#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qf5 h ASN 2 N 0.00 0.50 -3.24 1.61 2.35 -1.86 -3.34 115.58 111.61 1qf5 h ASN 2 Ca 0.00 -0.54 -0.74 0.00 -0.55 0.00 0.00 56.30 54.47 1qf5 h ASN 2 Cb 0.00 -0.16 -0.26 0.00 0.05 0.00 0.00 38.32 37.95 1qf5 h ASN 2 CO 0.00 1.42 -0.32 0.20 -1.65 0.00 0.00 177.43 177.08 1qf5 s ASN 3 N -7.23 5.98 -0.12 5.81 0.02 -1.26 -0.55 114.94 117.59 1qf5 s ASN 3 Ca -0.05 -1.68 -0.02 0.00 -1.02 0.00 0.00 52.86 50.08 1qf5 s ASN 3 Cb 0.06 -2.12 -0.03 0.00 0.02 0.00 0.00 41.25 39.18 1qf5 s ASN 3 CO 0.90 -0.73 -0.03 -0.69 0.02 0.00 0.00 177.10 176.57 1qf5 s VAL 4 N 1.52 4.00 -0.16 1.60 1.01 -0.02 -2.07 120.40 126.29 1qf5 s VAL 4 Ca 0.04 -0.34 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 1qf5 s VAL 4 Cb -0.27 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 1qf5 s VAL 4 CO 0.03 0.55 -0.07 -0.69 0.00 0.00 0.00 175.10 174.91 1qf5 s VAL 5 N -0.25 3.47 -0.20 2.92 1.01 -0.23 -0.30 120.40 126.82 1qf5 s VAL 5 Ca 0.05 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 1qf5 s VAL 5 Cb -0.13 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.75 1qf5 s VAL 5 CO 0.02 0.49 -0.11 -0.69 0.00 0.00 0.00 175.10 174.82 1qf5 s VAL 6 N 0.55 2.82 0.13 2.92 1.01 0.24 0.33 120.40 128.40 1qf5 s VAL 6 Ca -0.05 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.17 1qf5 s VAL 6 Cb -0.15 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 1qf5 s VAL 6 CO 0.03 0.47 0.23 -1.48 0.00 0.00 0.00 175.10 174.35 1qf5 s LEU 7 N 1.36 1.22 -0.06 3.92 0.05 -0.92 0.14 118.68 124.40 1qf5 s LEU 7 Ca 0.05 -0.83 -0.25 0.00 0.05 0.00 0.00 54.13 53.15 1qf5 s LEU 7 Cb -0.14 1.04 -0.03 0.00 -2.05 0.00 0.00 46.19 45.01 1qf5 s LEU 7 CO -0.07 -0.82 0.76 -0.83 -0.55 0.00 0.00 176.35 174.85 1qf5 s GLY 8 N -2.94 2.64 0.00 -3.48 0.00 -1.26 0.32 107.32 102.61 1qf5 s GLY 8 Ca 0.13 0.21 0.27 0.00 0.00 0.00 0.00 44.72 45.33 1qf5 s GLY 8 CO -0.04 1.31 1.63 -1.30 0.00 0.00 0.00 173.10 174.71 1qf5 n THR 9 N 3.87 0.00 0.00 0.90 -2.24 -0.86 -1.08 114.28 114.87 1qf5 n THR 9 Ca 0.01 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1qf5 n THR 9 Cb 0.51 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1qf5 n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qf5 n GLN 10 N -1.39 0.00 -0.96 -0.78 6.02 -1.26 -4.46 117.38 114.55 1qf5 n GLN 10 Ca 0.07 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.07 1qf5 n GLN 10 Cb 0.33 0.00 0.16 0.00 1.02 0.00 0.00 30.24 31.75 1qf5 n GLN 10 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1qf5 n TRP 11 N 0.00 0.48 0.00 1.08 8.01 -1.26 -1.69 117.44 124.05 1qf5 n TRP 11 Ca 0.00 -1.54 0.00 0.00 -1.31 0.00 0.00 57.50 54.65 1qf5 n TRP 11 Cb 0.00 -0.26 0.00 0.00 -2.01 0.00 0.00 31.31 29.04 1qf5 n TRP 11 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1qf5 n GLY 12 N -0.90 -0.25 2.48 6.99 0.00 -1.25 -4.48 105.19 107.78 1qf5 n GLY 12 Ca 0.22 -1.76 -0.17 0.00 0.00 0.00 0.00 46.02 44.31 1qf5 n GLY 12 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qf5 n ASP 13 N -1.20 -5.00 0.09 1.61 8.00 -1.26 -4.85 116.55 113.93 1qf5 n ASP 13 Ca 0.00 0.05 0.13 0.00 0.71 0.00 0.00 54.79 55.68 1qf5 n ASP 13 Cb 0.00 -4.19 0.43 0.00 -0.02 0.00 0.00 41.12 37.35 1qf5 n ASP 13 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1qf5 n GLU 14 N -3.00 0.23 0.00 -1.24 4.71 -1.26 -4.88 120.64 115.20 1qf5 n GLU 14 Ca -0.19 0.19 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1qf5 n GLU 14 Cb 0.65 -1.77 0.00 0.00 -1.01 0.00 0.00 31.44 29.31 1qf5 n GLU 14 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1qf5 n GLY 15 N 1.33 1.41 0.15 0.62 0.00 -1.26 -4.50 105.19 102.94 1qf5 n GLY 15 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 1qf5 n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qf5 h LYS 16 N 0.00 0.41 -0.48 1.61 1.57 -1.95 -3.10 116.57 114.63 1qf5 h LYS 16 Ca 0.00 -0.14 0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1qf5 h LYS 16 Cb 0.00 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.21 1qf5 h LYS 16 CO 0.00 0.61 0.12 0.78 -0.57 0.00 0.00 179.45 180.39 1qf5 h GLY 17 N 0.16 0.60 0.90 3.86 0.00 -1.91 -0.36 103.07 106.32 1qf5 h GLY 17 Ca 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.35 1qf5 h GLY 17 CO 0.01 -0.04 -0.05 1.70 0.00 0.00 0.00 176.54 178.16 1qf5 h LYS 18 N 0.26 -0.10 -0.65 4.80 3.64 -1.62 -1.50 116.57 121.40 1qf5 h LYS 18 Ca 0.24 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1qf5 h LYS 18 Cb 0.29 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1qf5 h LYS 18 CO -0.29 -0.07 0.42 0.82 -2.27 0.00 0.00 179.45 178.06 1qf5 h ILE 19 N -0.11 1.17 0.29 2.00 1.08 -1.39 -1.06 117.51 119.50 1qf5 h ILE 19 Ca 0.01 -0.35 -0.01 0.00 -0.39 0.00 0.00 64.86 64.12 1qf5 h ILE 19 Cb 0.12 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 34.10 1qf5 h ILE 19 CO -0.03 0.17 -0.14 0.58 -0.69 0.00 0.00 178.15 178.04 1qf5 h VAL 20 N 0.89 0.74 -0.56 1.67 2.07 -0.67 -0.15 116.25 120.24 1qf5 h VAL 20 Ca 0.24 -0.36 0.09 0.00 0.82 0.00 0.00 66.70 67.48 1qf5 h VAL 20 Cb -0.08 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 30.57 1qf5 h VAL 20 CO -0.05 0.08 0.19 -0.78 0.02 0.00 0.00 177.57 177.03 1qf5 h ASP 21 N -0.59 0.17 -0.53 0.57 3.58 -1.09 -0.07 116.42 118.47 1qf5 h ASP 21 Ca -0.04 0.08 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 1qf5 h ASP 21 Cb 0.43 0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.52 1qf5 h ASP 21 CO 0.07 0.11 0.23 0.25 -2.88 0.00 0.00 179.24 177.02 1qf5 h LEU 22 N 0.36 0.71 0.00 2.28 6.46 -1.11 -3.11 115.31 120.90 1qf5 h LEU 22 Ca 0.28 -0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.89 1qf5 h LEU 22 Cb 0.34 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.09 1qf5 h LEU 22 CO -0.30 0.66 -0.14 -0.07 -0.62 0.00 0.00 178.44 177.97 1qf5 h LEU 23 N 0.71 0.00 -0.46 2.25 3.38 -0.52 -3.33 115.31 117.34 1qf5 h LEU 23 Ca 0.18 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1qf5 h LEU 23 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1qf5 h LEU 23 CO -0.02 0.01 0.00 0.35 0.09 0.00 0.00 178.44 178.88 1qf5 n THR 24 N -2.51 0.00 -0.07 0.22 -2.24 -0.09 -3.29 114.28 106.31 1qf5 n THR 24 Ca 0.04 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.77 1qf5 n THR 24 Cb 0.47 -0.24 0.14 0.00 -2.10 0.00 0.00 70.33 68.60 1qf5 n THR 24 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1qf5 h GLU 25 N 0.07 0.72 -0.57 -0.78 4.81 -1.74 -2.97 114.58 114.11 1qf5 h GLU 25 Ca 0.00 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1qf5 h GLU 25 Cb 0.20 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.52 1qf5 h GLU 25 CO 0.00 0.83 0.00 0.54 -0.73 0.00 0.00 179.01 179.65 1qf5 n ARG 26 N -4.15 3.07 -3.99 1.92 1.74 -1.21 -5.00 116.66 109.03 1qf5 n ARG 26 Ca 0.01 -2.57 -0.29 0.00 -0.77 0.00 0.00 57.85 54.23 1qf5 n ARG 26 Cb 0.38 -1.59 -0.05 0.00 -1.02 0.00 0.00 32.46 30.18 1qf5 n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1qf5 s ALA 27 N -1.36 3.79 -0.17 7.54 0.00 -1.12 -4.65 121.76 125.79 1qf5 s ALA 27 Ca 0.42 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.40 1qf5 s ALA 27 Cb 0.24 -1.62 -0.22 0.00 0.00 0.00 0.00 23.12 21.53 1qf5 s ALA 27 CO 0.24 0.69 0.15 1.17 0.00 0.00 0.00 175.76 178.02 1qf5 n LYS 28 N 0.08 0.70 -4.20 0.00 3.00 0.19 -4.48 118.16 113.45 1qf5 n LYS 28 Ca -0.07 0.19 -0.18 0.00 -0.00 0.00 0.00 58.31 58.25 1qf5 n LYS 28 Cb 0.52 -1.63 -0.12 0.00 0.00 0.00 0.00 35.03 33.81 1qf5 n LYS 28 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1qf5 s TYR 29 N -2.54 1.30 -0.06 5.64 2.02 -1.04 -0.92 117.35 121.75 1qf5 s TYR 29 Ca -0.23 -0.49 -0.00 0.00 -0.37 0.00 0.00 57.07 55.98 1qf5 s TYR 29 Cb 0.08 -0.71 0.03 0.00 -0.40 0.00 0.00 41.96 40.95 1qf5 s TYR 29 CO 0.72 0.09 -0.02 0.54 -1.57 0.00 0.00 175.55 175.31 1qf5 s VAL 30 N -1.53 0.42 -0.13 0.71 0.11 -1.03 -0.88 120.40 118.08 1qf5 s VAL 30 Ca 0.02 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.10 1qf5 s VAL 30 Cb -0.08 -0.52 0.01 0.00 -1.53 0.00 0.00 36.38 34.26 1qf5 s VAL 30 CO 0.02 0.23 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.14 1qf5 s VAL 31 N 1.40 1.85 -0.04 2.04 1.01 0.16 -0.89 120.40 125.93 1qf5 s VAL 31 Ca -0.04 -0.85 -0.19 0.00 0.00 0.00 0.00 61.98 60.90 1qf5 s VAL 31 Cb -0.13 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.55 1qf5 s VAL 31 CO -0.03 0.51 0.55 -0.13 0.00 0.00 0.00 175.10 176.00 1qf5 s ARG 32 N 0.86 4.29 0.00 2.72 1.81 -0.55 -0.42 118.95 127.66 1qf5 s ARG 32 Ca -0.07 0.63 0.00 0.00 -1.72 0.00 0.00 55.73 54.56 1qf5 s ARG 32 Cb -0.15 -3.37 0.00 0.00 -0.45 0.00 0.00 34.95 30.98 1qf5 s ARG 32 CO -0.01 0.32 0.35 2.48 -0.68 0.00 0.00 175.30 177.75 1qf5 n TYR 33 N 2.99 0.00 -3.76 -0.53 4.11 -1.26 -0.30 117.16 118.41 1qf5 n TYR 33 Ca -0.07 0.00 -0.05 0.00 -0.00 0.00 0.00 57.90 57.78 1qf5 n TYR 33 Cb 0.51 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.84 1qf5 n TYR 33 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.86 178.00 1qf5 s GLN 34 N -0.27 1.37 1.05 -3.48 1.03 -1.26 -3.69 119.66 114.41 1qf5 s GLN 34 Ca 0.00 -0.74 0.00 0.00 0.04 0.00 0.00 55.36 54.66 1qf5 s GLN 34 Cb 0.00 0.48 0.00 0.00 0.03 0.00 0.00 33.01 33.52 1qf5 s GLN 34 CO 0.00 -0.63 0.00 0.41 -2.54 0.00 0.00 175.29 172.53 1qf5 n GLY 35 N -0.45 -1.90 0.00 2.60 0.00 -1.26 -4.61 105.19 99.57 1qf5 n GLY 35 Ca -0.06 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.45 1qf5 n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qf5 n GLY 36 N 0.00 3.78 1.13 -0.02 0.00 -1.26 -2.06 105.19 106.76 1qf5 n GLY 36 Ca 0.00 -0.22 0.05 0.00 0.00 0.00 0.00 46.02 45.85 1qf5 n GLY 36 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1qf5 n HIS 37 N 0.00 0.99 0.26 1.61 1.44 -1.26 -3.65 115.22 114.61 1qf5 n HIS 37 Ca 0.00 -0.37 0.13 0.00 -2.01 0.00 0.00 57.72 55.47 1qf5 n HIS 37 Cb 0.00 -0.23 0.31 0.00 0.12 0.00 0.00 29.99 30.19 1qf5 n HIS 37 CO 0.00 0.00 0.00 -2.95 -2.81 0.00 0.00 176.34 170.58 1qf5 h ASN 38 N 2.33 0.00 -3.93 4.39 -1.07 -1.95 -3.45 115.58 111.89 1qf5 h ASN 38 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 56.30 55.89 1qf5 h ASN 38 Cb 1.10 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 37.36 1qf5 h ASN 38 CO 0.19 0.00 0.41 0.00 0.07 0.00 0.00 177.43 178.10 1qf5 s ALA 39 N -3.31 3.14 -0.26 4.14 0.00 -1.24 -4.77 121.76 119.46 1qf5 s ALA 39 Ca 0.06 0.68 -0.04 0.00 0.00 0.00 0.00 51.96 52.67 1qf5 s ALA 39 Cb 0.06 -3.26 0.10 0.00 0.00 0.00 0.00 23.12 20.02 1qf5 s ALA 39 CO 0.63 -0.13 0.15 0.20 0.00 0.00 0.00 175.76 176.61 1qf5 s GLY 40 N -1.51 0.35 -0.27 0.00 0.00 -1.26 -4.25 107.32 100.38 1qf5 s GLY 40 Ca 0.55 -0.77 -0.05 0.00 0.00 0.00 0.00 44.72 44.45 1qf5 s GLY 40 CO 0.28 2.09 0.03 0.30 0.00 0.00 0.00 173.10 175.80 1qf5 s HIS 41 N 2.15 3.09 -0.08 1.90 3.76 -0.76 -4.79 115.29 120.57 1qf5 s HIS 41 Ca 0.08 -1.02 -0.18 0.00 -0.15 0.00 0.00 55.06 53.79 1qf5 s HIS 41 Cb -0.16 -2.19 -0.05 0.00 1.11 0.00 0.00 32.58 31.29 1qf5 s HIS 41 CO -0.30 -0.58 0.48 0.99 -0.85 0.00 0.00 174.74 174.48 1qf5 s THR 42 N 1.48 5.11 -0.04 1.30 2.01 -1.26 -1.80 115.64 122.44 1qf5 s THR 42 Ca 0.03 0.97 0.06 0.00 0.31 0.00 0.00 61.69 63.06 1qf5 s THR 42 Cb -0.16 -3.81 -0.01 0.00 0.01 0.00 0.00 72.50 68.53 1qf5 s THR 42 CO 0.00 0.39 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.35 1qf5 s LEU 43 N 0.15 2.02 -0.24 4.42 1.43 0.17 -3.51 118.68 123.11 1qf5 s LEU 43 Ca 0.26 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1qf5 s LEU 43 Cb -0.16 -1.18 0.07 0.00 0.03 0.00 0.00 46.19 44.96 1qf5 s LEU 43 CO 0.12 0.23 0.04 -0.69 0.23 0.00 0.00 176.35 176.27 1qf5 s VAL 44 N -0.23 0.87 -0.25 -1.59 1.01 -1.26 0.48 120.40 119.44 1qf5 s VAL 44 Ca 0.01 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1qf5 s VAL 44 Cb -0.11 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.85 1qf5 s VAL 44 CO 0.02 -0.35 -0.01 -0.63 0.00 0.00 0.00 175.10 174.13 1qf5 s ILE 45 N 1.67 3.40 -1.57 2.22 1.09 -0.15 -1.17 121.20 126.69 1qf5 s ILE 45 Ca 0.02 -0.68 -0.15 0.00 -1.10 0.00 0.00 60.65 58.74 1qf5 s ILE 45 Cb -0.18 -2.65 0.10 0.00 -1.06 0.00 0.00 42.46 38.67 1qf5 s ILE 45 CO -0.13 0.27 0.91 0.59 -0.10 0.00 0.00 174.94 176.48 1qf5 n ASN 46 N 4.78 -4.21 0.00 3.58 4.13 -1.26 -1.12 115.26 121.16 1qf5 n ASN 46 Ca -0.17 -0.85 0.00 0.00 1.68 0.00 0.00 54.58 55.24 1qf5 n ASN 46 Cb 0.49 -3.56 0.00 0.00 -1.54 0.00 0.00 39.78 35.17 1qf5 n ASN 46 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1qf5 n GLY 47 N -1.62 2.95 3.71 7.41 0.00 -1.26 -5.01 105.19 111.36 1qf5 n GLY 47 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1qf5 n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qf5 s GLU 48 N -0.32 4.53 -0.21 1.61 2.12 -0.27 -5.03 118.70 121.12 1qf5 s GLU 48 Ca 0.00 1.48 -0.07 0.00 0.36 0.00 0.00 54.97 56.74 1qf5 s GLU 48 Cb 0.00 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 1qf5 s GLU 48 CO 0.00 -0.11 0.06 0.21 -0.54 0.00 0.00 175.26 174.88 1qf5 s LYS 49 N 1.10 3.83 -0.09 4.30 2.20 -1.26 -0.98 119.74 128.84 1qf5 s LYS 49 Ca 0.53 -0.41 0.04 0.00 -0.36 0.00 0.00 55.97 55.77 1qf5 s LYS 49 Cb -0.22 -3.24 -0.00 0.00 -1.51 0.00 0.00 37.83 32.85 1qf5 s LYS 49 CO 0.27 0.09 -0.24 0.99 -0.36 0.00 0.00 175.35 176.11 1qf5 s THR 50 N 0.86 2.11 -0.26 3.43 2.01 0.18 -4.97 115.64 119.00 1qf5 s THR 50 Ca 0.03 -1.01 0.03 0.00 0.31 0.00 0.00 61.69 61.05 1qf5 s THR 50 Cb -0.14 -1.80 0.06 0.00 0.01 0.00 0.00 72.50 70.64 1qf5 s THR 50 CO 0.02 0.56 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.72 1qf5 s VAL 51 N 0.19 2.21 0.31 3.82 1.01 -1.26 0.45 120.40 127.12 1qf5 s VAL 51 Ca -0.14 -1.65 0.02 0.00 0.00 0.00 0.00 61.98 60.21 1qf5 s VAL 51 Cb -0.17 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 1qf5 s VAL 51 CO 0.07 -0.05 0.49 -0.76 0.00 0.00 0.00 175.10 174.85 1qf5 s LEU 52 N 1.10 4.11 0.00 3.92 1.43 -0.75 -4.93 118.68 123.56 1qf5 s LEU 52 Ca -0.08 0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 1qf5 s LEU 52 Cb -0.20 -3.18 0.00 0.00 0.03 0.00 0.00 46.19 42.84 1qf5 s LEU 52 CO -0.05 -0.22 0.00 1.41 0.23 0.00 0.00 176.35 177.72 1qf5 n HIS 53 N -1.64 0.00 -0.06 0.29 8.25 -1.26 -1.83 115.22 118.96 1qf5 n HIS 53 Ca -0.06 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.32 1qf5 n HIS 53 Cb 0.56 0.29 -0.07 0.00 1.12 0.00 0.00 29.99 31.89 1qf5 n HIS 53 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1qf5 n LEU 54 N -2.62 2.12 -4.70 2.41 7.94 -1.26 -4.39 117.00 116.49 1qf5 n LEU 54 Ca 0.00 -0.05 -0.42 0.00 -1.11 0.00 0.00 56.01 54.43 1qf5 n LEU 54 Cb 0.19 -0.25 -0.03 0.00 0.53 0.00 0.00 43.42 43.86 1qf5 n LEU 54 CO 0.00 0.58 0.91 -0.63 -1.11 0.00 0.00 177.39 177.14 1qf5 s ILE 55 N -2.25 4.17 0.47 1.96 1.01 -1.26 -4.98 121.20 120.32 1qf5 s ILE 55 Ca -0.14 1.54 -0.22 0.00 0.00 0.00 0.00 60.65 61.83 1qf5 s ILE 55 Cb 0.04 -3.99 -0.10 0.00 0.01 0.00 0.00 42.46 38.42 1qf5 s ILE 55 CO 0.33 0.06 0.78 -2.65 0.00 0.00 0.00 174.94 173.46 1qf5 n PRO 56 N 4.56 0.90 0.00 2.79 -0.02 -1.26 -4.83 135.00 