 0.03 -1.68 -0.02 -1.26 -4.15 135.00 132.97 3fk4 n PRO 389 Ca -0.00 0.34 -0.13 0.00 -2.02 0.00 0.00 63.50 61.68 3fk4 n PRO 389 Cb 0.51 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 3fk4 n PRO 389 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3fk4 h LEU 390 N 0.41 0.66 -1.31 2.45 4.07 -1.95 -3.20 115.31 116.44 3fk4 h LEU 390 Ca -0.49 -0.46 -0.00 0.00 0.08 0.00 0.00 57.88 57.02 3fk4 h LEU 390 Cb 1.37 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 42.91 3fk4 h LEU 390 CO 0.50 1.23 -0.01 1.12 -1.08 0.00 0.00 178.44 180.21 3fk4 h HIS 391 N 0.35 0.00 -0.46 1.13 2.07 -1.98 -2.48 115.15 113.79 3fk4 h HIS 391 Ca -0.05 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.47 3fk4 h HIS 391 Cb 1.42 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.40 3fk4 h HIS 391 CO 0.06 0.01 0.00 0.39 -3.07 0.00 0.00 177.93 175.32 3fk4 n GLU 392 N -3.10 2.13 -3.39 5.12 1.02 -1.21 -4.87 120.64 116.34 3fk4 n GLU 392 Ca 0.01 -1.67 -0.38 0.00 -0.02 0.00 0.00 57.16 55.10 3fk4 n GLU 392 Cb 0.33 -1.39 -0.07 0.00 -0.02 0.00 0.00 31.44 30.29 3fk4 n GLU 392 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3fk4 s VAL 393 N -1.42 5.20 -0.85 2.62 1.01 -0.93 -4.99 120.40 121.03 3fk4 s VAL 393 Ca 0.31 0.71 -0.22 0.00 0.00 0.00 0.00 61.98 62.78 3fk4 s VAL 393 Cb 0.16 -3.73 0.08 0.00 0.00 0.00 0.00 36.38 32.90 3fk4 s VAL 393 CO 0.20 0.26 1.18 -0.62 0.00 0.00 0.00 175.10 176.12 3fk4 s ASP 394 N 1.01 6.41 -0.29 3.32 2.15 -1.26 -4.78 116.67 123.23 3fk4 s ASP 394 Ca 0.19 -1.41 -0.06 0.00 0.43 0.00 0.00 52.55 51.70 3fk4 s ASP 394 Cb -0.15 -2.47 0.15 0.00 -0.30 0.00 0.00 42.92 40.16 3fk4 s ASP 394 CO 0.08 -1.38 0.61 -0.62 -0.17 0.00 0.00 175.17 173.69 3fk4 s ASP 395 N 4.00 -1.14 0.27 -0.34 -1.08 -1.26 -5.05 116.67 112.07 3fk4 s ASP 395 Ca 0.33 1.24 -0.00 0.00 -0.52 0.00 0.00 52.55 53.60 3fk4 s ASP 395 Cb -0.07 2.16 0.51 0.00 -1.46 0.00 0.00 42.92 44.06 3fk4 s ASP 395 CO -0.01 -0.24 1.84 0.16 0.52 0.00 0.00 175.17 177.44 3fk4 h ILE 396 N 6.02 0.93 0.26 4.11 3.07 -1.98 0.15 117.51 130.07 3fk4 h ILE 396 Ca -0.20 -0.34 -0.01 0.00 1.55 0.00 0.00 64.86 65.86 3fk4 h ILE 396 Cb 1.12 -0.13 0.00 0.00 -0.27 0.00 0.00 36.82 37.54 3fk4 h ILE 396 CO 0.17 0.18 -0.13 0.78 -1.05 0.00 0.00 178.15 178.10 3fk4 h ASN 397 N 0.98 -0.30 -0.51 2.16 -0.26 -1.97 -1.17 115.58 114.52 3fk4 h ASN 397 Ca 0.48 -0.16 -0.05 0.00 -0.56 0.00 0.00 56.30 56.01 3fk4 h ASN 397 Cb 0.44 0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.75 3fk4 h ASN 397 CO -0.25 -0.00 0.15 0.25 -1.06 0.00 0.00 177.43 176.52 3fk4 h LEU 398 N -0.61 0.79 0.58 1.61 5.85 -1.80 -2.11 115.31 119.62 3fk4 h LEU 398 Ca -0.04 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 3fk4 h LEU 398 Cb 0.44 -0.21 0.01 0.00 0.37 0.00 0.00 40.66 41.27 3fk4 h LEU 398 CO 0.06 0.76 -0.28 -0.74 -0.34 0.00 0.00 178.44 177.91 3fk4 h HIS 399 N 0.82 -0.72 -0.03 1.25 2.76 -0.66 -1.69 115.15 116.89 3fk4 h HIS 399 Ca 0.18 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.34 3fk4 h HIS 399 Cb 0.27 0.24 -0.00 0.00 1.55 0.00 0.00 27.41 29.47 3fk4 h HIS 399 CO 0.02 -0.40 0.04 0.66 -1.30 0.00 0.00 177.93 176.94 3fk4 h SER 400 N -0.90 0.00 0.04 3.26 4.64 -1.15 -0.85 113.55 118.59 3fk4 h SER 400 Ca -0.08 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3fk4 h SER 400 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3fk4 h SER 400 CO 0.13 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 176.07 3fk4 h ALA 401 N 1.95 -0.05 0.00 5.18 0.00 -1.00 -1.69 119.26 123.66 3fk4 h ALA 401 Ca 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3fk4 h ALA 401 Cb 0.08 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3fk4 h ALA 401 CO -0.00 -0.27 -0.10 -0.07 0.00 0.00 0.00 179.25 178.80 3fk4 h LEU 402 N -0.56 0.00 0.07 0.00 3.38 -0.41 0.08 115.31 117.87 3fk4 h LEU 402 Ca -0.01 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.69 3fk4 h LEU 402 Cb 0.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.27 3fk4 h LEU 402 CO 0.01 0.10 -1.20 -0.61 0.09 0.00 0.00 178.44 176.83 3fk4 h GLN 403 N 0.00 0.37 0.09 1.13 5.75 -1.07 -1.61 115.11 119.77 3fk4 h GLN 403 Ca -0.00 -0.55 -0.34 0.00 -0.15 0.00 0.00 58.65 57.60 3fk4 h GLN 403 Cb 0.28 0.19 -0.03 0.00 1.07 0.00 0.00 27.48 29.00 3fk4 h GLN 403 CO 0.01 1.24 -1.90 -0.89 -2.65 0.00 0.00 178.83 174.64 3fk4 n ILE 404 N -3.63 1.73 -0.09 2.39 5.41 -0.65 -4.51 119.36 120.01 3fk4 n ILE 404 Ca -0.10 -0.70 -0.12 0.00 1.00 0.00 0.00 62.75 62.83 3fk4 n ILE 404 Cb 0.99 -1.51 -0.15 0.00 -0.71 0.00 0.00 39.64 38.26 3fk4 n ILE 404 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 3fk4 n TRP 405 N -3.34 0.19 0.00 1.39 5.03 -0.01 -5.10 117.44 115.60 3fk4 n TRP 405 Ca -0.27 0.06 0.00 0.00 3.03 0.00 0.00 57.50 60.33 3fk4 n TRP 405 Cb 1.05 -1.03 0.00 0.00 -1.03 0.00 0.00 31.31 30.30 3fk4 n TRP 405 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07