137.14 1qf5 n PRO 56 Ca 0.10 0.33 0.04 0.00 -2.02 0.00 0.00 63.50 61.95 1qf5 n PRO 56 Cb 0.46 -1.83 0.22 0.00 -0.02 0.00 0.00 33.50 32.33 1qf5 n PRO 56 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1qf5 n SER 57 N 0.59 0.00 -1.35 2.55 7.64 -1.26 -2.17 113.62 119.62 1qf5 n SER 57 Ca 0.11 -0.45 0.11 0.00 1.01 0.00 0.00 58.87 59.65 1qf5 n SER 57 Cb 0.42 0.00 0.32 0.00 -1.01 0.00 0.00 64.21 63.94 1qf5 n SER 57 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qf5 n GLY 58 N -0.27 2.38 0.29 0.23 0.00 -1.26 -4.00 105.19 102.57 1qf5 n GLY 58 Ca 0.06 -0.78 0.16 0.00 0.00 0.00 0.00 46.02 45.46 1qf5 n GLY 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1qf5 h ILE 59 N 4.17 0.36 0.00 -0.61 6.09 -1.79 -2.63 117.51 123.10 1qf5 h ILE 59 Ca 0.00 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 1qf5 h ILE 59 Cb 1.01 1.20 0.00 0.00 0.47 0.00 0.00 36.82 39.50 1qf5 h ILE 59 CO 0.03 0.05 -0.07 0.18 -3.07 0.00 0.00 178.15 175.27 1qf5 n LEU 60 N -3.50 0.39 -4.74 2.19 4.77 -1.26 -4.81 117.00 110.04 1qf5 n LEU 60 Ca -0.02 0.48 -0.35 0.00 -0.03 0.00 0.00 56.01 56.09 1qf5 n LEU 60 Cb 0.17 -0.40 -0.08 0.00 -2.33 0.00 0.00 43.42 40.79 1qf5 n LEU 60 CO 0.27 -0.07 -0.15 -0.13 -1.33 0.00 0.00 177.39 175.98 1qf5 s ARG 61 N -3.05 4.15 0.43 3.23 0.52 -0.99 -4.99 118.95 118.25 1qf5 s ARG 61 Ca 0.12 -0.16 0.23 0.00 -0.52 0.00 0.00 55.73 55.41 1qf5 s ARG 61 Cb 0.16 -3.40 0.84 0.00 0.52 0.00 0.00 34.95 33.06 1qf5 s ARG 61 CO 0.58 0.32 1.79 1.05 0.02 0.00 0.00 175.30 179.06 1qf5 h GLU 62 N 6.55 0.00 -0.00 3.54 4.11 -1.87 -3.04 114.58 123.87 1qf5 h GLU 62 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.01 1qf5 h GLU 62 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1qf5 h GLU 62 CO 0.75 0.23 -0.10 0.27 0.07 0.00 0.00 179.01 180.23 1qf5 n ASN 63 N -3.35 0.13 -4.65 3.06 6.94 -1.26 -4.85 115.26 111.28 1qf5 n ASN 63 Ca 0.00 0.19 -0.34 0.00 -0.02 0.00 0.00 54.58 54.41 1qf5 n ASN 63 Cb 0.46 -0.30 -0.10 0.00 -2.36 0.00 0.00 39.78 37.48 1qf5 n ASN 63 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1qf5 s VAL 64 N -2.90 4.08 -0.29 3.53 1.01 -1.15 -4.68 120.40 120.00 1qf5 s VAL 64 Ca 0.17 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.67 1qf5 s VAL 64 Cb 0.19 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 1qf5 s VAL 64 CO 0.55 0.57 0.17 -0.89 0.00 0.00 0.00 175.10 175.50 1qf5 s THR 65 N -0.88 4.94 0.05 3.92 2.01 -0.10 -4.91 115.64 120.67 1qf5 s THR 65 Ca 0.14 -0.12 -0.24 0.00 0.31 0.00 0.00 61.69 61.78 1qf5 s THR 65 Cb -0.11 -3.43 -0.06 0.00 0.01 0.00 0.00 72.50 68.92 1qf5 s THR 65 CO 0.03 0.17 0.72 -0.44 -0.69 0.00 0.00 174.62 174.41 1qf5 s SER 66 N 1.69 7.17 -0.03 3.53 0.01 -0.04 -2.46 113.70 123.57 1qf5 s SER 66 Ca 0.06 1.40 0.03 0.00 1.31 0.00 0.00 55.95 58.75 1qf5 s SER 66 Cb -0.16 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1qf5 s SER 66 CO 0.08 0.06 -0.11 -0.63 0.41 0.00 0.00 173.24 173.05 1qf5 s ILE 67 N -0.21 0.94 -0.44 1.44 1.01 -0.07 -1.14 121.20 122.73 1qf5 s ILE 67 Ca 0.36 -0.43 -0.12 0.00 0.00 0.00 0.00 60.65 60.46 1qf5 s ILE 67 Cb -0.20 -0.83 0.07 0.00 0.01 0.00 0.00 42.46 41.51 1qf5 s ILE 67 CO 0.22 0.29 0.32 -0.63 0.00 0.00 0.00 174.94 175.14 1qf5 s ILE 68 N 0.25 4.70 1.01 2.92 1.01 -0.93 -1.48 121.20 128.68 1qf5 s ILE 68 Ca -0.05 -1.23 -0.12 0.00 0.00 0.00 0.00 60.65 59.24 1qf5 s ILE 68 Cb -0.10 -3.84 0.19 0.00 0.01 0.00 0.00 42.46 38.72 1qf5 s ILE 68 CO 0.01 -0.54 1.09 -0.83 0.00 0.00 0.00 174.94 174.68 1qf5 s GLY 69 N 2.34 1.56 0.66 6.18 0.00 0.59 -1.98 107.32 116.66 1qf5 s GLY 69 Ca 0.03 -0.38 0.43 0.00 0.00 0.00 0.00 44.72 44.80 1qf5 s GLY 69 CO 0.04 0.24 2.35 3.45 0.00 0.00 0.00 173.10 179.18 1qf5 h ASN 70 N -1.93 0.00 0.85 1.64 -1.07 -1.79 -2.26 115.58 111.02 1qf5 h ASN 70 Ca -0.55 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 55.80 1qf5 h ASN 70 Cb 1.33 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.58 1qf5 h ASN 70 CO 0.58 0.00 -0.12 1.23 0.07 0.00 0.00 177.43 179.19 1qf5 h GLY 71 N 0.00 0.00 -3.99 9.14 0.00 -1.48 -3.37 103.07 103.37 1qf5 h GLY 71 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1qf5 h GLY 71 CO -0.00 0.00 0.44 0.14 0.00 0.00 0.00 176.54 177.12 1qf5 s VAL 72 N -3.75 3.95 -0.35 4.60 1.01 -0.85 -4.21 120.40 120.79 1qf5 s VAL 72 Ca 0.00 1.75 -0.15 0.00 0.00 0.00 0.00 61.98 63.58 1qf5 s VAL 72 Cb 0.10 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 1qf5 s VAL 72 CO 0.59 0.33 0.36 0.68 0.00 0.00 0.00 175.10 177.06 1qf5 s VAL 73 N -0.49 5.17 -0.19 2.92 -7.23 -0.88 -3.66 120.40 116.04 1qf5 s VAL 73 Ca 0.47 -0.05 -0.17 0.00 -1.81 0.00 0.00 61.98 60.42 1qf5 s VAL 73 Cb -0.28 -3.84 -0.04 0.00 0.56 0.00 0.00 36.38 32.78 1qf5 s VAL 73 CO 0.34 -0.13 0.46 -0.22 -0.31 0.00 0.00 175.10 175.25 1qf5 s LEU 74 N 1.99 4.16 -0.41 1.32 0.20 0.11 -4.47 118.68 121.58 1qf5 s LEU 74 Ca 0.11 0.62 -0.16 0.00 0.69 0.00 0.00 54.13 55.39 1qf5 s LEU 74 Cb -0.17 -2.62 0.02 0.00 -0.43 0.00 0.00 46.19 42.98 1qf5 s LEU 74 CO 0.12 -0.12 0.39 -0.55 -0.29 0.00 0.00 176.35 175.90 1qf5 s SER 75 N 1.06 6.17 0.47 3.68 0.15 -1.26 -0.80 113.70 123.17 1qf5 s SER 75 Ca 0.22 -0.66 0.16 0.00 0.70 0.00 0.00 55.95 56.37 1qf5 s SER 75 Cb -0.15 -2.20 1.14 0.00 -1.71 0.00 0.00 66.02 63.10 1qf5 s SER 75 CO 0.09 -0.51 2.02 -0.65 1.20 0.00 0.00 173.24 175.39 1qf5 h PRO 76 N 8.67 0.25 -0.01 5.44 0.11 -1.98 -0.92 132.00 143.55 1qf5 h PRO 76 Ca -0.27 -0.01 -0.26 0.00 0.11 0.00 0.00 66.00 65.57 1qf5 h PRO 76 Cb 1.12 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 32.19 1qf5 h PRO 76 CO 0.76 0.16 -1.01 0.00 -0.21 0.00 0.00 178.00 177.70 1qf5 h ALA 77 N 1.76 0.17 -0.50 -0.75 0.00 -1.92 -2.60 119.26 115.42 1qf5 h ALA 77 Ca 0.22 -0.69 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 1qf5 h ALA 77 Cb 0.52 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1qf5 h ALA 77 CO -0.04 0.70 -0.02 0.00 0.00 0.00 0.00 179.25 179.89 1qf5 h ALA 78 N 0.46 0.68 -0.22 0.00 0.00 -1.81 -2.85 119.26 115.53 1qf5 h ALA 78 Ca -0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1qf5 h ALA 78 Cb 1.66 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 1qf5 h ALA 78 CO 0.20 0.51 0.10 1.25 0.00 0.00 0.00 179.25 181.31 1qf5 h LEU 79 N 0.77 0.29 -0.67 0.00 5.85 -1.22 -2.09 115.31 118.24 1qf5 h LEU 79 Ca 0.14 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1qf5 h LEU 79 Cb 0.55 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1qf5 h LEU 79 CO 0.03 0.35 0.42 0.24 -0.34 0.00 0.00 178.44 179.14 1qf5 h MET 80 N 0.22 0.81 -0.46 1.25 2.86 -1.48 0.18 114.93 118.31 1qf5 h MET 80 Ca 0.07 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.59 1qf5 h MET 80 Cb 0.13 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1qf5 h MET 80 CO -0.01 0.54 -0.03 -0.22 1.06 0.00 0.00 176.91 178.24 1qf5 h LYS 81 N 0.83 0.79 -0.10 1.72 3.64 -1.40 -1.15 116.57 120.89 1qf5 h LYS 81 Ca 0.27 -0.23 -0.22 0.00 -1.27 0.00 0.00 60.65 59.20 1qf5 h LYS 81 Cb 0.00 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1qf5 h LYS 81 CO -0.10 0.82 -0.78 1.49 -2.27 0.00 0.00 179.45 178.61 1qf5 h GLU 82 N 0.73 0.71 -0.49 1.90 4.81 -1.01 -2.76 114.58 118.45 1qf5 h GLU 82 Ca 0.14 -0.62 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1qf5 h GLU 82 Cb 0.49 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 1qf5 h GLU 82 CO 0.03 1.23 0.30 1.98 -0.73 0.00 0.00 179.01 181.81 1qf5 h MET 83 N 0.39 0.67 0.86 1.92 4.05 -0.52 -2.47 114.93 119.83 1qf5 h MET 83 Ca -0.07 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.25 1qf5 h MET 83 Cb 1.42 -0.14 0.01 0.00 -0.80 0.00 0.00 31.60 32.09 1qf5 h MET 83 CO 0.16 0.49 -0.41 -0.22 0.23 0.00 0.00 176.91 177.15 1qf5 h LYS 84 N 0.66 -1.11 -0.80 0.39 1.63 -1.24 -0.52 116.57 115.58 1qf5 h LYS 84 Ca 0.18 0.08 0.19 0.00 -0.85 0.00 0.00 60.65 60.24 1qf5 h LYS 84 Cb -0.01 0.25 -0.05 0.00 -0.60 0.00 0.00 32.23 31.82 1qf5 h LYS 84 CO -0.03 -0.74 0.55 0.93 -3.45 0.00 0.00 179.45 176.70 1qf5 h GLU 85 N -1.16 0.26 0.14 1.90 5.08 -1.48 -0.58 114.58 118.73 1qf5 h GLU 85 Ca -0.12 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 57.98 1qf5 h GLU 85 Cb 0.88 -0.06 0.03 0.00 0.50 0.00 0.00 28.75 30.10 1qf5 h GLU 85 CO 0.19 0.17 -1.04 -0.07 -1.00 0.00 0.00 179.01 177.26 1qf5 h LEU 86 N 0.27 0.68 -1.69 1.33 3.38 -1.29 -3.24 115.31 114.74 1qf5 h LEU 86 Ca 0.40 -0.88 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 1qf5 h LEU 86 Cb 1.16 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1qf5 h LEU 86 CO -0.10 1.50 -0.08 -0.33 0.09 0.00 0.00 178.44 179.51 1qf5 h GLU 87 N -0.04 0.09 0.00 1.13 5.08 0.13 -0.54 114.58 120.43 1qf5 h GLU 87 Ca -0.17 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1qf5 h GLU 87 Cb 1.78 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.02 1qf5 h GLU 87 CO 0.20 0.18 0.00 -0.44 -1.00 0.00 0.00 179.01 177.95 1qf5 h ASP 88 N 0.09 0.00 -0.59 1.42 3.32 -1.22 -2.66 116.42 116.77 1qf5 h ASP 88 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1qf5 h ASP 88 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1qf5 h ASP 88 CO 0.01 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.07 1qf5 n ARG 89 N -3.01 3.98 -1.01 3.56 1.74 -0.27 -4.93 116.66 116.72 1qf5 n ARG 89 Ca 0.01 -2.80 -0.00 0.00 -0.77 0.00 0.00 57.85 54.28 1qf5 n ARG 89 Cb 0.31 -1.99 -0.00 0.00 -1.02 0.00 0.00 32.46 29.76 1qf5 n ARG 89 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qf5 n GLY 90 N 0.93 0.43 3.47 -0.13 0.00 -1.00 -5.03 105.19 103.86 1qf5 n GLY 90 Ca 0.25 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 1qf5 n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qf5 s ILE 91 N -2.01 5.11 -1.32 -0.61 -1.09 -0.83 -5.00 121.20 115.46 1qf5 s ILE 91 Ca 0.00 -0.53 -0.17 0.00 -2.23 0.00 0.00 60.65 57.72 1qf5 s ILE 91 Cb 0.00 -3.76 0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1qf5 s ILE 91 CO 0.00 -0.17 1.92 -0.81 -1.23 0.00 0.00 174.94 174.65 1qf5 n PRO 92 N 5.10 2.88 -0.05 2.79 -0.04 -1.26 -3.50 135.00 140.92 1qf5 n PRO 92 Ca -0.12 -2.93 -0.14 0.00 -0.04 0.00 0.00 63.50 60.27 1qf5 n PRO 92 Cb 0.48 -3.42 -0.09 0.00 -0.04 0.00 0.00 33.50 30.43 1qf5 n PRO 92 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1qf5 h VAL 93 N 5.07 0.04 -0.25 0.52 2.07 -1.91 -1.50 116.25 120.30 1qf5 h VAL 93 Ca 0.47 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.06 1qf5 h VAL 93 Cb 0.79 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1qf5 h VAL 93 CO 1.60 0.00 0.45 0.03 0.02 0.00 0.00 177.57 179.67 1qf5 h ARG 94 N -0.50 0.00 0.00 1.57 3.08 -1.89 0.21 114.38 116.85 1qf5 h ARG 94 Ca 0.06 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.02 1qf5 h ARG 94 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1qf5 h ARG 94 CO -0.48 0.00 -0.48 0.93 -1.07 0.00 0.00 179.97 178.87 1qf5 h GLU 95 N 0.00 0.00 0.00 0.04 5.08 -1.67 -3.38 114.58 114.65 1qf5 h GLU 95 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1qf5 h GLU 95 Cb 1.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1qf5 h GLU 95 CO -0.00 0.45 0.00 2.89 -1.00 0.00 0.00 179.01 181.35 1qf5 n ARG 96 N -3.21 0.37 -3.91 2.33 1.85 0.56 -5.03 116.66 109.63 1qf5 n ARG 96 Ca 0.02 -0.41 -0.35 0.00 -1.00 0.00 0.00 57.85 56.11 1qf5 n ARG 96 Cb 0.72 -0.91 -0.10 0.00 -1.05 0.00 0.00 32.46 31.12 1qf5 n ARG 96 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1qf5 s LEU 97 N -0.34 3.77 0.26 2.89 2.96 -0.10 -0.86 118.68 127.27 1qf5 s LEU 97 Ca 0.00 0.02 0.10 0.00 -0.22 0.00 0.00 54.13 54.03 1qf5 s LEU 97 Cb 0.00 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 1qf5 s LEU 97 CO 0.00 0.11 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.22 1qf5 s LEU 98 N 0.75 2.59 0.12 -0.68 1.43 -0.29 -4.85 118.68 117.75 1qf5 s LEU 98 Ca 0.04 -1.05 -0.13 0.00 -1.03 0.00 0.00 54.13 51.96 1qf5 s LEU 98 Cb -0.13 -0.93 0.02 0.00 0.03 0.00 0.00 46.19 45.17 1qf5 s LEU 98 CO 0.02 -0.07 0.32 -1.48 0.23 0.00 0.00 176.35 175.38 1qf5 s LEU 99 N -3.45 0.78 0.10 1.79 0.05 -0.36 -2.19 118.68 115.40 1qf5 s LEU 99 Ca 0.28 -0.48 -0.24 0.00 0.05 0.00 0.00 54.13 53.75 1qf5 s LEU 99 Cb -0.03 1.53 -0.07 0.00 -2.05 0.00 0.00 46.19 45.58 1qf5 s LEU 99 CO 0.12 -0.82 0.72 -0.55 -0.55 0.00 0.00 176.35 175.27 1qf5 s SER 100 N -2.84 7.25 0.07 1.48 0.15 -0.84 -1.93 113.70 117.05 1qf5 s SER 100 Ca 0.05 1.48 0.25 0.00 0.70 0.00 0.00 55.95 58.43 1qf5 s SER 100 Cb 0.03 -2.45 1.00 0.00 -1.71 0.00 0.00 66.02 62.89 1qf5 s SER 100 CO -0.11 0.17 1.79 -1.84 1.20 0.00 0.00 173.24 174.45 1qf5 n GLU 101 N 2.01 0.08 0.00 5.44 0.28 -1.26 -2.61 120.64 124.58 1qf5 n GLU 101 Ca -0.06 0.13 0.14 0.00 -0.16 0.00 0.00 57.16 57.22 1qf5 n GLU 101 Cb 0.50 -1.60 0.58 0.00 1.43 0.00 0.00 31.44 32.35 1qf5 n GLU 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1qf5 n ALA 102 N -1.59 2.75 -2.12 -1.84 0.00 -1.26 -0.89 120.51 115.56 1qf5 n ALA 102 Ca 0.06 -0.35 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 1qf5 n ALA 102 Cb 0.32 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 1qf5 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qf5 s PRO 104 N 1.51 3.67 0.01 0.00 0.04 -1.24 -1.28 135.00 137.70 1qf5 s PRO 104 Ca 0.66 1.22 -0.13 0.00 0.04 0.00 0.00 61.00 62.79 1qf5 s PRO 104 Cb -0.37 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.03 1qf5 s PRO 104 CO 0.30 -0.52 0.39 -0.51 0.04 0.00 0.00 177.00 176.70 1qf5 s LEU 105 N -3.95 4.45 -0.32 -3.56 1.43 0.14 0.04 118.68 116.91 1qf5 s LEU 105 Ca 0.64 0.91 -0.10 0.00 -1.03 0.00 0.00 54.13 54.55 1qf5 s LEU 105 Cb -0.15 -2.62 -0.00 0.00 0.03 0.00 0.00 46.19 43.45 1qf5 s LEU 105 CO 0.28 0.31 0.17 -0.63 0.23 0.00 0.00 176.35 176.70 1qf5 s ILE 106 N -1.13 4.68 0.51 -0.59 1.01 0.02 -4.81 121.20 120.89 1qf5 s ILE 106 Ca 0.25 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.47 1qf5 s ILE 106 Cb -0.16 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.92 1qf5 s ILE 106 CO 0.14 0.01 0.23 0.18 0.00 0.00 0.00 174.94 175.50 1qf5 n LEU 107 N 5.00 0.00 -0.31 2.97 4.77 -1.26 -4.27 117.00 123.90 1qf5 n LEU 107 Ca -0.13 -2.89 0.06 0.00 -0.03 0.00 0.00 56.01 53.01 1qf5 n LEU 107 Cb 0.49 0.12 0.21 0.00 -2.33 0.00 0.00 43.42 41.90 1qf5 n LEU 107 CO 0.35 -0.52 1.16 0.44 -1.33 0.00 0.00 177.39 177.48 1qf5 h ASP 108 N 0.86 0.71 0.14 -1.43 3.32 -1.98 -1.97 116.42 116.07 1qf5 h ASP 108 Ca -0.37 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 1qf5 h ASP 108 Cb 1.23 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1qf5 h ASP 108 CO 0.59 0.37 -0.10 0.10 -1.72 0.00 0.00 179.24 178.47 1qf5 h TYR 109 N 0.80 0.00 -0.47 4.55 -0.00 -1.97 -1.83 116.97 118.05 1qf5 h TYR 109 Ca 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 59.14 1qf5 h TYR 109 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.21 1qf5 h TYR 109 CO -0.05 0.10 0.13 0.45 -0.00 0.00 0.00 178.16 178.79 1qf5 h HIS 110 N 0.00 0.78 -0.51 0.10 3.86 -1.70 0.11 115.15 117.78 1qf5 h HIS 110 Ca -0.00 -0.09 -0.12 0.00 -1.16 0.00 0.00 60.37 59.00 1qf5 h HIS 110 Cb 0.20 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1qf5 h HIS 110 CO 0.00 0.70 -0.14 0.28 0.86 0.00 0.00 177.93 179.62 1qf5 h VAL 111 N 0.63 1.27 0.01 2.45 2.07 -1.46 -1.25 116.25 119.96 1qf5 h VAL 111 Ca 0.15 -1.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 1qf5 h VAL 111 Cb 0.30 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1qf5 h VAL 111 CO -0.00 0.45 -0.00 0.00 0.02 0.00 0.00 177.57 178.04 1qf5 h ALA 112 N 0.96 -0.01 -0.99 1.67 0.00 -1.12 -1.89 119.26 117.88 1qf5 h ALA 112 Ca 0.13 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1qf5 h ALA 112 Cb 0.71 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1qf5 h ALA 112 CO 0.05 -0.47 0.65 -0.07 0.00 0.00 0.00 179.25 179.41 1qf5 h LEU 113 N -0.08 1.10 0.06 0.00 3.38 -0.71 -0.89 115.31 118.18 1qf5 h LEU 113 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1qf5 h LEU 113 Cb 0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1qf5 h LEU 113 CO 0.00 0.77 -0.07 -0.78 0.09 0.00 0.00 178.44 178.45 1qf5 h ASP 114 N 1.28 -0.18 -0.62 -0.43 1.82 -0.91 -0.22 116.42 117.16 1qf5 h ASP 114 Ca 0.38 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 57.02 1qf5 h ASP 114 Cb -0.05 0.07 -0.03 0.00 0.68 0.00 0.00 39.33 40.00 1qf5 h ASP 114 CO -0.11 -0.11 0.32 0.78 -1.61 0.00 0.00 179.24 178.51 1qf5 h ASN 115 N -0.15 0.80 0.10 2.28 -0.26 -1.01 -2.06 115.58 115.28 1qf5 h ASN 115 Ca 0.01 -0.12 -0.00 0.00 -0.56 0.00 0.00 56.30 55.62 1qf5 h ASN 115 Cb 0.15 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1qf5 h ASN 115 CO -0.03 0.69 -0.05 0.00 -1.06 0.00 0.00 177.43 176.99 1qf5 h ALA 116 N 1.14 -0.13 -0.86 -0.83 0.00 -0.96 -1.86 119.26 115.76 1qf5 h ALA 116 Ca 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1qf5 h ALA 116 Cb 0.09 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1qf5 h ALA 116 CO -0.03 -0.54 0.51 0.00 0.00 0.00 0.00 179.25 179.18 1qf5 h ARG 117 N -0.19 1.17 -0.20 0.00 3.08 -0.93 -1.15 114.38 116.15 1qf5 h ARG 117 Ca -0.01 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 1qf5 h ARG 117 Cb 0.15 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1qf5 h ARG 117 CO 0.02 0.82 -0.24 0.93 -1.07 0.00 0.00 179.97 180.44 1qf5 h GLU 118 N 1.18 0.37 -0.02 0.04 4.39 -1.30 -1.27 114.58 117.98 1qf5 h GLU 118 Ca 0.31 -0.13 -0.19 0.00 0.34 0.00 0.00 59.36 59.69 1qf5 h GLU 118 Cb -0.04 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1qf5 h GLU 118 CO -0.06 0.59 -0.81 1.57 -1.16 0.00 0.00 179.01 179.14 1qf5 h LYS 119 N 0.33 0.25 0.00 2.33 2.10 -0.80 -3.01 116.57 117.77 1qf5 h LYS 119 Ca 0.05 -0.24 -0.08 0.00 -2.00 0.00 0.00 60.65 58.38 1qf5 h LYS 119 Cb 0.60 0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.98 1qf5 h LYS 119 CO 0.04 0.93 -0.39 0.00 -2.00 0.00 0.00 179.45 178.03 1qf5 h ALA 120 N 0.99 1.05 -0.04 0.07 0.00 -0.87 -2.90 119.26 117.57 1qf5 h ALA 120 Ca -0.04 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.37 1qf5 h ALA 120 Cb 1.41 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1qf5 h ALA 120 CO 0.13 0.49 -0.65 0.00 0.00 0.00 0.00 179.25 179.22 1qf5 h ARG 121 N 0.00 0.14 0.00 0.00 3.08 -1.13 -3.48 114.38 112.99 1qf5 h ARG 121 Ca -0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1qf5 h ARG 121 Cb 0.86 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1qf5 h ARG 121 CO 0.05 0.74 0.00 0.41 -1.07 0.00 0.00 179.97 180.10 1qf5 n GLY 122 N 0.35 3.17 0.17 0.04 0.00 -1.10 -1.86 105.19 105.96 1qf5 n GLY 122 Ca -0.02 0.19 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1qf5 n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qf5 h ALA 123 N -0.90 1.11 -0.11 4.61 0.00 -1.92 -2.84 119.26 119.22 1qf5 h ALA 123 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1qf5 h ALA 123 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1qf5 h ALA 123 CO 0.00 0.64 0.00 1.63 0.00 0.00 0.00 179.25 181.52 1qf5 n LYS 124 N -3.95 1.73 -1.80 0.00 4.01 -0.77 -4.92 118.16 112.46 1qf5 n LYS 124 Ca -0.02 -0.59 -0.41 0.00 -0.51 0.00 0.00 58.31 56.78 1qf5 n LYS 124 Cb 0.53 -1.63 -0.01 0.00 -0.51 0.00 0.00 35.03 33.41 1qf5 n LYS 124 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1qf5 s ALA 125 N -1.35 3.70 0.16 7.82 0.00 -1.07 -4.92 121.76 126.09 1qf5 s ALA 125 Ca 0.10 1.56 -0.10 0.00 0.00 0.00 0.00 51.96 53.52 1qf5 s ALA 125 Cb 0.08 -3.63 -0.00 0.00 0.00 0.00 0.00 23.12 19.56 1qf5 s ALA 125 CO 0.03 -0.99 1.51 0.82 0.00 0.00 0.00 175.76 177.14 1qf5 h ILE 126 N 3.30 1.27 -0.82 0.00 2.04 -1.91 -3.43 117.51 117.96 1qf5 h ILE 126 Ca -0.48 -1.49 0.00 0.00 1.00 0.00 0.00 64.86 63.89 1qf5 h ILE 126 Cb 1.22 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 1qf5 h ILE 126 CO 0.76 0.50 0.00 0.61 0.00 0.00 0.00 178.15 180.02 1qf5 n GLY 127 N 0.03 0.57 3.64 5.37 0.00 -1.26 -1.69 105.19 111.85 1qf5 n GLY 127 Ca -0.01 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 1qf5 n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qf5 s THR 128 N -2.02 1.98 -2.15 2.61 -4.23 -1.26 -4.66 115.64 105.91 1qf5 s THR 128 Ca 0.00 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.76 1qf5 s THR 128 Cb 0.00 -2.43 0.65 0.00 1.34 0.00 0.00 72.50 72.06 1qf5 s THR 128 CO 0.00 0.00 1.86 0.35 -0.54 0.00 0.00 174.62 176.29 1qf5 n THR 129 N -4.36 0.04 -2.21 3.99 -2.24 -1.26 -4.92 114.28 103.32 1qf5 n THR 129 Ca 0.05 -0.11 -0.20 0.00 -2.27 0.00 0.00 64.05 61.51 1qf5 n THR 129 Cb 0.57 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 1qf5 n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qf5 n GLY 130 N 1.00 0.05 1.30 3.38 0.00 -1.26 -4.90 105.19 104.76 1qf5 n GLY 130 Ca 0.19 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1qf5 n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qf5 n ARG 131 N -2.83 2.64 -1.16 1.61 5.12 -1.26 -4.89 116.66 115.89 1qf5 n ARG 131 Ca -0.23 -2.54 -0.05 0.00 -1.93 0.00 0.00 57.85 53.09 1qf5 n ARG 131 Cb 0.68 -1.55 -0.02 0.00 -1.16 0.00 0.00 32.46 30.40 1qf5 n ARG 131 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1qf5 n GLY 132 N 1.62 0.80 0.44 -0.13 0.00 -1.26 -4.71 105.19 101.96 1qf5 n GLY 132 Ca 0.23 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 1qf5 n GLY 132 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1qf5 h ILE 133 N 0.00 0.10 -0.18 -0.61 1.08 -1.93 -2.64 117.51 113.34 1qf5 h ILE 133 Ca -0.11 -0.12 0.05 0.00 -0.39 0.00 0.00 64.86 64.29 1qf5 h ILE 133 Cb 0.39 0.12 -0.07 0.00 -3.07 0.00 0.00 36.82 34.19 1qf5 h ILE 133 CO 0.16 0.01 -0.31 1.23 -0.69 0.00 0.00 178.15 178.55 1qf5 h GLY 134 N -1.21 -0.38 0.71 5.37 0.00 -1.94 -2.14 103.07 103.47 1qf5 h GLY 134 Ca -0.11 0.38 0.10 0.00 0.00 0.00 0.00 47.33 47.70 1qf5 h GLY 134 CO 0.19 -0.21 0.58 -2.55 0.00 0.00 0.00 176.54 174.54 1qf5 h PRO 135 N -0.36 0.89 -0.42 4.80 0.11 -1.85 -1.72 132.00 133.45 1qf5 h PRO 135 Ca 0.11 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.09 1qf5 h PRO 135 Cb 0.53 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 1qf5 h PRO 135 CO -0.38 0.59 -0.05 0.00 -0.21 0.00 0.00 178.00 177.95 1qf5 h ALA 136 N 1.55 1.13 -0.03 -0.75 0.00 -1.02 -1.86 119.26 118.28 1qf5 h ALA 136 Ca 0.42 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 1qf5 h ALA 136 Cb 0.40 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1qf5 h ALA 136 CO -0.18 0.55 -0.57 1.88 0.00 0.00 0.00 179.25 180.93 1qf5 h TYR 137 N 0.66 0.14 -0.16 0.00 0.05 -0.77 -2.91 116.97 113.96 1qf5 h TYR 137 Ca 0.12 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.82 1qf5 h TYR 137 Cb 0.48 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 1qf5 h TYR 137 CO 0.02 0.65 -0.01 0.93 -1.05 0.00 0.00 178.16 178.70 1qf5 h GLU 138 N 0.08 0.30 -0.45 4.88 5.08 -0.99 -2.00 114.58 121.49 1qf5 h GLU 138 Ca -0.00 -0.10 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1qf5 h GLU 138 Cb 1.03 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 1qf5 h GLU 138 CO 0.08 0.54 0.30 -0.44 -1.00 0.00 0.00 179.01 178.49 1qf5 h ASP 139 N 0.03 0.44 0.54 1.42 5.19 -1.35 0.23 116.42 122.91 1qf5 h ASP 139 Ca 0.04 -0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.42 1qf5 h ASP 139 Cb 0.41 -0.10 0.01 0.00 0.18 0.00 0.00 39.33 39.83 1qf5 h ASP 139 CO 0.01 0.31 -0.26 0.50 -3.12 0.00 0.00 179.24 176.68 1qf5 h LYS 140 N 0.51 -0.70 -0.48 3.56 3.64 -1.33 0.41 116.57 122.18 1qf5 h LYS 140 Ca 0.18 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1qf5 h LYS 140 Cb 0.08 0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 1qf5 h LYS 140 CO -0.04 -0.39 0.30 0.28 -2.27 0.00 0.00 179.45 177.33 1qf5 h VAL 141 N -1.02 1.13 0.00 2.00 2.07 -1.08 0.09 116.25 119.45 1qf5 h VAL 141 Ca -0.07 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1qf5 h VAL 141 Cb 0.63 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1qf5 h VAL 141 CO 0.12 0.14 0.00 0.00 0.02 0.00 0.00 177.57 177.85 1qf5 n ALA 142 N -2.46 2.14 -2.21 1.67 0.00 0.77 -4.90 120.51 115.52 1qf5 n ALA 142 Ca 0.04 -0.10 -0.19 0.00 0.00 0.00 0.00 53.44 53.20 1qf5 n ALA 142 Cb 0.07 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.12 1qf5 n ALA 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1qf5 n ARG 143 N -1.37 -1.45 -0.00 0.00 1.74 0.02 -4.85 116.66 110.75 1qf5 n ARG 143 Ca 0.09 0.95 0.03 0.00 -0.77 0.00 0.00 57.85 58.14 1qf5 n ARG 143 Cb 0.22 -5.44 -0.03 0.00 -1.02 0.00 0.00 32.46 26.19 1qf5 n ARG 143 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1qf5 n ARG 144 N -2.73 4.73 -2.03 5.56 1.85 -0.28 -5.03 116.66 118.73 1qf5 n ARG 144 Ca -0.21 -0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.31 1qf5 n ARG 144 Cb 0.66 -0.80 0.01 0.00 -1.05 0.00 0.00 32.46 31.28 1qf5 n ARG 144 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1qf5 s GLY 145 N -1.63 2.10 0.15 2.89 0.00 -0.02 -4.88 107.32 105.93 1qf5 s GLY 145 Ca 0.02 0.38 -0.14 0.00 0.00 0.00 0.00 44.72 44.97 1qf5 s GLY 145 CO 0.23 0.69 0.56 1.08 0.00 0.00 0.00 173.10 175.66 1qf5 s LEU 146 N -4.54 4.33 0.34 0.66 1.43 -1.26 -4.91 118.68 114.74 1qf5 s LEU 146 Ca 0.63 1.09 0.07 0.00 -1.03 0.00 0.00 54.13 54.89 1qf5 s LEU 146 Cb -0.16 -3.29 -0.07 0.00 0.03 0.00 0.00 46.19 42.70 1qf5 s LEU 146 CO 0.38 0.10 -0.02 -0.13 0.23 0.00 0.00 176.35 176.90 1qf5 s ARG 147 N -1.98 1.76 0.36 1.70 0.52 -1.26 -0.68 118.95 119.37 1qf5 s ARG 147 Ca 0.38 -1.95 0.10 0.00 -0.52 0.00 0.00 55.73 53.74 1qf5 s ARG 147 Cb -0.15 -1.38 0.84 0.00 0.52 0.00 0.00 34.95 34.78 1qf5 s ARG 147 CO 0.19 -0.01 1.87 0.28 0.02 0.00 0.00 175.30 177.65 1qf5 h VAL 148 N 2.03 0.83 -0.04 3.52 2.07 -1.07 -1.25 116.25 122.33 1qf5 h VAL 148 Ca -0.42 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1qf5 h VAL 148 Cb 1.24 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1qf5 h VAL 148 CO 0.73 0.12 0.04 1.23 0.02 0.00 0.00 177.57 179.71 1qf5 h GLY 149 N 0.67 0.00 2.00 2.17 0.00 -1.31 -2.15 103.07 104.45 1qf5 h GLY 149 Ca 0.44 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.72 1qf5 h GLY 149 CO -0.20 0.00 -0.25 -0.55 0.00 0.00 0.00 176.54 175.54 1qf5 h ASP 150 N 0.00 0.00 0.16 0.19 3.32 -1.51 -2.72 116.42 115.87 1qf5 h ASP 150 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1qf5 h ASP 150 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1qf5 h ASP 150 CO -0.00 0.25 0.00 -0.07 -1.72 0.00 0.00 179.24 177.70 1qf5 h LEU 151 N 0.00 0.00 -2.00 1.55 3.38 -1.52 -2.83 115.31 113.90 1qf5 h LEU 151 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1qf5 h LEU 151 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1qf5 h LEU 151 CO 0.03 0.00 -0.10 -0.26 0.09 0.00 0.00 178.44 178.20 1qf5 h PHE 152 N 0.00 0.00 -3.22 1.13 -1.00 -1.65 -3.33 116.94 108.87 1qf5 h PHE 152 Ca 0.00 0.00 -0.62 0.00 2.81 0.00 0.00 57.97 60.16 1qf5 h PHE 152 Cb 0.08 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 39.24 1qf5 h PHE 152 CO 0.00 0.10 -0.71 0.34 -1.61 0.00 0.00 178.31 176.43 1qf5 s ASP 153 N -6.23 4.04 0.56 2.17 -1.08 -1.07 -4.99 116.67 110.07 1qf5 s ASP 153 Ca -0.03 -2.53 0.23 0.00 -0.52 0.00 0.00 52.55 49.70 1qf5 s ASP 153 Cb 0.14 -1.26 1.55 0.00 -1.46 0.00 0.00 42.92 41.88 1qf5 s ASP 153 CO 0.59 -0.29 2.18 0.11 0.52 0.00 0.00 175.17 178.27 1qf5 h LYS 154 N 6.98 0.00 0.45 4.34 1.57 -1.80 -0.90 116.57 127.22 1qf5 h LYS 154 Ca -0.05 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1qf5 h LYS 154 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1qf5 h LYS 154 CO 0.54 0.00 -0.22 0.93 -0.57 0.00 0.00 179.45 180.13 1qf5 h GLU 155 N 0.00 -0.59 0.00 3.15 4.39 -1.94 -2.98 114.58 116.62 1qf5 h GLU 155 Ca 0.03 0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 1qf5 h GLU 155 Cb 0.12 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1qf5 h GLU 155 CO -0.00 -0.29 -0.12 1.79 -1.16 0.00 0.00 179.01 179.23 1qf5 h THR 156 N -1.00 0.34 -0.40 1.13 1.35 -1.90 -2.81 112.91 109.63 1qf5 h THR 156 Ca -0.06 -0.75 -0.10 0.00 -0.55 0.00 0.00 66.41 64.95 1qf5 h THR 156 Cb 0.57 1.56 -0.02 0.00 -1.73 0.00 0.00 68.15 68.54 1qf5 h THR 156 CO 0.10 0.12 -0.16 0.15 -0.25 0.00 0.00 175.52 175.48 1qf5 h PHE 157 N 0.00 0.83 -0.19 4.73 3.57 -1.18 -0.47 116.94 124.22 1qf5 h PHE 157 Ca -0.00 -0.16 -0.11 0.00 3.53 0.00 0.00 57.97 61.22 1qf5 h PHE 157 Cb 0.55 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1qf5 h PHE 157 CO 0.00 0.85 -0.37 0.00 -2.23 0.00 0.00 178.31 176.57 1qf5 h ALA 158 N 1.16 1.01 0.04 2.41 0.00 -1.34 -0.67 119.26 121.88 1qf5 h ALA 158 Ca 0.11 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1qf5 h ALA 158 Cb 0.64 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1qf5 h ALA 158 CO 0.04 0.60 -0.02 0.93 0.00 0.00 0.00 179.25 180.81 1qf5 h GLU 159 N 0.35 -0.06 -0.28 0.00 5.08 -1.35 -2.12 114.58 116.20 1qf5 h GLU 159 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1qf5 h GLU 159 Cb 0.81 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1qf5 h GLU 159 CO 0.07 0.31 0.18 0.87 -1.00 0.00 0.00 179.01 179.43 1qf5 h LYS 160 N -0.43 0.37 -0.94 2.33 1.57 -1.05 -2.69 116.57 115.73 1qf5 h LYS 160 Ca -0.01 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1qf5 h LYS 160 Cb 0.39 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.57 1qf5 h LYS 160 CO 0.01 0.27 0.56 1.25 -0.57 0.00 0.00 179.45 180.97 1qf5 h LEU 161 N 0.36 1.14 -0.07 2.94 5.85 -1.17 -2.44 115.31 121.92 1qf5 h LEU 161 Ca 0.10 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.78 1qf5 h LEU 161 Cb -0.01 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 1qf5 h LEU 161 CO -0.02 0.88 -0.10 0.50 -0.34 0.00 0.00 178.44 179.35 1qf5 h LYS 162 N 1.30 -0.14 0.21 1.25 1.63 -1.10 -1.32 116.57 118.40 1qf5 h LYS 162 Ca 0.34 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.15 1qf5 h LYS 162 Cb -0.04 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1qf5 h LYS 162 CO -0.06 -0.09 -0.22 0.93 -3.45 0.00 0.00 179.45 176.56 1qf5 h GLU 163 N -0.15 -0.45 -0.38 1.90 5.08 -1.28 -1.53 114.58 117.77 1qf5 h GLU 163 Ca 0.06 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.50 1qf5 h GLU 163 Cb 0.23 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 1qf5 h GLU 163 CO -0.16 -0.30 0.13 0.28 -1.00 0.00 0.00 179.01 177.97 1qf5 h VAL 164 N -0.46 0.89 -0.29 3.13 2.07 -1.36 -2.53 116.25 117.69 1qf5 h VAL 164 Ca -0.00 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1qf5 h VAL 164 Cb 0.44 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1qf5 h VAL 164 CO -0.05 0.05 -0.10 0.24 0.02 0.00 0.00 177.57 177.73 1qf5 h MET 165 N 0.29 0.47 -0.46 1.57 2.86 -1.16 -2.01 114.93 116.49 1qf5 h MET 165 Ca 0.17 -0.12 0.04 0.00 -2.06 0.00 0.00 59.70 57.73 1qf5 h MET 165 Cb 0.15 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 1qf5 h MET 165 CO -0.18 0.57 0.24 1.49 1.06 0.00 0.00 176.91 180.09 1qf5 h GLU 166 N 0.44 0.46 -0.09 1.72 4.81 -0.87 0.11 114.58 121.16 1qf5 h GLU 166 Ca 0.09 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1qf5 h GLU 166 Cb 0.44 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 1qf5 h GLU 166 CO 0.02 0.31 0.05 -0.92 -0.73 0.00 0.00 179.01 177.74 1qf5 h TYR 167 N 0.48 0.12 -0.13 0.92 3.20 -1.10 -2.74 116.97 117.73 1qf5 h TYR 167 Ca 0.20 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.91 1qf5 h TYR 167 Cb 0.09 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1qf5 h TYR 167 CO -0.10 0.14 -0.57 0.45 -1.64 0.00 0.00 178.16 176.44 1qf5 h HIS 168 N 0.07 0.50 -0.56 -3.82 3.86 -1.14 -3.19 115.15 110.87 1qf5 h HIS 168 Ca 0.03 -0.18 -0.10 0.00 -1.16 0.00 0.00 60.37 58.96 1qf5 h HIS 168 Cb 0.06 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1qf5 h HIS 168 CO -0.05 0.88 -0.03 -0.91 0.86 0.00 0.00 177.93 178.68 1qf5 h ASN 169 N 0.30 0.99 -0.34 2.45 2.35 -0.77 -0.83 115.58 119.73 1qf5 h ASN 169 Ca 0.00 -0.32 0.06 0.00 -0.55 0.00 0.00 56.30 55.49 1qf5 h ASN 169 Cb 1.09 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 39.14 1qf5 h ASN 169 CO 0.10 1.07 0.01 0.15 -1.65 0.00 0.00 177.43 177.10 1qf5 h PHE 170 N 0.88 -0.00 -0.12 1.19 3.04 -1.50 0.65 116.94 121.08 1qf5 h PHE 170 Ca 0.15 0.02 -0.15 0.00 3.98 0.00 0.00 57.97 61.97 1qf5 h PHE 170 Cb 0.58 0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.13 1qf5 h PHE 170 CO 0.04 -0.05 -0.59 0.37 -2.02 0.00 0.00 178.31 176.06 1qf5 h GLN 171 N 0.10 0.38 -0.13 1.11 4.15 -1.53 0.70 115.11 119.90 1qf5 h GLN 171 Ca 0.16 -0.25 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 1qf5 h GLN 171 Cb 0.22 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 1qf5 h GLN 171 CO -0.27 0.86 0.05 -0.07 -1.93 0.00 0.00 178.83 177.47 1qf5 h LEU 172 N 0.29 0.19 0.24 -2.39 3.38 -0.55 -1.12 115.31 115.34 1qf5 h LEU 172 Ca -0.00 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1qf5 h LEU 172 Cb 1.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1qf5 h LEU 172 CO 0.10 0.33 -0.12 0.58 0.09 0.00 0.00 178.44 179.42 1qf5 h VAL 173 N 0.04 0.00 0.21 1.22 2.07 -0.90 0.30 116.25 119.19 1qf5 h VAL 173 Ca 0.04 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1qf5 h VAL 173 Cb 0.20 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1qf5 h VAL 173 CO -0.00 0.00 -0.10 0.78 0.02 0.00 0.00 177.57 178.27 1qf5 h ASN 174 N -1.07 -0.24 0.00 0.57 2.35 -1.00 -2.30 115.58 113.89 1qf5 h ASN 174 Ca -0.03 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1qf5 h ASN 174 Cb 0.25 0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 1qf5 h ASN 174 CO 0.05 0.08 -0.02 0.22 -1.65 0.00 0.00 177.43 176.11 1qf5 h TYR 175 N -0.57 0.00 -0.00 1.19 3.20 -1.51 -3.37 116.97 115.90 1qf5 h TYR 175 Ca -0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1qf5 h TYR 175 Cb 0.42 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.69 1qf5 h TYR 175 CO 0.02 0.70 -0.11 0.66 -1.64 0.00 0.00 178.16 177.78 1qf5 n TYR 176 N -4.66 0.00 -2.97 -3.82 4.01 -0.48 -4.93 117.16 104.31 1qf5 n TYR 176 Ca -0.07 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.47 1qf5 n TYR 176 Cb 0.34 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1qf5 n TYR 176 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1qf5 n LYS 177 N -0.93 -3.23 -3.41 -0.72 4.01 -0.86 -4.95 118.16 108.07 1qf5 n LYS 177 Ca 0.14 0.61 -0.22 0.00 -0.51 0.00 0.00 58.31 58.33 1qf5 n LYS 177 Cb 0.28 -5.30 0.01 0.00 -0.51 0.00 0.00 35.03 29.51 1qf5 n LYS 177 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1qf5 s ALA 178 N -2.87 4.46 0.08 7.82 0.00 0.99 -4.96 121.76 127.28 1qf5 s ALA 178 Ca 0.24 -1.77 -0.30 0.00 0.00 0.00 0.00 51.96 50.13 1qf5 s ALA 178 Cb -0.12 -1.16 -0.06 0.00 0.00 0.00 0.00 23.12 21.78 1qf5 s ALA 178 CO 0.29 -0.52 1.16 -2.00 0.00 0.00 0.00 175.76 174.69 1qf5 s GLU 179 N -4.39 4.47 0.69 0.00 2.12 -1.26 -3.65 118.70 116.68 1qf5 s GLU 179 Ca 0.50 1.73 -0.14 0.00 0.36 0.00 0.00 54.97 57.42 1qf5 s GLU 179 Cb -0.05 -3.34 0.02 0.00 0.26 0.00 0.00 34.13 31.02 1qf5 s GLU 179 CO 0.30 -0.18 1.12 0.00 -0.54 0.00 0.00 175.26 175.97 1qf5 s ALA 180 N 0.80 2.37 -0.20 6.30 0.00 -1.26 -4.83 121.76 124.93 1qf5 s ALA 180 Ca 0.56 0.55 -0.12 0.00 0.00 0.00 0.00 51.96 52.95 1qf5 s ALA 180 Cb -0.29 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 1qf5 s ALA 180 CO 0.30 -1.47 0.21 0.08 0.00 0.00 0.00 175.76 174.89 1qf5 s VAL 181 N -2.39 5.35 -0.16 0.00 1.01 -1.26 -5.05 120.40 117.90 1qf5 s VAL 181 Ca 0.67 0.35 -0.29 0.00 0.00 0.00 0.00 61.98 62.71 1qf5 s VAL 181 Cb -0.21 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1qf5 s VAL 181 CO 0.45 0.38 1.43 -0.62 0.00 0.00 0.00 175.10 176.74 1qf5 s ASP 182 N 0.61 6.75 0.25 3.32 2.15 -1.26 -4.92 116.67 123.57 1qf5 s ASP 182 Ca 0.12 1.77 -0.05 0.00 0.43 0.00 0.00 52.55 54.82 1qf5 s ASP 182 Cb -0.12 -2.54 0.32 0.00 -0.30 0.00 0.00 42.92 40.28 1qf5 s ASP 182 CO 0.02 -0.92 1.89 0.22 -0.17 0.00 0.00 175.17 176.21 1qf5 h TYR 183 N 9.10 1.16 -0.35 -5.34 3.20 -1.99 -2.40 116.97 120.35 1qf5 h TYR 183 Ca -0.31 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.45 1qf5 h TYR 183 Cb 1.13 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 1qf5 h TYR 183 CO 0.85 0.66 -0.34 0.37 -1.64 0.00 0.00 178.16 178.06 1qf5 h GLN 184 N 1.19 0.80 -0.01 1.82 5.75 -1.98 0.14 115.11 122.83 1qf5 h GLN 184 Ca 0.39 -0.39 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1qf5 h GLN 184 Cb 0.03 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.58 1qf5 h GLN 184 CO -0.13 1.02 0.00 -0.22 -2.65 0.00 0.00 178.83 176.85 1qf5 h LYS 185 N 0.67 0.01 -0.16 1.69 1.63 -1.92 0.15 116.57 118.64 1qf5 h LYS 185 Ca 0.07 -0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1qf5 h LYS 185 Cb 0.89 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.51 1qf5 h LYS 185 CO 0.08 0.09 0.09 0.28 -3.45 0.00 0.00 179.45 176.54 1qf5 h VAL 186 N -0.08 1.11 -0.91 2.00 2.07 -1.38 -0.49 116.25 118.57 1qf5 h VAL 186 Ca 0.00 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.24 1qf5 h VAL 186 Cb 0.09 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1qf5 h VAL 186 CO -0.00 0.10 0.60 0.25 0.02 0.00 0.00 177.57 178.54 1qf5 h LEU 187 N 0.15 1.02 0.09 2.57 5.85 -0.55 -1.13 115.31 123.31 1qf5 h LEU 187 Ca 0.06 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1qf5 h LEU 187 Cb 0.09 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1qf5 h LEU 187 CO -0.01 0.72 -0.04 0.44 -0.34 0.00 0.00 178.44 179.21 1qf5 h ASP 188 N 1.20 -0.10 -0.16 1.25 3.32 -0.49 -2.07 116.42 119.36 1qf5 h ASP 188 Ca 0.35 -0.39 0.04 0.00 0.02 0.00 0.00 57.03 57.06 1qf5 h ASP 188 Cb -0.07 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 1qf5 h ASP 188 CO -0.10 0.36 -0.13 0.44 -1.72 0.00 0.00 179.24 178.09 1qf5 h ASP 189 N -0.59 -0.43 -0.34 6.45 3.32 -0.99 -0.27 116.42 123.58 1qf5 h ASP 189 Ca -0.01 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1qf5 h ASP 189 Cb 0.48 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 1qf5 h ASP 189 CO 0.02 -0.18 0.16 0.74 -1.72 0.00 0.00 179.24 178.27 1qf5 h THR 190 N -0.15 1.16 0.00 0.35 2.02 -1.29 -2.45 112.91 112.55 1qf5 h THR 190 Ca 0.10 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.79 1qf5 h THR 190 Cb 0.30 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1qf5 h THR 190 CO -0.25 0.17 -0.11 -0.03 0.37 0.00 0.00 175.52 175.67 1qf5 h MET 191 N 0.41 0.00 0.00 6.66 -1.53 -1.21 -2.20 114.93 117.07 1qf5 h MET 191 Ca 0.12 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.38 1qf5 h MET 191 Cb 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.17 1qf5 h MET 191 CO -0.01 0.11 0.00 0.00 0.14 0.00 0.00 176.91 177.15 1qf5 n ALA 192 N -2.21 2.36 -1.23 0.39 0.00 -0.13 -3.24 120.51 116.45 1qf5 n ALA 192 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1qf5 n ALA 192 Cb 0.28 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1qf5 n ALA 192 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1qf5 n VAL 193 N -0.93 0.00 -0.22 0.00 0.24 -1.00 -4.93 118.33 111.48 1qf5 n VAL 193 Ca 0.15 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.48 1qf5 n VAL 193 Cb 0.07 1.36 0.14 0.00 -1.47 0.00 0.00 33.84 33.94 1qf5 n VAL 193 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qf5 h ALA 194 N 0.00 0.83 0.00 2.33 0.00 -1.38 -1.70 119.26 119.34 1qf5 h ALA 194 Ca 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1qf5 h ALA 194 Cb 0.62 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1qf5 h ALA 194 CO 0.00 -0.29 -0.19 -0.44 0.00 0.00 0.00 179.25 178.33 1qf5 h ASP 195 N 0.30 0.00 -0.04 0.00 3.32 -1.90 -0.53 116.42 117.57 1qf5 h ASP 195 Ca 0.36 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.24 1qf5 h ASP 195 Cb 0.56 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.12 1qf5 h ASP 195 CO -0.43 0.19 -0.63 0.40 -1.72 0.00 0.00 179.24 177.04 1qf5 h ILE 196 N 0.00 1.38 -0.19 0.35 2.04 -1.71 -2.93 117.51 116.46 1qf5 h ILE 196 Ca -0.00 -2.01 -0.03 0.00 1.00 0.00 0.00 64.86 63.81 1qf5 h ILE 196 Cb 0.42 2.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.91 1qf5 h ILE 196 CO 0.02 0.60 -0.02 -0.07 0.00 0.00 0.00 178.15 178.69 1qf5 h LEU 197 N 0.06 0.34 -1.45 1.44 3.38 -1.16 -3.17 115.31 114.74 1qf5 h LEU 197 Ca -0.07 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 1qf5 h LEU 197 Cb 1.31 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 1qf5 h LEU 197 CO 0.13 0.59 -0.20 0.71 0.09 0.00 0.00 178.44 179.76 1qf5 h THR 198 N 0.08 0.63 0.00 0.22 1.35 -1.22 -2.78 112.91 111.19 1qf5 h THR 198 Ca 0.05 -0.92 -0.00 0.00 -0.55 0.00 0.00 66.41 64.99 1qf5 h THR 198 Cb 0.43 1.60 -0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1qf5 h THR 198 CO 0.01 0.20 -0.01 0.77 -0.25 0.00 0.00 175.52 176.25 1qf5 h SER 199 N 0.00 0.00 -0.07 5.36 4.64 -1.48 -2.80 113.55 119.19 1qf5 h SER 199 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qf5 h SER 199 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1qf5 h SER 199 CO 0.03 0.01 0.00 0.23 -0.87 0.00 0.00 176.83 176.22 1qf5 n MET 200 N -3.10 2.02 -2.23 4.77 2.81 -1.05 -4.98 117.12 115.36 1qf5 n MET 200 Ca 0.01 -1.49 -0.41 0.00 -1.81 0.00 0.00 57.70 54.01 1qf5 n MET 200 Cb 0.33 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.34 1qf5 n MET 200 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1qf5 s VAL 201 N -1.93 3.02 0.04 2.03 1.01 -1.06 -1.22 120.40 122.28 1qf5 s VAL 201 Ca 0.34 0.98 -0.10 0.00 0.00 0.00 0.00 61.98 63.19 1qf5 s VAL 201 Cb 0.20 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1qf5 s VAL 201 CO 0.31 0.21 0.21 0.54 0.00 0.00 0.00 175.10 176.38 1qf5 s VAL 202 N -0.87 0.10 -1.07 2.92 0.11 -0.81 -4.87 120.40 115.91 1qf5 s VAL 202 Ca 0.49 -0.84 -0.22 0.00 -2.93 0.00 0.00 61.98 58.48 1qf5 s VAL 202 Cb -0.37 -0.89 0.05 0.00 -1.53 0.00 0.00 36.38 33.64 1qf5 s VAL 202 CO 0.47 -0.46 1.51 -0.62 -3.33 0.00 0.00 175.10 172.67 1qf5 s ASP 203 N -2.04 6.52 0.20 3.54 -1.08 -1.26 -4.41 116.67 118.13 1qf5 s ASP 203 Ca -0.06 -1.61 -0.11 0.00 -0.52 0.00 0.00 52.55 50.26 1qf5 s ASP 203 Cb -0.01 -2.57 0.25 0.00 -1.46 0.00 0.00 42.92 39.13 1qf5 s ASP 203 CO -0.03 -1.49 1.72 0.58 0.52 0.00 0.00 175.17 176.47 1qf5 h VAL 204 N 6.59 0.70 -0.20 1.11 2.07 -1.90 -1.78 116.25 122.84 1qf5 h VAL 204 Ca 0.24 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.71 1qf5 h VAL 204 Cb 0.98 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 1qf5 h VAL 204 CO 1.43 0.05 -0.06 -1.28 0.02 0.00 0.00 177.57 177.73 1qf5 h SER 205 N 0.28 -0.23 -0.50 0.57 0.87 -1.89 -0.37 113.55 112.29 1qf5 h SER 205 Ca 0.29 0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.85 1qf5 h SER 205 Cb 0.40 0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 1qf5 h SER 205 CO -0.35 -0.08 0.06 -0.78 -0.53 0.00 0.00 176.83 175.14 1qf5 h ASP 206 N -0.02 0.81 -0.16 6.23 3.58 -1.86 -2.51 116.42 122.48 1qf5 h ASP 206 Ca 0.10 -0.27 0.02 0.00 0.42 0.00 0.00 57.03 57.30 1qf5 h ASP 206 Cb 0.17 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1qf5 h ASP 206 CO -0.22 0.88 0.01 0.25 -2.88 0.00 0.00 179.24 177.27 1qf5 h LEU 207 N 0.71 -0.04 -1.70 2.28 5.85 -1.03 -1.57 115.31 119.80 1qf5 h LEU 207 Ca 0.15 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1qf5 h LEU 207 Cb 0.43 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1qf5 h LEU 207 CO 0.01 0.00 0.13 -0.07 -0.34 0.00 0.00 178.44 178.17 1qf5 h LEU 208 N 0.06 0.29 -0.74 2.25 3.38 -1.00 -1.27 115.31 118.28 1qf5 h LEU 208 Ca 0.07 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1qf5 h LEU 208 Cb 0.08 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1qf5 h LEU 208 CO -0.12 0.24 -0.58 -0.78 0.09 0.00 0.00 178.44 177.29 1qf5 h ASP 209 N 0.33 0.18 -0.15 -0.43 3.58 -0.89 -2.14 116.42 116.91 1qf5 h ASP 209 Ca 0.09 -0.10 -0.19 0.00 0.42 0.00 0.00 57.03 57.24 1qf5 h ASP 209 Cb 0.02 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.02 1qf5 h ASP 209 CO -0.01 0.72 -0.66 1.56 -2.88 0.00 0.00 179.24 177.96 1qf5 h GLN 210 N 0.12 0.71 -0.92 0.28 4.20 -0.38 -2.39 115.11 116.73 1qf5 h GLN 210 Ca -0.00 -0.57 -0.01 0.00 0.06 0.00 0.00 58.65 58.13 1qf5 h GLN 210 Cb 1.05 0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.90 1qf5 h GLN 210 CO 0.08 1.18 0.53 0.00 -0.67 0.00 0.00 178.83 179.95 1qf5 h ALA 211 N 0.53 1.20 -0.36 3.87 0.00 -1.21 -0.13 119.26 123.16 1qf5 h ALA 211 Ca -0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1qf5 h ALA 211 Cb 1.30 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1qf5 h ALA 211 CO 0.14 0.66 0.22 -0.09 0.00 0.00 0.00 179.25 180.19 1qf5 h ARG 212 N 1.28 0.49 0.00 0.00 1.12 -1.31 0.37 114.38 116.32 1qf5 h ARG 212 Ca 0.33 -0.04 -0.08 0.00 -1.11 0.00 0.00 59.98 59.08 1qf5 h ARG 212 Cb -0.01 -0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 29.83 1qf5 h ARG 212 CO -0.06 0.36 -0.37 1.96 -3.11 0.00 0.00 179.97 178.75 1qf5 h GLN 213 N 0.48 0.00 0.00 0.20 4.20 -0.87 -2.50 115.11 116.62 1qf5 h GLN 213 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1qf5 h GLN 213 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1qf5 h GLN 213 CO -0.03 0.37 -0.34 0.54 -0.67 0.00 0.00 178.83 178.70 1qf5 n ARG 214 N -3.91 0.11 -1.51 1.46 1.74 -0.12 -4.94 116.66 109.49 1qf5 n ARG 214 Ca -0.01 0.05 -0.02 0.00 -0.77 0.00 0.00 57.85 57.10 1qf5 n ARG 214 Cb 0.43 -1.59 -0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1qf5 n ARG 214 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qf5 n GLY 215 N 1.43 0.41 3.77 -0.13 0.00 -0.06 -5.03 105.19 105.59 1qf5 n GLY 215 Ca 0.05 -0.92 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 1qf5 n GLY 215 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qf5 s ASP 216 N -2.95 5.35 -0.09 1.61 1.01 -0.18 -4.99 116.67 116.42 1qf5 s ASP 216 Ca 0.00 2.09 -0.24 0.00 0.71 0.00 0.00 52.55 55.10 1qf5 s ASP 216 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 1qf5 s ASP 216 CO 0.00 -1.47 0.76 -0.36 0.21 0.00 0.00 175.17 174.30 1qf5 s PHE 217 N -2.08 3.54 -0.04 4.23 0.40 -1.26 -4.73 117.98 118.03 1qf5 s PHE 217 Ca 0.70 1.28 0.05 0.00 -0.60 0.00 0.00 56.93 58.35 1qf5 s PHE 217 Cb -0.22 -2.89 -0.01 0.00 0.51 0.00 0.00 43.02 40.42 1qf5 s PHE 217 CO 0.35 -0.01 -0.17 0.08 0.70 0.00 0.00 175.22 176.17 1qf5 s VAL 218 N 1.18 1.42 -0.06 -0.44 1.01 0.29 -0.64 120.40 123.17 1qf5 s VAL 218 Ca 0.39 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.70 1qf5 s VAL 218 Cb -0.18 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 1qf5 s VAL 218 CO 0.18 0.41 -0.24 -0.32 0.00 0.00 0.00 175.10 175.12 1qf5 s MET 219 N -0.05 2.59 -0.22 2.72 1.75 -0.06 -0.84 119.30 125.19 1qf5 s MET 219 Ca -0.02 -0.89 -0.06 0.00 -1.25 0.00 0.00 55.69 53.47 1qf5 s MET 219 Cb -0.11 -2.19 -0.03 0.00 2.84 0.00 0.00 34.83 35.35 1qf5 s MET 219 CO 0.02 0.38 0.04 -0.06 -0.65 0.00 0.00 175.02 174.74 1qf5 s PHE 220 N -0.15 3.08 -0.30 4.11 0.40 0.58 0.36 117.98 126.06 1qf5 s PHE 220 Ca -0.04 -0.38 -0.11 0.00 -0.60 0.00 0.00 56.93 55.81 1qf5 s PHE 220 Cb -0.14 -2.15 -0.03 0.00 0.51 0.00 0.00 43.02 41.21 1qf5 s PHE 220 CO 0.04 -0.24 0.18 -2.00 0.70 0.00 0.00 175.22 173.90 1qf5 s GLU 221 N 1.19 3.64 0.52 0.44 2.12 0.44 -0.59 118.70 126.46 1qf5 s GLU 221 Ca 0.04 -0.53 -0.09 0.00 0.36 0.00 0.00 54.97 54.75 1qf5 s GLU 221 Cb -0.14 -3.64 -0.05 0.00 0.26 0.00 0.00 34.13 30.56 1qf5 s GLU 221 CO 0.02 -0.31 0.89 0.20 -0.54 0.00 0.00 175.26 175.52 1qf5 s GLY 222 N 1.70 1.69 0.19 -1.50 0.00 0.12 -4.12 107.32 105.39 1qf5 s GLY 222 Ca 0.06 -0.24 0.11 0.00 0.00 0.00 0.00 44.72 44.66 1qf5 s GLY 222 CO 0.09 -0.02 -0.23 0.00 0.00 0.00 0.00 173.10 172.94 1qf5 s ALA 223 N -2.83 2.55 0.00 3.20 0.00 -1.26 -4.84 121.76 118.58 1qf5 s ALA 223 Ca 0.52 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1qf5 s ALA 223 Cb -0.11 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.67 1qf5 s ALA 223 CO 0.45 0.43 0.00 1.04 0.00 0.00 0.00 175.76 177.68 1qf5 n GLN 224 N 0.26 0.00 -4.03 0.00 3.00 -1.26 -4.81 117.38 110.54 1qf5 n GLN 224 Ca -0.12 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.77 1qf5 n GLN 224 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.72 1qf5 n GLN 224 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1qf5 s GLY 225 N -2.00 0.71 0.20 1.08 0.00 -1.26 -3.88 107.32 102.17 1qf5 s GLY 225 Ca 0.00 -1.10 -0.13 0.00 0.00 0.00 0.00 44.72 43.49 1qf5 s GLY 225 CO 0.00 -0.99 1.66 -0.84 0.00 0.00 0.00 173.10 172.94 1qf5 h THR 226 N 2.58 0.52 0.00 0.90 2.02 -0.98 -1.06 112.91 116.89 1qf5 h THR 226 Ca -0.32 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1qf5 h THR 226 Cb 1.23 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 1qf5 h THR 226 CO 0.49 0.01 0.00 0.18 0.37 0.00 0.00 175.52 176.58 1qf5 n LEU 227 N -5.30 0.00 -1.03 2.58 4.77 -0.68 -1.38 117.00 115.96 1qf5 n LEU 227 Ca 0.07 0.06 0.11 0.00 -0.03 0.00 0.00 56.01 56.22 1qf5 n LEU 227 Cb 0.31 -0.06 0.18 0.00 -2.33 0.00 0.00 43.42 41.52 1qf5 n LEU 227 CO 0.12 -0.03 0.66 0.18 -1.33 0.00 0.00 177.39 176.99 1qf5 n LEU 228 N -1.06 3.25 -4.72 2.23 4.77 -0.40 -2.00 117.00 119.06 1qf5 n LEU 228 Ca 0.11 -1.46 -0.43 0.00 -0.03 0.00 0.00 56.01 54.20 1qf5 n LEU 228 Cb 0.07 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1qf5 n LEU 228 CO 0.09 0.69 1.08 -0.67 -1.33 0.00 0.00 177.39 177.26 1qf5 n ASP 229 N 1.32 3.29 0.24 -1.43 2.03 -0.48 -1.34 116.55 120.19 1qf5 n ASP 229 Ca 0.17 1.17 0.07 0.00 0.52 0.00 0.00 54.79 56.72 1qf5 n ASP 229 Cb 0.56 -1.53 0.57 0.00 -0.72 0.00 0.00 41.12 40.01 1qf5 n ASP 229 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1qf5 h ILE 230 N 3.01 1.06 0.00 5.18 6.09 -1.47 -0.00 117.51 131.38 1qf5 h ILE 230 Ca -0.47 -0.29 -0.19 0.00 -1.37 0.00 0.00 64.86 62.54 1qf5 h ILE 230 Cb 1.26 1.14 -0.03 0.00 0.47 0.00 0.00 36.82 39.66 1qf5 h ILE 230 CO 0.72 0.08 -1.39 0.47 -3.07 0.00 0.00 178.15 174.96 1qf5 n ASP 231 N -4.44 1.89 -0.21 2.19 8.00 -1.26 -4.67 116.55 118.06 1qf5 n ASP 231 Ca -0.03 0.43 0.12 0.00 0.71 0.00 0.00 54.79 56.02 1qf5 n ASP 231 Cb 0.16 -0.85 0.13 0.00 -0.02 0.00 0.00 41.12 40.53 1qf5 n ASP 231 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1qf5 n HIS 232 N -4.43 0.00 -1.85 1.24 8.25 -1.25 -4.94 115.22 112.24 1qf5 n HIS 232 Ca -0.29 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.00 1qf5 n HIS 232 Cb 0.61 -0.09 0.11 0.00 1.12 0.00 0.00 29.99 31.74 1qf5 n HIS 232 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qf5 n GLY 233 N 1.43 -0.74 2.65 -1.41 0.00 -0.01 -4.87 105.19 102.25 1qf5 n GLY 233 Ca 0.08 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 44.01 1qf5 n GLY 233 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qf5 n THR 234 N -2.89 2.72 -1.62 2.61 -2.24 -0.85 -4.59 114.28 107.43 1qf5 n THR 234 Ca 0.10 -1.78 -0.44 0.00 -2.27 0.00 0.00 64.05 59.66 1qf5 n THR 234 Cb 0.36 -2.28 -0.02 0.00 -2.10 0.00 0.00 70.33 66.29 1qf5 n THR 234 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qf5 n TYR 235 N 4.82 1.57 0.83 4.78 9.36 -1.26 -0.68 117.16 136.57 1qf5 n TYR 235 Ca 0.52 0.65 0.07 0.00 3.32 0.00 0.00 57.90 62.46 1qf5 n TYR 235 Cb 0.21 -2.31 0.22 0.00 -0.63 0.00 0.00 39.34 36.83 1qf5 n TYR 235 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1qf5 n PRO 236 N 0.86 1.89 -2.11 2.98 -0.04 -1.26 -0.52 135.00 136.80 1qf5 n PRO 236 Ca 0.09 -1.38 -0.42 0.00 -0.04 0.00 0.00 63.50 61.75 1qf5 n PRO 236 Cb 0.32 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 1qf5 n PRO 236 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1qf5 n TYR 237 N 0.61 3.03 -4.15 0.54 4.01 0.14 -4.86 117.16 116.49 1qf5 n TYR 237 Ca 0.14 -2.85 -0.14 0.00 -0.16 0.00 0.00 57.90 54.89 1qf5 n TYR 237 Cb 0.34 -2.11 -0.07 0.00 -0.31 0.00 0.00 39.34 37.19 1qf5 n TYR 237 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1qf5 s VAL 238 N 1.04 0.00 0.28 -0.72 -7.23 -1.26 -4.43 120.40 108.08 1qf5 s VAL 238 Ca 0.44 -1.77 -0.02 0.00 -1.81 0.00 0.00 61.98 58.81 1qf5 s VAL 238 Cb 0.12 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 1qf5 s VAL 238 CO -0.03 0.00 0.51 0.28 -0.31 0.00 0.00 175.10 175.55 1qf5 s THR 239 N -3.63 5.09 -1.41 5.32 -1.32 -0.45 -4.99 115.64 114.25 1qf5 s THR 239 Ca 0.34 -0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.63 1qf5 s THR 239 Cb 0.02 -3.77 0.00 0.00 -1.51 0.00 0.00 72.50 67.25 1qf5 s THR 239 CO 0.18 -0.35 0.65 -1.20 -2.21 0.00 0.00 174.62 171.69 1qf5 n SER 240 N -1.09 0.54 -4.38 8.08 7.64 -1.26 -3.40 113.62 119.76 1qf5 n SER 240 Ca -0.03 -1.84 -0.19 0.00 1.01 0.00 0.00 58.87 57.82 1qf5 n SER 240 Cb 0.54 -0.27 -0.10 0.00 -1.01 0.00 0.00 64.21 63.37 1qf5 n SER 240 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1qf5 s SER 241 N -0.49 2.36 -0.43 6.43 1.04 -1.26 -4.89 113.70 116.46 1qf5 s SER 241 Ca 0.00 -1.17 -0.26 0.00 0.48 0.00 0.00 55.95 54.99 1qf5 s SER 241 Cb 0.00 -0.09 0.02 0.00 0.10 0.00 0.00 66.02 66.05 1qf5 s SER 241 CO 0.00 -0.38 0.97 0.20 0.98 0.00 0.00 173.24 175.01 1qf5 s ASN 242 N -3.37 6.59 0.00 7.02 -0.87 -1.26 -2.26 114.94 120.79 1qf5 s ASN 242 Ca 0.28 0.36 0.25 0.00 -1.57 0.00 0.00 52.86 52.18 1qf5 s ASN 242 Cb 0.04 -2.48 0.51 0.00 -0.02 0.00 0.00 41.25 39.30 1qf5 s ASN 242 CO 0.10 -1.03 1.41 0.35 -2.57 0.00 0.00 177.10 175.36 1qf5 n THR 243 N 6.35 0.00 -2.10 1.60 -2.24 -1.26 -4.45 114.28 112.19 1qf5 n THR 243 Ca 0.08 -0.02 -0.29 0.00 -2.27 0.00 0.00 64.05 61.55 1qf5 n THR 243 Cb 0.48 0.30 0.03 0.00 -2.10 0.00 0.00 70.33 69.04 1qf5 n THR 243 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1qf5 s THR 244 N -2.94 3.87 0.61 4.28 -4.23 -1.26 -4.60 115.64 111.36 1qf5 s THR 244 Ca 0.13 0.39 0.27 0.00 -1.18 0.00 0.00 61.69 61.29 1qf5 s THR 244 Cb 0.18 -3.57 0.36 0.00 1.34 0.00 0.00 72.50 70.80 1qf5 s THR 244 CO 0.68 -0.69 1.64 0.00 -0.54 0.00 0.00 174.62 175.72 1qf5 h ALA 245 N -0.38 2.37 0.00 3.99 0.00 -1.87 0.93 119.26 124.29 1qf5 h ALA 245 Ca -0.45 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1qf5 h ALA 245 Cb 1.24 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1qf5 h ALA 245 CO 0.62 -1.06 -0.16 0.78 0.00 0.00 0.00 179.25 179.43 1qf5 h GLY 246 N 0.00 0.00 2.00 0.00 0.00 -1.92 -2.42 103.07 100.73 1qf5 h GLY 246 Ca 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.61 1qf5 h GLY 246 CO -0.00 0.00 -0.00 -1.33 0.00 0.00 0.00 176.54 175.21 1qf5 h GLY 247 N 1.18 0.00 0.98 4.60 0.00 -1.02 -2.84 103.07 105.97 1qf5 h GLY 247 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1qf5 h GLY 247 CO 0.02 0.00 0.23 -2.08 0.00 0.00 0.00 176.54 174.71 1qf5 h VAL 248 N 0.00 1.13 0.10 4.60 2.07 -1.60 -0.44 116.25 122.11 1qf5 h VAL 248 Ca -0.00 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1qf5 h VAL 248 Cb 0.33 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1qf5 h VAL 248 CO 0.00 0.14 -0.05 0.00 0.02 0.00 0.00 177.57 177.68 1qf5 h ALA 249 N 1.09 -0.14 -0.28 1.67 0.00 -1.68 -2.50 119.26 117.43 1qf5 h ALA 249 Ca 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1qf5 h ALA 249 Cb 0.02 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1qf5 h ALA 249 CO -0.03 -0.30 0.04 1.79 0.00 0.00 0.00 179.25 180.76 1qf5 h THR 250 N -0.69 1.15 -0.10 0.00 1.35 -1.60 -0.98 112.91 112.05 1qf5 h THR 250 Ca -0.01 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1qf5 h THR 250 Cb 0.54 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1qf5 h THR 250 CO 0.02 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.10 1qf5 n GLY 251 N -1.09 0.32 0.00 5.82 0.00 -0.18 -4.46 105.19 105.60 1qf5 n GLY 251 Ca 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1qf5 n GLY 251 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1qf5 n SER 252 N 0.43 0.74 0.00 1.61 3.41 -0.94 -2.00 113.62 116.87 1qf5 n SER 252 Ca 0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 1qf5 n SER 252 Cb 0.39 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1qf5 n SER 252 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qf5 n GLY 253 N 0.54 0.56 3.69 5.00 0.00 -0.38 -3.78 105.19 110.81 1qf5 n GLY 253 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1qf5 n GLY 253 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qf5 s LEU 254 N 0.00 4.25 0.23 0.99 2.96 -1.24 -4.90 118.68 120.97 1qf5 s LEU 254 Ca 0.00 1.45 -0.32 0.00 -0.22 0.00 0.00 54.13 55.05 1qf5 s LEU 254 Cb 0.00 -3.46 -0.13 0.00 0.50 0.00 0.00 46.19 43.10 1qf5 s LEU 254 CO 0.00 -0.39 1.54 0.61 -1.32 0.00 0.00 176.35 176.79 1qf5 n GLY 255 N 3.14 1.11 0.39 7.98 0.00 -1.26 -4.26 105.19 112.29 1qf5 n GLY 255 Ca 0.07 0.54 0.21 0.00 0.00 0.00 0.00 46.02 46.83 1qf5 n GLY 255 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qf5 h PRO 256 N 5.08 0.00 0.00 1.61 0.13 -1.94 -0.80 132.00 136.07 1qf5 h PRO 256 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1qf5 h PRO 256 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1qf5 h PRO 256 CO 0.82 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.13 1qf5 n ARG 257 N -4.28 0.26 -0.21 0.86 1.74 -1.26 -2.53 116.66 111.23 1qf5 n ARG 257 Ca 0.10 0.12 0.11 0.00 -0.77 0.00 0.00 57.85 57.41 1qf5 n ARG 257 Cb 0.63 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.79 1qf5 n ARG 257 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1qf5 n TYR 258 N -1.24 0.56 -2.73 -1.55 4.01 -0.30 -4.85 117.16 111.06 1qf5 n TYR 258 Ca 0.08 -0.30 -0.43 0.00 -0.16 0.00 0.00 57.90 57.09 1qf5 n TYR 258 Cb 0.11 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 1qf5 n TYR 258 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1qf5 s VAL 259 N -1.33 4.47 -0.14 -0.72 1.01 -1.05 -4.61 120.40 118.03 1qf5 s VAL 259 Ca 0.38 1.22 -0.13 0.00 0.00 0.00 0.00 61.98 63.46 1qf5 s VAL 259 Cb 0.22 -4.43 -0.24 0.00 0.00 0.00 0.00 36.38 31.93 1qf5 s VAL 259 CO 0.30 -0.68 0.37 0.44 0.00 0.00 0.00 175.10 175.52 1qf5 h ASP 260 N 8.68 0.30 -3.41 3.32 3.32 -1.75 -3.48 116.42 123.41 1qf5 h ASP 260 Ca -0.23 -0.81 -0.31 0.00 0.02 0.00 0.00 57.03 55.70 1qf5 h ASP 260 Cb 1.07 -0.10 -0.35 0.00 0.22 0.00 0.00 39.33 40.17 1qf5 h ASP 260 CO 1.03 1.71 -0.71 -0.47 -1.72 0.00 0.00 179.24 179.09 1qf5 s TYR 261 N -2.49 -0.01 -0.32 4.55 6.14 -1.04 -4.92 117.35 119.26 1qf5 s TYR 261 Ca -0.24 0.26 -0.06 0.00 0.64 0.00 0.00 57.07 57.67 1qf5 s TYR 261 Cb 0.06 -0.29 0.03 0.00 0.42 0.00 0.00 41.96 42.18 1qf5 s TYR 261 CO 0.72 -0.15 0.09 0.08 0.64 0.00 0.00 175.55 176.93 1qf5 s VAL 262 N 1.51 3.76 -0.28 3.14 1.01 -1.26 -1.07 120.40 127.22 1qf5 s VAL 262 Ca -0.04 -1.04 -0.13 0.00 0.00 0.00 0.00 61.98 60.77 1qf5 s VAL 262 Cb -0.12 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 1qf5 s VAL 262 CO -0.04 -0.10 0.30 -0.22 0.00 0.00 0.00 175.10 175.04 1qf5 s LEU 263 N 1.42 4.05 -0.20 3.92 2.96 0.15 -0.65 118.68 130.33 1qf5 s LEU 263 Ca -0.01 0.15 -0.14 0.00 -0.22 0.00 0.00 54.13 53.90 1qf5 s LEU 263 Cb -0.19 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.15 1qf5 s LEU 263 CO 0.02 -0.14 0.33 -0.83 -1.32 0.00 0.00 176.35 174.41 1qf5 s GLY 264 N 1.69 2.10 -0.14 7.98 0.00 -0.55 -2.16 107.32 116.25 1qf5 s GLY 264 Ca 0.12 -0.57 -0.27 0.00 0.00 0.00 0.00 44.72 44.00 1qf5 s GLY 264 CO 0.10 0.65 0.89 -0.42 0.00 0.00 0.00 173.10 174.32 1qf5 s ILE 265 N 1.06 4.85 -0.17 0.90 -1.09 0.15 -1.55 121.20 125.36 1qf5 s ILE 265 Ca 0.16 1.78 -0.00 0.00 -2.23 0.00 0.00 60.65 60.36 1qf5 s ILE 265 Cb -0.14 -4.20 0.04 0.00 -1.58 0.00 0.00 42.46 36.58 1qf5 s ILE 265 CO 0.06 0.03 -0.07 -0.22 -1.23 0.00 0.00 174.94 173.52 1qf5 s LEU 266 N 1.99 1.74 0.47 2.97 2.96 -0.43 -2.03 118.68 126.35 1qf5 s LEU 266 Ca 0.42 -0.67 -0.19 0.00 -0.22 0.00 0.00 54.13 53.47 1qf5 s LEU 266 Cb -0.17 -1.00 -0.10 0.00 0.50 0.00 0.00 46.19 45.42 1qf5 s LEU 266 CO 0.15 -0.16 0.97 -0.75 -1.32 0.00 0.00 176.35 175.24 1qf5 s LYS 267 N 1.57 4.08 0.38 1.98 2.20 -1.26 -0.36 119.74 128.34 1qf5 s LYS 267 Ca 0.01 1.08 0.28 0.00 -0.36 0.00 0.00 55.97 56.98 1qf5 s LYS 267 Cb -0.15 -2.16 1.22 0.00 -1.51 0.00 0.00 37.83 35.23 1qf5 s LYS 267 CO -0.08 -0.16 1.83 0.00 -0.36 0.00 0.00 175.35 176.59 1qf5 h ALA 268 N 1.50 1.00 -3.46 3.13 0.00 -1.17 -3.45 119.26 116.81 1qf5 h ALA 268 Ca -0.48 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1qf5 h ALA 268 Cb 1.18 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 1qf5 h ALA 268 CO 0.61 0.00 -0.10 2.48 0.00 0.00 0.00 179.25 182.24 1qf5 n TYR 269 N -2.56 -0.12 -4.37 0.00 4.11 -1.26 -4.30 117.16 108.66 1qf5 n TYR 269 Ca 0.01 -0.57 -0.28 0.00 -0.00 0.00 0.00 57.90 57.07 1qf5 n TYR 269 Cb 0.22 0.05 -0.11 0.00 -0.00 0.00 0.00 39.34 39.49 1qf5 n TYR 269 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 1qf5 s SER 270 N -1.48 3.64 0.05 9.48 0.01 -0.54 -4.71 113.70 120.15 1qf5 s SER 270 Ca 0.07 -0.73 -0.04 0.00 1.31 0.00 0.00 55.95 56.56 1qf5 s SER 270 Cb 0.00 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 1qf5 s SER 270 CO 0.05 0.14 0.05 0.42 0.41 0.00 0.00 173.24 174.31 1qf5 s THR 271 N -1.44 0.17 -0.26 1.44 -4.23 -1.26 -1.12 115.64 108.94 1qf5 s THR 271 Ca 0.19 -1.42 -0.22 0.00 -1.18 0.00 0.00 61.69 59.07 1qf5 s THR 271 Cb -0.09 -1.22 0.07 0.00 1.34 0.00 0.00 72.50 72.60 1qf5 s THR 271 CO 0.10 -0.78 0.68 -0.60 -0.54 0.00 0.00 174.62 173.48 1qf5 s ARG 272 N -3.37 0.77 -0.14 3.99 3.52 -0.88 -4.41 118.95 118.43 1qf5 s ARG 272 Ca 0.02 1.01 -0.01 0.00 -0.13 0.00 0.00 55.73 56.62 1qf5 s ARG 272 Cb 0.04 0.32 0.04 0.00 -1.56 0.00 0.00 34.95 33.78 1qf5 s ARG 272 CO -0.08 -0.11 -0.02 0.54 -0.81 0.00 0.00 175.30 174.82 1qf5 s VAL 273 N 0.69 0.74 0.00 7.11 0.11 -1.26 -0.32 120.40 127.46 1qf5 s VAL 273 Ca -0.03 -0.35 0.00 0.00 -2.93 0.00 0.00 61.98 58.67 1qf5 s VAL 273 Cb -0.05 -0.97 0.00 0.00 -1.53 0.00 0.00 36.38 33.83 1qf5 s VAL 273 CO -0.04 0.11 0.00 0.61 -3.33 0.00 0.00 175.10 172.45 1qf5 n GLY 274 N 5.01 2.18 3.79 6.54 0.00 -1.26 -5.04 105.19 116.40 1qf5 n GLY 274 Ca -0.10 -2.10 -0.31 0.00 0.00 0.00 0.00 46.02 43.51 1qf5 n GLY 274 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qf5 s ALA 275 N -1.70 2.32 0.00 4.61 0.00 -0.68 -5.02 121.76 121.28 1qf5 s ALA 275 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.02 1qf5 s ALA 275 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1qf5 s ALA 275 CO 0.00 -1.64 0.00 0.41 0.00 0.00 0.00 175.76 174.53 1qf5 n GLY 276 N -1.68 3.75 3.68 0.00 0.00 -1.26 -4.86 105.19 104.82 1qf5 n GLY 276 Ca 0.08 -1.73 -0.39 0.00 0.00 0.00 0.00 46.02 43.97 1qf5 n GLY 276 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1qf5 n PRO 277 N -1.60 1.44 -2.71 1.61 -0.02 -1.26 -5.00 135.00 127.45 1qf5 n PRO 277 Ca 0.00 0.53 -0.04 0.00 -2.02 0.00 0.00 63.50 61.98 1qf5 n PRO 277 Cb 0.00 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.14 1qf5 n PRO 277 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1qf5 n PHE 278 N -1.06 -2.14 -0.23 6.00 7.35 -1.26 -5.07 117.46 121.05 1qf5 n PHE 278 Ca 0.11 -0.98 0.04 0.00 -0.76 0.00 0.00 57.45 55.85 1qf5 n PHE 278 Cb 0.44 1.27 0.15 0.00 0.35 0.00 0.00 39.48 41.69 1qf5 n PHE 278 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1qf5 h PRO 279 N 4.54 0.23 -0.48 -7.13 0.11 -1.94 -2.26 132.00 125.06 1qf5 h PRO 279 Ca 0.02 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1qf5 h PRO 279 Cb 1.14 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1qf5 h PRO 279 CO -0.06 0.15 0.00 0.25 -0.21 0.00 0.00 178.00 178.13 1qf5 n THR 280 N -5.18 0.46 -1.79 -1.15 -2.24 -1.26 -4.48 114.28 98.64 1qf5 n THR 280 Ca 0.12 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 1qf5 n THR 280 Cb 0.41 -0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 1qf5 n THR 280 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1qf5 s GLU 281 N -1.63 4.16 0.04 -0.78 2.12 -0.85 -2.19 118.70 119.57 1qf5 s GLU 281 Ca 0.14 2.51 -0.12 0.00 0.36 0.00 0.00 54.97 57.86 1qf5 s GLU 281 Cb 0.09 -3.38 -0.06 0.00 0.26 0.00 0.00 34.13 31.04 1qf5 s GLU 281 CO 0.07 -0.76 0.40 -0.51 -0.54 0.00 0.00 175.26 173.92 1qf5 s LEU 282 N 2.02 4.40 0.00 2.70 1.43 -0.65 -4.95 118.68 123.63 1qf5 s LEU 282 Ca 0.76 0.85 0.00 0.00 -1.03 0.00 0.00 54.13 54.71 1qf5 s LEU 282 Cb -0.46 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 42.96 1qf5 s LEU 282 CO 0.34 0.24 0.04 0.49 0.23 0.00 0.00 176.35 177.69 1qf5 n PHE 283 N 1.29 0.00 -0.37 0.29 3.72 -1.26 -4.73 117.46 116.39 1qf5 n PHE 283 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1qf5 n PHE 283 Cb 0.52 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 1qf5 n PHE 283 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1qf5 n ASP 284 N -0.77 0.00 0.07 4.37 5.75 -1.26 -4.88 116.55 119.83 1qf5 n ASP 284 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.75 1qf5 n ASP 284 Cb 0.00 0.00 0.21 0.00 -1.03 0.00 0.00 41.12 40.30 1qf5 n ASP 284 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1qf5 h GLU 285 N 0.00 0.30 -0.10 0.11 3.07 -1.99 -2.74 114.58 113.23 1qf5 h GLU 285 Ca 0.00 -0.14 -0.08 0.00 -0.50 0.00 0.00 59.36 58.64 1qf5 h GLU 285 Cb 0.00 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1qf5 h GLU 285 CO 0.00 0.66 -0.28 1.15 -1.40 0.00 0.00 179.01 179.13 1qf5 h THR 286 N 0.25 1.24 0.05 1.13 2.02 -1.98 -0.87 112.91 114.75 1qf5 h THR 286 Ca 0.02 -1.14 -0.00 0.00 0.77 0.00 0.00 66.41 66.06 1qf5 h THR 286 Cb 0.82 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1qf5 h THR 286 CO 0.06 0.34 -0.02 1.23 0.37 0.00 0.00 175.52 177.50 1qf5 h GLY 287 N 0.99 -0.06 1.64 2.16 0.00 -1.79 -1.53 103.07 104.47 1qf5 h GLY 287 Ca 0.02 0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.39 1qf5 h GLY 287 CO 0.04 -0.02 0.23 -2.09 0.00 0.00 0.00 176.54 174.70 1qf5 h GLU 288 N -0.39 0.42 -0.05 4.80 4.57 -1.37 -1.68 114.58 120.89 1qf5 h GLU 288 Ca -0.01 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1qf5 h GLU 288 Cb 0.35 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.84 1qf5 h GLU 288 CO 0.01 0.28 0.01 0.35 -1.18 0.00 0.00 179.01 178.47 1qf5 h PHE 289 N 0.43 0.08 -0.53 0.92 3.57 -0.90 -0.31 116.94 120.21 1qf5 h PHE 289 Ca 0.13 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.63 1qf5 h PHE 289 Cb -0.00 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1qf5 h PHE 289 CO -0.00 0.32 0.34 -0.07 -2.23 0.00 0.00 178.31 176.66 1qf5 h LEU 290 N -0.18 0.57 0.13 0.59 3.38 -0.82 0.88 115.31 119.85 1qf5 h LEU 290 Ca 0.01 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1qf5 h LEU 290 Cb 0.28 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1qf5 h LEU 290 CO 0.00 0.40 -0.07 0.00 0.09 0.00 0.00 178.44 178.86 1qf5 h LYS 292 N -0.20 -0.22 0.00 0.00 3.64 -0.88 0.66 116.57 119.58 1qf5 h LYS 292 Ca -0.01 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1qf5 h LYS 292 Cb 0.16 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1qf5 h LYS 292 CO 0.02 -0.00 -0.40 0.37 -2.27 0.00 0.00 179.45 177.17 1qf5 h GLN 293 N -0.41 0.00 -0.00 1.90 5.75 -0.85 -2.84 115.11 118.65 1qf5 h GLN 293 Ca -0.02 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1qf5 h GLN 293 Cb 0.32 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.87 1qf5 h GLN 293 CO 0.04 0.40 -0.49 0.41 -2.65 0.00 0.00 178.83 176.53 1qf5 n GLY 294 N 0.00 -1.12 3.66 2.39 0.00 0.63 -4.91 105.19 105.84 1qf5 n GLY 294 Ca -0.01 -0.38 -0.24 0.00 0.00 0.00 0.00 46.02 45.39 1qf5 n GLY 294 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1qf5 n ASN 295 N -1.35 -4.70 -4.56 1.61 2.85 0.10 -4.87 115.26 104.34 1qf5 n ASN 295 Ca 0.07 -0.64 -0.33 0.00 -0.11 0.00 0.00 54.58 53.56 1qf5 n ASN 295 Cb 0.34 -4.66 -0.04 0.00 1.24 0.00 0.00 39.78 36.66 1qf5 n ASN 295 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1qf5 s GLU 296 N -6.20 2.99 -0.01 1.20 0.41 -0.47 -4.92 118.70 111.71 1qf5 s GLU 296 Ca 0.45 -0.65 0.00 0.00 -0.41 0.00 0.00 54.97 54.36 1qf5 s GLU 296 Cb -0.21 -5.19 0.01 0.00 -1.78 0.00 0.00 34.13 26.96 1qf5 s GLU 296 CO 0.76 -2.88 0.01 -0.06 -0.49 0.00 0.00 175.26 172.60 1qf5 s PHE 297 N 7.92 0.01 -0.15 1.61 0.08 -1.26 -1.59 117.98 124.61 1qf5 s PHE 297 Ca 0.60 0.05 -0.38 0.00 0.12 0.00 0.00 56.93 57.32 1qf5 s PHE 297 Cb -0.04 -0.09 -0.15 0.00 -0.57 0.00 0.00 43.02 42.18 1qf5 s PHE 297 CO -0.05 -0.03 1.69 0.41 -0.10 0.00 0.00 175.22 177.14 1qf5 n GLY 298 N 3.47 0.93 0.03 4.36 0.00 0.43 -4.83 105.19 109.58 1qf5 n GLY 298 Ca -0.18 0.86 0.09 0.00 0.00 0.00 0.00 46.02 46.79 1qf5 n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qf5 n ALA 299 N 5.01 1.78 -0.07 4.61 0.00 -1.26 -0.33 120.51 130.25 1qf5 n ALA 299 Ca 0.24 -0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.53 1qf5 n ALA 299 Cb 0.19 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.27 1qf5 n ALA 299 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1qf5 n THR 300 N -1.66 0.77 0.26 0.00 -1.04 -1.26 -4.80 114.28 106.55 1qf5 n THR 300 Ca 0.04 -0.26 0.05 0.00 -2.04 0.00 0.00 64.05 61.84 1qf5 n THR 300 Cb 0.21 -1.20 -0.07 0.00 -1.82 0.00 0.00 70.33 67.45 1qf5 n THR 300 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1qf5 n THR 301 N -3.13 0.00 -0.94 12.58 -2.24 -1.24 -5.00 114.28 114.32 1qf5 n THR 301 Ca -0.25 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1qf5 n THR 301 Cb 0.73 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 1qf5 n THR 301 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qf5 n GLY 302 N 1.55 0.83 3.77 3.38 0.00 0.55 -4.95 105.19 110.33 1qf5 n GLY 302 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1qf5 n GLY 302 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qf5 s ARG 303 N -0.06 4.21 0.20 1.61 0.52 -1.26 -4.29 118.95 119.87 1qf5 s ARG 303 Ca 0.00 2.19 -0.30 0.00 -0.52 0.00 0.00 55.73 57.10 1qf5 s ARG 303 Cb 0.00 -2.95 -0.08 0.00 0.52 0.00 0.00 34.95 32.44 1qf5 s ARG 303 CO 0.00 -0.30 1.16 -0.98 0.02 0.00 0.00 175.30 175.20 1qf5 s ARG 304 N -1.97 4.54 0.36 3.54 1.04 -1.26 0.16 118.95 125.36 1qf5 s ARG 304 Ca 0.52 1.83 -0.15 0.00 -1.04 0.00 0.00 55.73 56.89 1qf5 s ARG 304 Cb -0.39 -3.24 -0.09 0.00 -2.04 0.00 0.00 34.95 29.19 1qf5 s ARG 304 CO 0.51 -0.00 0.78 1.03 -0.04 0.00 0.00 175.30 177.58 1qf5 s ARG 305 N -0.48 3.99 0.26 3.89 0.52 -0.62 -4.85 118.95 121.66 1qf5 s ARG 305 Ca 0.51 0.71 -0.25 0.00 -0.52 0.00 0.00 55.73 56.17 1qf5 s ARG 305 Cb -0.32 -2.38 -0.09 0.00 0.52 0.00 0.00 34.95 32.68 1qf5 s ARG 305 CO 0.37 0.09 0.87 1.03 0.02 0.00 0.00 175.30 177.68 1qf5 s ARG 306 N -3.19 4.57 0.30 3.54 0.52 0.56 -4.91 118.95 120.35 1qf5 s ARG 306 Ca 0.55 1.24 0.10 0.00 -0.52 0.00 0.00 55.73 57.10 1qf5 s ARG 306 Cb -0.10 -2.98 -0.06 0.00 0.52 0.00 0.00 34.95 32.33 1qf5 s ARG 306 CO 0.20 0.40 -0.12 0.95 0.02 0.00 0.00 175.30 176.74 1qf5 s THR 307 N -1.44 2.16 0.06 0.02 -4.23 -1.26 -2.07 115.64 108.87 1qf5 s THR 307 Ca 0.45 -2.25 -0.15 0.00 -1.18 0.00 0.00 61.69 58.56 1qf5 s THR 307 Cb -0.20 -2.46 0.05 0.00 1.34 0.00 0.00 72.50 71.23 1qf5 s THR 307 CO 0.25 -0.31 0.70 0.61 -0.54 0.00 0.00 174.62 175.33 1qf5 n GLY 308 N -0.67 0.65 3.89 3.99 0.00 -0.28 -1.64 105.19 111.13 1qf5 n GLY 308 Ca -0.05 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.66 1qf5 n GLY 308 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qf5 s TRP 309 N -3.10 3.37 0.23 1.61 0.52 -0.93 -1.47 118.94 119.18 1qf5 s TRP 309 Ca 0.16 1.01 -0.30 0.00 0.02 0.00 0.00 56.10 56.98 1qf5 s TRP 309 Cb -0.01 -2.92 -0.10 0.00 -1.15 0.00 0.00 33.47 29.29 1qf5 s TRP 309 CO 0.02 -0.99 1.44 -1.17 0.02 0.00 0.00 176.95 176.27 1qf5 s LEU 310 N -5.24 4.39 -0.45 2.99 2.96 -1.26 -3.84 118.68 118.23 1qf5 s LEU 310 Ca 0.56 2.63 -0.06 0.00 -0.22 0.00 0.00 54.13 57.04 1qf5 s LEU 310 Cb -0.11 -3.62 0.12 0.00 0.50 0.00 0.00 46.19 43.08 1qf5 s LEU 310 CO 0.51 -0.70 0.29 -0.62 -1.32 0.00 0.00 176.35 174.50 1qf5 s ASP 311 N 0.48 5.47 0.49 3.68 -1.08 -1.26 -1.26 116.67 123.18 1qf5 s ASP 311 Ca 0.60 -2.04 0.32 0.00 -0.52 0.00 0.00 52.55 50.91 1qf5 s ASP 311 Cb -0.41 -1.92 1.32 0.00 -1.46 0.00 0.00 42.92 40.45 1qf5 s ASP 311 CO 0.41 -0.60 1.93 0.71 0.52 0.00 0.00 175.17 178.14 1qf5 h THR 312 N 6.18 0.00 0.09 1.71 1.35 -1.65 -1.69 112.91 118.90 1qf5 h THR 312 Ca -0.16 -0.43 -0.00 0.00 -0.55 0.00 0.00 66.41 65.27 1qf5 h THR 312 Cb 1.05 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1qf5 h THR 312 CO 0.77 0.00 -0.05 0.58 -0.25 0.00 0.00 175.52 176.58 1qf5 h VAL 313 N 0.00 1.14 -0.64 6.82 2.07 -1.86 -0.09 116.25 123.69 1qf5 h VAL 313 Ca 0.00 -1.00 -0.06 0.00 0.82 0.00 0.00 66.70 66.46 1qf5 h VAL 313 Cb 0.46 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1qf5 h VAL 313 CO 0.00 0.24 0.16 0.00 0.02 0.00 0.00 177.57 177.98 1qf5 h ALA 314 N 0.23 1.07 -0.67 1.67 0.00 -1.90 -2.59 119.26 117.07 1qf5 h ALA 314 Ca -0.01 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1qf5 h ALA 314 Cb 0.49 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1qf5 h ALA 314 CO 0.02 0.61 0.16 0.28 0.00 0.00 0.00 179.25 180.33 1qf5 h VAL 315 N 0.95 1.25 -0.00 0.00 2.07 -1.28 -1.67 116.25 117.58 1qf5 h VAL 315 Ca 0.20 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 1qf5 h VAL 315 Cb 0.34 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1qf5 h VAL 315 CO -0.00 0.36 -0.08 0.03 0.02 0.00 0.00 177.57 177.90 1qf5 h ARG 316 N 1.00 0.00 -0.43 1.57 3.08 -0.61 -0.52 114.38 118.47 1qf5 h ARG 316 Ca 0.21 -0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.12 1qf5 h ARG 316 Cb 0.35 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1qf5 h ARG 316 CO 0.00 0.08 -0.27 -0.09 -1.07 0.00 0.00 179.97 178.62 1qf5 h ARG 317 N 0.00 0.94 -0.19 0.04 9.65 -1.11 -2.71 114.38 121.00 1qf5 h ARG 317 Ca -0.00 -0.44 -0.05 0.00 -1.10 0.00 0.00 59.98 58.39 1qf5 h ARG 317 Cb 0.14 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 1qf5 h ARG 317 CO 0.01 1.10 -0.11 0.00 2.80 0.00 0.00 179.97 183.77 1qf5 h ALA 318 N 0.82 1.46 -0.17 2.80 0.00 -0.84 -1.76 119.26 121.57 1qf5 h ALA 318 Ca 0.09 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1qf5 h ALA 318 Cb 0.86 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1qf5 h ALA 318 CO 0.08 0.38 0.10 0.28 0.00 0.00 0.00 179.25 180.09 1qf5 h VAL 319 N 0.29 1.08 -0.01 0.00 2.07 -0.83 -2.94 116.25 115.91 1qf5 h VAL 319 Ca 0.06 -0.20 -0.24 0.00 0.82 0.00 0.00 66.70 67.14 1qf5 h VAL 319 Cb 0.38 0.91 0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1qf5 h VAL 319 CO 0.02 0.07 -0.94 0.06 0.02 0.00 0.00 177.57 176.81 1qf5 h GLN 320 N 0.19 0.65 -0.25 1.57 3.07 -1.27 -2.14 115.11 116.93 1qf5 h GLN 320 Ca 0.06 -0.69 -0.04 0.00 0.09 0.00 0.00 58.65 58.08 1qf5 h GLN 320 Cb 0.03 0.19 -0.01 0.00 0.08 0.00 0.00 27.48 27.77 1qf5 h GLN 320 CO -0.01 1.28 -0.00 -0.07 0.09 0.00 0.00 178.83 180.12 1qf5 h LEU 321 N 0.30 0.34 -1.15 0.06 3.38 -1.40 -3.14 115.31 113.70 1qf5 h LEU 321 Ca -0.11 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1qf5 h LEU 321 Cb 1.60 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1qf5 h LEU 321 CO 0.18 0.41 -0.33 0.59 0.09 0.00 0.00 178.44 179.38 1qf5 n ASN 322 N -4.33 2.08 -3.84 -0.43 3.02 -1.11 -4.65 115.26 105.99 1qf5 n ASN 322 Ca 0.01 -1.54 -0.25 0.00 -0.03 0.00 0.00 54.58 52.77 1qf5 n ASN 322 Cb 0.21 0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 1qf5 n ASN 322 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1qf5 n SER 323 N 0.22 -1.16 -4.69 6.41 3.41 -0.84 -4.80 113.62 112.17 1qf5 n SER 323 Ca 0.09 -0.95 -0.43 0.00 -0.26 0.00 0.00 58.87 57.32 1qf5 n SER 323 Cb 0.44 -3.40 -0.01 0.00 -0.26 0.00 0.00 64.21 60.99 1qf5 n SER 323 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1qf5 n LEU 324 N -4.33 3.38 -0.09 1.04 4.77 -0.99 -4.63 117.00 116.15 1qf5 n LEU 324 Ca -0.28 1.20 -0.15 0.00 -0.03 0.00 0.00 56.01 56.75 1qf5 n LEU 324 Cb 0.67 -1.47 -0.14 0.00 -2.33 0.00 0.00 43.42 40.16 1qf5 n LEU 324 CO 0.72 -0.57 -1.13 -1.20 -1.33 0.00 0.00 177.39 173.87 1qf5 n SER 325 N 0.81 1.22 -3.39 -1.43 7.64 0.18 -4.95 113.62 113.69 1qf5 n SER 325 Ca 0.05 0.01 -0.06 0.00 1.01 0.00 0.00 58.87 59.88 1qf5 n SER 325 Cb 0.36 0.04 0.01 0.00 -1.01 0.00 0.00 64.21 63.60 1qf5 n SER 325 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1qf5 s GLY 326 N -5.91 0.09 0.33 0.23 0.00 -1.21 -4.51 107.32 96.34 1qf5 s GLY 326 Ca -0.22 -0.39 0.10 0.00 0.00 0.00 0.00 44.72 44.21 1qf5 s GLY 326 CO 0.72 0.40 -0.12 -1.36 0.00 0.00 0.00 173.10 172.74 1qf5 s PHE 327 N -2.83 2.37 -0.31 1.90 0.08 0.04 -1.48 117.98 117.76 1qf5 s PHE 327 Ca 0.15 -0.45 -0.01 0.00 0.12 0.00 0.00 56.93 56.74 1qf5 s PHE 327 Cb -0.04 -1.28 0.10 0.00 -0.57 0.00 0.00 43.02 41.23 1qf5 s PHE 327 CO 0.07 0.62 0.11 0.00 -0.10 0.00 0.00 175.22 175.92 1qf5 s LEU 329 N 1.65 4.34 0.24 0.00 2.96 -0.11 -1.31 118.68 126.45 1qf5 s LEU 329 Ca 0.10 1.97 0.09 0.00 -0.22 0.00 0.00 54.13 56.07 1qf5 s LEU 329 Cb -0.17 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.90 1qf5 s LEU 329 CO -0.26 -0.51 -0.15 0.42 -1.32 0.00 0.00 176.35 174.53 1qf5 s THR 330 N 1.43 1.96 -1.88 3.68 -4.23 0.51 0.10 115.64 117.21 1qf5 s THR 330 Ca 0.58 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1qf5 s THR 330 Cb -0.28 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.37 1qf5 s THR 330 CO 0.27 -0.49 0.00 0.29 -0.54 0.00 0.00 174.62 174.15 1qf5 n LYS 331 N -0.49 -1.61 -0.35 3.99 5.02 -1.22 -0.71 118.16 122.78 1qf5 n LYS 331 Ca -0.07 1.06 0.01 0.00 -2.02 0.00 0.00 58.31 57.29 1qf5 n LYS 331 Cb 0.61 -5.66 0.15 0.00 -0.02 0.00 0.00 35.03 30.11 1qf5 n LYS 331 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1qf5 h LEU 332 N 0.00 1.02 -2.21 -0.35 5.85 -1.86 -1.86 115.31 115.89 1qf5 h LEU 332 Ca -0.48 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1qf5 h LEU 332 Cb 1.36 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1qf5 h LEU 332 CO 0.59 0.68 0.09 -2.24 -0.34 0.00 0.00 178.44 177.22 1qf5 h ASP 333 N 1.17 0.00 1.70 1.25 2.03 -1.85 -0.29 116.42 120.44 1qf5 h ASP 333 Ca 0.40 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.67 1qf5 h ASP 333 Cb 0.08 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.57 1qf5 h ASP 333 CO -0.14 0.00 -0.12 0.58 -1.03 0.00 0.00 179.24 178.52 1qf5 h VAL 334 N 0.00 0.22 0.00 4.15 2.07 -1.68 -3.17 116.25 117.83 1qf5 h VAL 334 Ca 0.00 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1qf5 h VAL 334 Cb 0.19 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1qf5 h VAL 334 CO 0.00 0.12 0.00 0.18 0.02 0.00 0.00 177.57 177.89 1qf5 n LEU 335 N -3.15 0.00 -4.77 2.57 4.77 -0.12 -4.89 117.00 111.42 1qf5 n LEU 335 Ca 0.03 0.09 -0.41 0.00 -0.03 0.00 0.00 56.01 55.69 1qf5 n LEU 335 Cb 0.54 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 1qf5 n LEU 335 CO 0.34 -0.01 1.09 -1.81 -1.33 0.00 0.00 177.39 175.68 1qf5 s ASP 336 N -2.18 6.55 0.00 -1.43 1.01 -1.20 -3.28 116.67 116.14 1qf5 s ASP 336 Ca 0.38 2.84 0.00 0.00 0.71 0.00 0.00 52.55 56.48 1qf5 s ASP 336 Cb 0.19 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1qf5 s ASP 336 CO 0.36 -0.73 0.00 0.61 0.21 0.00 0.00 175.17 175.62 1qf5 n GLY 337 N 1.14 2.83 3.76 0.21 0.00 0.28 -4.99 105.19 108.42 1qf5 n GLY 337 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1qf5 n GLY 337 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qf5 n LEU 338 N 0.00 4.60 -0.10 0.99 4.77 -1.21 -4.71 117.00 121.34 1qf5 n LEU 338 Ca 0.00 1.19 -0.10 0.00 -0.03 0.00 0.00 56.01 57.07 1qf5 n LEU 338 Cb 0.00 -1.61 -0.02 0.00 -2.33 0.00 0.00 43.42 39.45 1qf5 n LEU 338 CO 0.00 0.16 0.87 0.11 -1.33 0.00 0.00 177.39 177.20 1qf5 h LYS 339 N 3.81 0.48 -3.88 3.23 1.79 -1.92 -3.09 116.57 116.99 1qf5 h LYS 339 Ca -0.49 -0.10 -0.17 0.00 -2.18 0.00 0.00 60.65 57.71 1qf5 h LYS 339 Cb 1.23 -0.07 -0.21 0.00 -1.58 0.00 0.00 32.23 31.60 1qf5 h LYS 339 CO 0.71 0.52 -0.66 -1.21 -1.08 0.00 0.00 179.45 177.73 1qf5 s GLU 340 N -5.42 0.33 -0.07 3.15 2.02 -1.26 -0.16 118.70 117.29 1qf5 s GLU 340 Ca -0.13 -0.54 0.05 0.00 0.02 0.00 0.00 54.97 54.37 1qf5 s GLU 340 Cb 0.09 0.12 -0.00 0.00 0.10 0.00 0.00 34.13 34.43 1qf5 s GLU 340 CO 0.74 -0.06 -0.23 0.14 0.02 0.00 0.00 175.26 175.87 1qf5 s VAL 341 N -1.37 1.94 0.30 2.63 -7.23 0.20 -4.73 120.40 112.13 1qf5 s VAL 341 Ca -0.15 -0.98 0.08 0.00 -1.81 0.00 0.00 61.98 59.12 1qf5 s VAL 341 Cb -0.09 -1.66 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 1qf5 s VAL 341 CO -0.00 0.54 0.21 -0.54 -0.31 0.00 0.00 175.10 174.99 1qf5 s LYS 342 N 0.10 2.72 -0.23 4.82 1.02 -1.26 0.15 119.74 127.06 1qf5 s LYS 342 Ca -0.10 -1.25 -0.05 0.00 0.02 0.00 0.00 55.97 54.59 1qf5 s LYS 342 Cb -0.15 -2.44 0.12 0.00 -0.52 0.00 0.00 37.83 34.83 1qf5 s LYS 342 CO 0.06 0.24 0.44 -0.48 -0.92 0.00 0.00 175.35 174.68 1qf5 s LEU 343 N -3.89 -0.74 0.12 3.17 2.34 -0.91 -4.23 118.68 114.53 1qf5 s LEU 343 Ca 0.37 0.76 -0.32 0.00 0.06 0.00 0.00 54.13 55.00 1qf5 s LEU 343 Cb -0.06 1.41 -0.12 0.00 -0.56 0.00 0.00 46.19 46.86 1qf5 s LEU 343 CO 0.25 -0.26 1.78 0.00 -1.06 0.00 0.00 176.35 177.06 1qf5 n VAL 345 N 4.40 0.00 -3.72 0.00 0.24 -0.40 -1.64 118.33 117.20 1qf5 n VAL 345 Ca 0.18 -0.39 -0.05 0.00 -2.04 0.00 0.00 64.34 62.05 1qf5 n VAL 345 Cb 0.34 1.02 -0.01 0.00 -1.47 0.00 0.00 33.84 33.72 1qf5 n VAL 345 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qf5 s ALA 346 N -1.38 -1.65 -0.01 2.33 0.00 -1.20 -4.76 121.76 115.09 1qf5 s ALA 346 Ca 0.03 0.23 0.08 0.00 0.00 0.00 0.00 51.96 52.30 1qf5 s ALA 346 Cb 0.05 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.77 1qf5 s ALA 346 CO 0.21 -0.99 -0.25 0.71 0.00 0.00 0.00 175.76 175.44 1qf5 s TYR 347 N -3.31 2.36 -0.31 0.00 2.02 0.08 -0.99 117.35 117.19 1qf5 s TYR 347 Ca 0.11 -0.41 -0.11 0.00 -0.37 0.00 0.00 57.07 56.29 1qf5 s TYR 347 Cb -0.02 -1.49 -0.02 0.00 -0.40 0.00 0.00 41.96 40.04 1qf5 s TYR 347 CO 0.01 0.01 0.19 0.50 -1.57 0.00 0.00 175.55 174.69 1qf5 s ARG 348 N -0.76 3.56 0.54 -0.62 6.06 0.71 -0.40 118.95 128.05 1qf5 s ARG 348 Ca 0.11 -0.58 -0.16 0.00 -2.50 0.00 0.00 55.73 52.59 1qf5 s ARG 348 Cb -0.10 -3.67 -0.07 0.00 0.06 0.00 0.00 34.95 31.17 1qf5 s ARG 348 CO -0.00 -0.36 1.01 -1.64 -2.50 0.00 0.00 175.30 171.81 1qf5 s MET 349 N 1.69 3.76 0.64 5.12 -1.94 0.16 -1.49 119.30 127.23 1qf5 s MET 349 Ca 0.06 1.02 0.30 0.00 -1.71 0.00 0.00 55.69 55.36 1qf5 s MET 349 Cb -0.17 -2.10 1.61 0.00 2.01 0.00 0.00 34.83 36.18 1qf5 s MET 349 CO 0.09 -0.43 1.94 -1.35 -0.01 0.00 0.00 175.02 175.25 1qf5 h PRO 350 N 0.75 0.00 -0.12 2.03 0.11 -1.88 0.39 132.00 133.29 1qf5 h PRO 350 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1qf5 h PRO 350 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1qf5 h PRO 350 CO 0.60 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.99 1qf5 n ASP 351 N -3.19 2.18 0.00 -2.05 5.68 -1.26 -4.95 116.55 112.96 1qf5 n ASP 351 Ca 0.01 -1.74 0.00 0.00 -0.50 0.00 0.00 54.79 52.55 1qf5 n ASP 351 Cb 0.44 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 1qf5 n ASP 351 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qf5 n GLY 352 N 1.25 2.88 3.77 6.12 0.00 0.13 -5.07 105.19 114.27 1qf5 n GLY 352 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1qf5 n GLY 352 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qf5 s ARG 353 N -0.52 3.82 -0.34 1.61 0.52 -1.26 -4.70 118.95 118.09 1qf5 s ARG 353 Ca 0.00 2.00 -0.11 0.00 -0.52 0.00 0.00 55.73 57.10 1qf5 s ARG 353 Cb 0.00 -2.59 -0.00 0.00 0.52 0.00 0.00 34.95 32.88 1qf5 s ARG 353 CO 0.00 -0.56 0.20 -2.00 0.02 0.00 0.00 175.30 172.95 1qf5 s GLU 354 N -2.45 3.26 0.29 3.54 2.12 -1.26 0.36 118.70 124.56 1qf5 s GLU 354 Ca 0.60 -0.79 0.10 0.00 0.36 0.00 0.00 54.97 55.25 1qf5 s GLU 354 Cb -0.34 -3.69 -0.05 0.00 0.26 0.00 0.00 34.13 30.31 1qf5 s GLU 354 CO 0.43 -0.50 -0.03 0.14 -0.54 0.00 0.00 175.26 174.76 1qf5 s VAL 355 N 1.64 3.09 -0.03 3.70 -7.23 0.46 -4.95 120.40 117.08 1qf5 s VAL 355 Ca 0.05 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.26 1qf5 s VAL 355 Cb -0.18 -2.75 0.07 0.00 0.56 0.00 0.00 36.38 34.08 1qf5 s VAL 355 CO 0.08 -0.33 0.99 0.35 -0.31 0.00 0.00 175.10 175.87 1qf5 n THR 356 N -0.88 1.08 -4.38 5.32 -2.24 -1.26 -0.74 114.28 111.18 1qf5 n THR 356 Ca -0.05 -1.17 -0.24 0.00 -2.27 0.00 0.00 64.05 60.32 1qf5 n THR 356 Cb 0.60 0.38 -0.11 0.00 -2.10 0.00 0.00 70.33 69.09 1qf5 n THR 356 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1qf5 s THR 357 N -1.31 2.06 0.32 4.28 -4.23 -1.26 -4.88 115.64 110.63 1qf5 s THR 357 Ca 0.07 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.52 1qf5 s THR 357 Cb 0.06 -1.98 -0.06 0.00 1.34 0.00 0.00 72.50 71.87 1qf5 s THR 357 CO 0.01 -0.25 0.62 0.42 -0.54 0.00 0.00 174.62 174.87 1qf5 s THR 358 N -1.95 4.95 0.88 3.99 -4.23 -1.26 -4.91 115.64 113.12 1qf5 s THR 358 Ca 0.19 0.22 -0.13 0.00 -1.18 0.00 0.00 61.69 60.79 1qf5 s THR 358 Cb -0.06 -3.73 0.13 0.00 1.34 0.00 0.00 72.50 70.17 1qf5 s THR 358 CO 0.08 -0.38 1.17 -2.84 -0.54 0.00 0.00 174.62 172.12 1qf5 s PRO 359 N -3.63 1.35 0.00 3.99 0.02 -1.26 -5.06 135.00 130.41 1qf5 s PRO 359 Ca 0.46 0.13 0.00 0.00 0.02 0.00 0.00 61.00 61.61 1qf5 s PRO 359 Cb -0.11 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.54 1qf5 s PRO 359 CO 0.30 -2.02 0.00 1.28 -0.33 0.00 0.00 177.00 176.23 1qf5 n LEU 360 N -3.61 0.28 -4.73 -5.54 4.77 -1.26 -5.00 117.00 101.91 1qf5 n LEU 360 Ca 0.08 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.70 1qf5 n LEU 360 Cb 0.60 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.76 1qf5 n LEU 360 CO 0.55 0.00 0.86 0.00 -1.33 0.00 0.00 177.39 177.48 1qf5 s ALA 361 N -4.64 2.33 0.34 -1.18 0.00 -1.26 -4.27 121.76 113.08 1qf5 s ALA 361 Ca 0.00 1.09 0.07 0.00 0.00 0.00 0.00 51.96 53.12 1qf5 s ALA 361 Cb 0.00 -3.51 0.76 0.00 0.00 0.00 0.00 23.12 20.37 1qf5 s ALA 361 CO 0.00 -1.60 1.85 0.00 0.00 0.00 0.00 175.76 176.01 1qf5 h ALA 362 N 0.37 1.77 0.00 0.00 0.00 -0.97 -1.78 119.26 118.65 1qf5 h ALA 362 Ca -0.50 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 1qf5 h ALA 362 Cb 1.32 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1qf5 h ALA 362 CO 0.52 -0.02 -0.02 -0.44 0.00 0.00 0.00 179.25 179.29 1qf5 h ASP 363 N 0.75 0.00 -0.02 0.00 3.32 -1.91 -1.95 116.42 116.61 1qf5 h ASP 363 Ca 0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.52 1qf5 h ASP 363 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1qf5 h ASP 363 CO -0.23 0.02 0.00 0.47 -1.72 0.00 0.00 179.24 177.78 1qf5 n ASP 364 N -4.18 0.44 -0.01 6.45 9.92 -0.67 -3.21 116.55 125.30 1qf5 n ASP 364 Ca -0.03 -1.32 0.10 0.00 -0.53 0.00 0.00 54.79 53.02 1qf5 n ASP 364 Cb 0.11 -0.01 -0.16 0.00 -0.64 0.00 0.00 41.12 40.41 1qf5 n ASP 364 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1qf5 n TRP 365 N -0.58 0.00 -0.02 1.24 7.02 -0.73 -4.78 117.44 119.59 1qf5 n TRP 365 Ca 0.19 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.66 1qf5 n TRP 365 Cb 0.16 -0.48 -0.00 0.00 -2.42 0.00 0.00 31.31 28.57 1qf5 n TRP 365 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1qf5 n LYS 366 N -2.22 -0.02 -0.42 -0.99 0.00 -1.20 -0.46 118.16 112.85 1qf5 n LYS 366 Ca -0.04 0.09 0.10 0.00 0.00 0.00 0.00 58.31 58.47 1qf5 n LYS 366 Cb 0.54 -0.14 0.31 0.00 0.00 0.00 0.00 35.03 35.74 1qf5 n LYS 366 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1qf5 n GLY 367 N -1.01 2.67 3.76 3.14 0.00 -1.26 -5.00 105.19 107.49 1qf5 n GLY 367 Ca 0.00 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 1qf5 n GLY 367 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qf5 s VAL 368 N -1.32 2.38 -0.04 1.61 1.01 0.39 -4.16 120.40 120.27 1qf5 s VAL 368 Ca 0.46 0.34 0.05 0.00 0.00 0.00 0.00 61.98 62.83 1qf5 s VAL 368 Cb 0.26 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 1qf5 s VAL 368 CO 0.27 0.07 -0.20 -1.61 0.00 0.00 0.00 175.10 173.63 1qf5 s GLU 369 N -1.15 1.95 0.42 2.72 0.41 -0.56 -4.88 118.70 117.60 1qf5 s GLU 369 Ca 0.56 -0.72 -0.23 0.00 -0.41 0.00 0.00 54.97 54.18 1qf5 s GLU 369 Cb -0.44 -1.72 -0.09 0.00 -1.78 0.00 0.00 34.13 30.09 1qf5 s GLU 369 CO 0.52 0.33 1.01 -1.25 -0.49 0.00 0.00 175.26 175.37 1qf5 s PRO 370 N -0.15 4.16 -0.31 0.39 0.04 -1.26 -0.20 135.00 137.66 1qf5 s PRO 370 Ca -0.01 1.35 -0.01 0.00 0.04 0.00 0.00 61.00 62.38 1qf5 s PRO 370 Cb -0.11 -2.38 0.07 0.00 0.04 0.00 0.00 34.50 32.11 1qf5 s PRO 370 CO 0.02 -0.12 0.02 0.42 0.04 0.00 0.00 177.00 177.37 1qf5 s ILE 371 N -1.86 2.82 0.82 0.56 1.01 -0.16 -4.82 121.20 119.56 1qf5 s ILE 371 Ca 0.60 -1.62 -0.10 0.00 0.00 0.00 0.00 60.65 59.53 1qf5 s ILE 371 Cb -0.17 -2.72 0.12 0.00 0.01 0.00 0.00 42.46 39.70 1qf5 s ILE 371 CO 0.22 -0.23 1.15 -0.31 0.00 0.00 0.00 174.94 175.77 1qf5 s TYR 372 N 1.17 2.29 -0.10 3.97 2.02 -1.26 -1.28 117.35 124.16 1qf5 s TYR 372 Ca -0.02 0.37 -0.03 0.00 -0.37 0.00 0.00 57.07 57.01 1qf5 s TYR 372 Cb -0.20 -3.55 0.05 0.00 -0.40 0.00 0.00 41.96 37.86 1qf5 s TYR 372 CO -0.03 -1.95 0.13 -2.00 -1.57 0.00 0.00 175.55 170.13 1qf5 s GLU 373 N -5.52 0.03 -0.01 -0.62 2.12 -1.14 -4.78 118.70 108.77 1qf5 s GLU 373 Ca 0.66 0.37 -0.15 0.00 0.36 0.00 0.00 54.97 56.22 1qf5 s GLU 373 Cb -0.08 -0.70 -0.06 0.00 0.26 0.00 0.00 34.13 33.56 1qf5 s GLU 373 CO 0.48 -0.41 0.40 0.99 -0.54 0.00 0.00 175.26 176.18 1qf5 s THR 374 N 2.24 5.05 0.07 -1.70 2.01 -1.26 -2.15 115.64 119.90 1qf5 s THR 374 Ca 0.04 0.83 0.04 0.00 0.31 0.00 0.00 61.69 62.90 1qf5 s THR 374 Cb -0.13 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 1qf5 s THR 374 CO -0.06 0.57 -0.11 -0.04 -0.69 0.00 0.00 174.62 174.28 1qf5 s MET 375 N -0.99 0.73 0.25 4.92 -1.94 0.12 -4.98 119.30 117.41 1qf5 s MET 375 Ca 0.23 -0.94 -0.30 0.00 -1.71 0.00 0.00 55.69 52.97 1qf5 s MET 375 Cb -0.16 -0.58 -0.09 0.00 2.01 0.00 0.00 34.83 36.00 1qf5 s MET 375 CO 0.13 0.11 1.27 -1.25 -0.01 0.00 0.00 175.02 175.27 1qf5 s PRO 376 N -1.96 4.43 0.00 2.03 0.04 -1.26 0.60 135.00 138.88 1qf5 s PRO 376 Ca -0.03 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1qf5 s PRO 376 Cb -0.08 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1qf5 s PRO 376 CO 0.01 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.31 1qf5 n GLY 377 N 1.72 0.49 3.44 0.56 0.00 0.78 -4.60 105.19 107.58 1qf5 n GLY 377 Ca 0.03 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 1qf5 n GLY 377 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1qf5 s TRP 378 N 0.29 -0.64 -0.15 1.61 -2.14 -1.17 -4.81 118.94 111.94 1qf5 s TRP 378 Ca 0.00 1.50 0.18 0.00 2.66 0.00 0.00 56.10 60.44 1qf5 s TRP 378 Cb 0.00 0.25 -0.10 0.00 -3.10 0.00 0.00 33.47 30.52 1qf5 s TRP 378 CO 0.00 -0.32 0.89 0.77 -2.66 0.00 0.00 176.95 175.64 1qf5 h SER 379 N 5.65 0.00 -4.02 -2.66 0.02 -1.84 0.80 113.55 111.51 1qf5 h SER 379 Ca -0.29 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.14 1qf5 h SER 379 Cb 1.18 0.00 0.09 0.00 0.14 0.00 0.00 62.40 63.81 1qf5 h SER 379 CO 0.18 0.47 0.53 -1.83 -1.14 0.00 0.00 176.83 175.04 1qf5 s GLU 380 N -3.01 3.53 0.05 3.45 -1.05 -1.26 -4.30 118.70 116.12 1qf5 s GLU 380 Ca -0.02 1.96 -0.28 0.00 -0.15 0.00 0.00 54.97 56.48 1qf5 s GLU 380 Cb 0.09 -2.36 -0.05 0.00 -0.44 0.00 0.00 34.13 31.37 1qf5 s GLU 380 CO 0.80 -0.79 0.88 0.45 0.95 0.00 0.00 175.26 177.56 1qf5 s SER 381 N -1.19 7.34 0.00 0.83 0.15 -1.26 -4.61 113.70 114.96 1qf5 s SER 381 Ca 0.66 1.61 0.10 0.00 0.70 0.00 0.00 55.95 59.02 1qf5 s SER 381 Cb -0.33 -2.53 0.03 0.00 -1.71 0.00 0.00 66.02 61.48 1qf5 s SER 381 CO 0.40 -0.09 0.71 0.35 1.20 0.00 0.00 173.24 175.82 1qf5 n THR 382 N 3.11 0.00 -1.69 6.45 -2.24 -1.26 -4.96 114.28 113.69 1qf5 n THR 382 Ca 0.01 -0.44 -0.44 0.00 -2.27 0.00 0.00 64.05 60.91 1qf5 n THR 382 Cb 0.50 1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.86 1qf5 n THR 382 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1qf5 n PHE 383 N 0.10 2.32 -0.50 4.78 -0.00 -1.26 -2.07 117.46 120.84 1qf5 n PHE 383 Ca 0.05 0.38 0.00 0.00 -0.00 0.00 0.00 57.45 57.88 1qf5 n PHE 383 Cb 0.23 -2.50 0.00 0.00 -0.00 0.00 0.00 39.48 37.21 1qf5 n PHE 383 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1qf5 n GLY 384 N 2.29 0.79 3.70 7.13 0.00 0.42 -4.96 105.19 114.56 1qf5 n GLY 384 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1qf5 n GLY 384 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qf5 s VAL 385 N -2.28 2.59 -0.17 1.61 1.01 -0.88 -4.80 120.40 117.47 1qf5 s VAL 385 Ca 0.00 0.27 0.17 0.00 0.00 0.00 0.00 61.98 62.42 1qf5 s VAL 385 Cb 0.00 -3.17 0.44 0.00 0.00 0.00 0.00 36.38 33.65 1qf5 s VAL 385 CO 0.00 0.01 1.33 0.29 0.00 0.00 0.00 175.10 176.73 1qf5 n LYS 386 N 4.82 2.25 -3.71 2.72 5.02 -1.26 -4.56 118.16 123.43 1qf5 n LYS 386 Ca 0.16 -2.79 -0.11 0.00 -2.02 0.00 0.00 58.31 53.54 1qf5 n LYS 386 Cb 0.38 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.57 1qf5 n LYS 386 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1qf5 s ASP 387 N -2.34 -0.51 0.30 4.39 -4.77 -1.26 -4.76 116.67 107.72 1qf5 s ASP 387 Ca 0.39 0.91 0.06 0.00 -3.30 0.00 0.00 52.55 50.61 1qf5 s ASP 387 Cb 0.33 0.84 0.78 0.00 -1.09 0.00 0.00 42.92 43.78 1qf5 s ASP 387 CO 0.06 -0.18 1.72 0.03 0.70 0.00 0.00 175.17 177.50 1qf5 h ARG 388 N 6.45 0.49 -1.03 2.11 3.08 -1.97 0.73 114.38 124.23 1qf5 h ARG 388 Ca -0.33 -0.03 0.28 0.00 0.07 0.00 0.00 59.98 59.97 1qf5 h ARG 388 Cb 1.18 -0.11 -0.07 0.00 0.08 0.00 0.00 29.97 31.06 1qf5 h ARG 388 CO 0.27 0.33 0.70 0.77 -1.07 0.00 0.00 179.97 180.96 1qf5 h SER 389 N 0.51 0.25 0.09 7.04 0.02 -2.01 0.44 113.55 119.88 1qf5 h SER 389 Ca 0.59 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.58 1qf5 h SER 389 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1qf5 h SER 389 CO -0.49 0.06 0.00 0.61 -1.14 0.00 0.00 176.83 175.87 1qf5 n GLY 390 N -1.60 -1.04 3.73 -3.77 0.00 0.25 -4.81 105.19 97.95 1qf5 n GLY 390 Ca 0.23 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1qf5 n GLY 390 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qf5 s LEU 391 N -2.09 4.28 0.58 0.99 1.43 0.15 -4.89 118.68 119.14 1qf5 s LEU 391 Ca 0.45 0.74 -0.20 0.00 -1.03 0.00 0.00 54.13 54.09 1qf5 s LEU 391 Cb 0.22 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 1qf5 s LEU 391 CO 0.38 0.05 1.32 -0.81 0.23 0.00 0.00 176.35 177.53 1qf5 n PRO 392 N 3.51 1.47 -0.31 1.29 -0.04 -1.26 -4.79 135.00 134.87 1qf5 n PRO 392 Ca -0.09 0.55 0.10 0.00 -0.04 0.00 0.00 63.50 64.02 1qf5 n PRO 392 Cb 0.52 -2.55 0.27 0.00 -0.04 0.00 0.00 33.50 31.70 1qf5 n PRO 392 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1qf5 h GLN 393 N 1.10 0.59 -0.12 0.54 5.75 -1.97 0.82 115.11 121.82 1qf5 h GLN 393 Ca -0.51 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 57.95 1qf5 h GLN 393 Cb 1.32 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.73 1qf5 h GLN 393 CO 0.55 0.39 0.05 0.00 -2.65 0.00 0.00 178.83 177.18 1qf5 h ALA 394 N 1.61 1.87 -0.24 3.38 0.00 -1.90 -1.32 119.26 122.66 1qf5 h ALA 394 Ca 0.51 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.31 1qf5 h ALA 394 Cb 0.81 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1qf5 h ALA 394 CO -0.40 0.11 -0.18 0.00 0.00 0.00 0.00 179.25 178.78 1qf5 h ALA 395 N 1.89 0.35 -0.54 0.00 0.00 -1.18 -2.37 119.26 117.41 1qf5 h ALA 395 Ca 0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1qf5 h ALA 395 Cb 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1qf5 h ALA 395 CO -0.01 0.26 0.18 -0.07 0.00 0.00 0.00 179.25 179.62 1qf5 h LEU 396 N 0.25 0.73 -0.51 0.00 3.38 -0.91 -1.14 115.31 117.12 1qf5 h LEU 396 Ca 0.05 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 1qf5 h LEU 396 Cb 0.72 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1qf5 h LEU 396 CO 0.05 0.68 -0.38 0.78 0.09 0.00 0.00 178.44 179.66 1qf5 h ASN 397 N 0.78 0.85 -0.73 -0.43 -0.26 -1.25 -0.41 115.58 114.13 1qf5 h ASN 397 Ca 0.18 -0.38 -0.03 0.00 -0.56 0.00 0.00 56.30 55.51 1qf5 h ASN 397 Cb 0.21 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 37.19 1qf5 h ASN 397 CO -0.01 1.13 0.33 0.22 -1.06 0.00 0.00 177.43 178.05 1qf5 h TYR 398 N 0.66 1.07 -0.36 1.19 3.20 -1.06 0.58 116.97 122.24 1qf5 h TYR 398 Ca 0.06 -0.06 -0.08 0.00 3.14 0.00 0.00 58.73 61.79 1qf5 h TYR 398 Cb 0.94 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 1qf5 h TYR 398 CO 0.05 0.80 -0.08 0.82 -1.64 0.00 0.00 178.16 178.11 1qf5 h ILE 399 N 1.03 1.28 -0.16 1.81 2.04 -1.04 -2.79 117.51 119.68 1qf5 h ILE 399 Ca 0.25 -1.15 -0.11 0.00 1.00 0.00 0.00 64.86 64.86 1qf5 h ILE 399 Cb 0.15 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1qf5 h ILE 399 CO -0.03 0.38 -0.36 0.50 0.00 0.00 0.00 178.15 178.64 1qf5 h LYS 400 N 0.49 0.33 -0.23 2.37 1.63 -0.78 -2.64 116.57 117.74 1qf5 h LYS 400 Ca 0.09 -0.15 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 1qf5 h LYS 400 Cb 0.59 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.20 1qf5 h LYS 400 CO 0.03 0.65 0.03 -0.09 -3.45 0.00 0.00 179.45 176.63 1qf5 h ARG 401 N 0.28 0.38 -0.54 1.90 9.65 -0.88 0.38 114.38 125.56 1qf5 h ARG 401 Ca 0.03 -0.10 0.06 0.00 -1.10 0.00 0.00 59.98 58.87 1qf5 h ARG 401 Cb 0.78 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 29.26 1qf5 h ARG 401 CO 0.06 0.52 0.24 0.82 2.80 0.00 0.00 179.97 184.41 1qf5 h ILE 402 N 0.18 0.87 -0.78 1.20 2.04 -1.40 0.20 117.51 119.82 1qf5 h ILE 402 Ca 0.07 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1qf5 h ILE 402 Cb 0.33 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 1qf5 h ILE 402 CO 0.01 0.08 0.39 -0.33 0.00 0.00 0.00 178.15 178.30 1qf5 h GLU 403 N 0.45 1.11 0.03 2.37 5.08 -1.19 -0.66 114.58 121.76 1qf5 h GLU 403 Ca 0.25 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1qf5 h GLU 403 Cb 0.23 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1qf5 h GLU 403 CO -0.22 0.84 -0.01 0.93 -1.00 0.00 0.00 179.01 179.55 1qf5 h GLU 404 N 1.10 -0.04 0.00 2.33 5.08 0.62 0.56 114.58 124.24 1qf5 h GLU 404 Ca 0.27 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1qf5 h GLU 404 Cb 0.08 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1qf5 h GLU 404 CO -0.04 0.19 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.03 1qf5 h LEU 405 N -0.26 0.00 0.00 1.33 3.38 -0.52 -3.28 115.31 115.95 1qf5 h LEU 405 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1qf5 h LEU 405 Cb 0.24 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1qf5 h LEU 405 CO 0.01 0.06 -2.32 0.41 0.09 0.00 0.00 178.44 176.69 1qf5 n THR 406 N -3.26 1.33 -1.00 0.22 -1.04 -0.27 -4.98 114.28 105.27 1qf5 n THR 406 Ca -0.01 -0.62 -0.00 0.00 -2.04 0.00 0.00 64.05 61.38 1qf5 n THR 406 Cb 0.27 -1.03 -0.00 0.00 -1.82 0.00 0.00 70.33 67.75 1qf5 n THR 406 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1qf5 n GLY 407 N 2.18 0.42 3.03 3.41 0.00 0.19 -5.02 105.19 109.40 1qf5 n GLY 407 Ca -0.38 -0.77 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 1qf5 n GLY 407 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qf5 s VAL 408 N -2.00 1.04 0.37 1.61 1.01 -1.24 -5.08 120.40 116.10 1qf5 s VAL 408 Ca 0.00 -0.46 -0.25 0.00 0.00 0.00 0.00 61.98 61.26 1qf5 s VAL 408 Cb 0.00 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 35.36 1qf5 s VAL 408 CO 0.00 0.32 1.09 -2.16 0.00 0.00 0.00 175.10 174.35 1qf5 s PRO 409 N 0.41 4.24 -0.50 2.72 0.04 -1.26 -4.53 135.00 136.11 1qf5 s PRO 409 Ca -0.09 1.65 -0.20 0.00 0.04 0.00 0.00 61.00 62.41 1qf5 s PRO 409 Cb -0.13 -2.71 0.05 0.00 0.04 0.00 0.00 34.50 31.75 1qf5 s PRO 409 CO 0.02 -0.11 0.64 0.42 0.04 0.00 0.00 177.00 178.02 1qf5 s ILE 410 N -1.49 4.84 -0.45 0.56 1.01 -1.26 -0.78 121.20 123.63 1qf5 s ILE 410 Ca 0.55 -0.39 0.23 0.00 0.00 0.00 0.00 60.65 61.04 1qf5 s ILE 410 Cb -0.26 -4.30 0.05 0.00 0.01 0.00 0.00 42.46 37.96 1qf5 s ILE 410 CO 0.33 -0.80 1.23 0.44 0.00 0.00 0.00 174.94 176.14 1qf5 h ASP 411 N 9.00 0.00 -3.67 3.58 3.32 -1.43 -3.47 116.42 123.76 1qf5 h ASP 411 Ca -0.27 -0.10 -0.22 0.00 0.02 0.00 0.00 57.03 56.46 1qf5 h ASP 411 Cb 1.09 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.36 1qf5 h ASP 411 CO 0.96 0.05 -0.59 -0.63 -1.72 0.00 0.00 179.24 177.31 1qf5 s ILE 412 N -3.25 -0.02 -0.10 0.35 1.01 -1.16 0.17 121.20 118.20 1qf5 s ILE 412 Ca 0.03 0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.77 1qf5 s ILE 412 Cb 0.11 -0.18 0.01 0.00 0.01 0.00 0.00 42.46 42.41 1qf5 s ILE 412 CO 0.74 0.02 -0.17 -0.63 0.00 0.00 0.00 174.94 174.90 1qf5 s ILE 413 N 0.41 1.62 -0.17 2.92 1.01 -0.74 -0.93 121.20 125.33 1qf5 s ILE 413 Ca -0.03 -0.74 -0.07 0.00 0.00 0.00 0.00 60.65 59.82 1qf5 s ILE 413 Cb -0.04 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 1qf5 s ILE 413 CO -0.02 0.46 0.06 -0.55 0.00 0.00 0.00 174.94 174.90 1qf5 s SER 414 N 0.74 5.66 -0.12 3.58 0.15 0.12 -1.77 113.70 122.06 1qf5 s SER 414 Ca -0.11 0.12 0.18 0.00 0.70 0.00 0.00 55.95 56.84 1qf5 s SER 414 Cb -0.16 -1.93 0.27 0.00 -1.71 0.00 0.00 66.02 62.49 1qf5 s SER 414 CO 0.02 0.22 1.14 0.35 1.20 0.00 0.00 173.24 176.17 1qf5 n THR 415 N 3.26 1.79 0.00 6.45 -2.24 -0.87 -3.43 114.28 119.24 1qf5 n THR 415 Ca -0.17 -2.14 0.00 0.00 -2.27 0.00 0.00 64.05 59.47 1qf5 n THR 415 Cb 0.53 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1qf5 n THR 415 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qf5 n GLY 416 N -1.35 0.99 0.17 3.38 0.00 -1.21 -0.44 105.19 106.74 1qf5 n GLY 416 Ca 0.15 -0.80 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 1qf5 n GLY 416 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qf5 h PRO 417 N 0.00 0.22 -7.02 1.61 0.13 -1.96 -3.44 132.00 121.53 1qf5 h PRO 417 Ca 0.00 -0.14 -0.54 0.00 -0.87 0.00 0.00 66.00 64.45 1qf5 h PRO 417 Cb 0.00 0.02 0.11 0.00 0.13 0.00 0.00 31.00 31.26 1qf5 h PRO 417 CO 0.00 0.73 0.58 0.34 -0.23 0.00 0.00 178.00 179.42 1qf5 s ASP 418 N -6.89 5.63 0.29 1.44 -1.08 -1.26 -4.29 116.67 110.51 1qf5 s ASP 418 Ca -0.04 2.64 0.03 0.00 -0.52 0.00 0.00 52.55 54.65 1qf5 s ASP 418 Cb 0.12 -2.63 0.72 0.00 -1.46 0.00 0.00 42.92 39.67 1qf5 s ASP 418 CO 0.79 -1.31 1.66 -0.09 0.52 0.00 0.00 175.17 176.74 1qf5 h ARG 419 N 1.76 0.27 0.00 4.34 2.43 -1.47 -0.97 114.38 120.74 1qf5 h ARG 419 Ca -0.50 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1qf5 h ARG 419 Cb 1.28 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1qf5 h ARG 419 CO 0.59 0.18 0.00 1.79 -1.51 0.00 0.00 179.97 181.01 1qf5 h THR 420 N 0.27 0.00 -0.09 0.20 1.35 -1.91 -3.39 112.91 109.35 1qf5 h THR 420 Ca 0.55 -0.45 -0.71 0.00 -0.55 0.00 0.00 66.41 65.26 1qf5 h THR 420 Cb 1.09 1.40 -0.03 0.00 -1.73 0.00 0.00 68.15 68.88 1qf5 h THR 420 CO -0.60 0.00 3.21 -0.62 -0.25 0.00 0.00 175.52 177.26 1qf5 n GLU 421 N -2.30 3.09 -3.99 4.72 1.02 -0.37 -4.84 120.64 117.97 1qf5 n GLU 421 Ca 0.05 -2.58 -0.09 0.00 -0.02 0.00 0.00 57.16 54.51 1qf5 n GLU 421 Cb 0.39 -3.16 -0.05 0.00 -0.02 0.00 0.00 31.44 28.60 1qf5 n GLU 421 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1qf5 s THR 422 N 2.78 0.00 -0.24 2.62 2.01 -1.26 -2.05 115.64 119.49 1qf5 s THR 422 Ca 0.51 -1.39 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 1qf5 s THR 422 Cb 0.15 -2.23 0.13 0.00 0.01 0.00 0.00 72.50 70.55 1qf5 s THR 422 CO -0.08 0.00 0.34 0.00 -0.69 0.00 0.00 174.62 174.19 1qf5 s MET 423 N -3.93 0.32 -0.58 4.92 0.23 -0.73 -4.57 119.30 114.96 1qf5 s MET 423 Ca 0.22 0.36 -0.23 0.00 -1.03 0.00 0.00 55.69 55.01 1qf5 s MET 423 Cb -0.01 -0.63 0.05 0.00 -1.53 0.00 0.00 34.83 32.71 1qf5 s MET 423 CO 0.09 -0.72 0.93 0.42 -2.03 0.00 0.00 175.02 173.71 1qf5 s ILE 424 N 2.48 4.40 -0.15 3.16 1.01 -1.26 -1.79 121.20 129.05 1qf5 s ILE 424 Ca 0.11 0.03 0.22 0.00 0.00 0.00 0.00 60.65 61.01 1qf5 s ILE 424 Cb -0.15 -4.57 0.24 0.00 0.01 0.00 0.00 42.46 37.99 1qf5 s ILE 424 CO -0.18 -1.20 1.66 -0.07 0.00 0.00 0.00 174.94 175.15 1qf5 h LEU 425 N 11.01 0.00 -7.00 2.97 3.38 -0.62 -3.45 115.31 121.60 1qf5 h LEU 425 Ca -0.27 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1qf5 h LEU 425 Cb 1.07 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.61 1qf5 h LEU 425 CO 1.11 0.21 0.06 -0.60 0.09 0.00 0.00 178.44 179.30 1qf5 s ARG 426 N -3.30 0.72 -0.19 1.13 3.52 -0.54 -5.03 118.95 115.27 1qf5 s ARG 426 Ca 0.04 1.16 -0.19 0.00 -0.13 0.00 0.00 55.73 56.61 1qf5 s ARG 426 Cb 0.08 0.19 -0.03 0.00 -1.56 0.00 0.00 34.95 33.62 1qf5 s ARG 426 CO 0.67 -0.14 0.53 0.34 -0.81 0.00 0.00 175.30 175.90 1qf5 s ASP 427 N 1.39 6.61 0.51 -2.12 -1.08 -1.26 -4.68 116.67 116.04 1qf5 s ASP 427 Ca -0.08 0.73 0.22 0.00 -0.52 0.00 0.00 52.55 52.90 1qf5 s ASP 427 Cb -0.05 -2.30 1.32 0.00 -1.46 0.00 0.00 42.92 40.43 1qf5 s ASP 427 CO -0.16 -0.17 2.02 -0.65 0.52 0.00 0.00 175.17 176.74 1qf5 h PRO 428 N 7.35 0.05 -0.09 4.34 0.11 -1.93 -0.75 132.00 141.08 1qf5 h PRO 428 Ca -0.34 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.62 1qf5 h PRO 428 Cb 1.16 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1qf5 h PRO 428 CO 0.75 0.04 -0.59 0.74 -0.21 0.00 0.00 178.00 178.73 1qf5 h PHE 429 N 0.06 0.38 0.00 0.65 0.04 -1.93 0.58 116.94 116.71 1qf5 h PHE 429 Ca 0.20 -0.14 -0.17 0.00 2.80 0.00 0.00 57.97 60.66 1qf5 h PHE 429 Cb 0.74 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.80 1qf5 h PHE 429 CO -0.00 0.81 -0.97 -0.44 -0.60 0.00 0.00 178.31 177.11 1qf5 h ASP 430 N 0.22 0.00 -0.00 2.17 3.32 -1.56 0.46 116.42 121.03 1qf5 h ASP 430 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1qf5 h ASP 430 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1qf5 h ASP 430 CO 0.09 0.73 0.00 0.00 -1.72 0.00 0.00 179.24 178.34