#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iq8 h MET 7 N 0.00 0.21 -5.04 1.97 2.86 -2.00 -3.43 114.93 109.49 1iq8 h MET 7 Ca 0.00 -0.10 -0.56 0.00 -2.06 0.00 0.00 59.70 56.98 1iq8 h MET 7 Cb 0.00 -0.00 -0.32 0.00 0.06 0.00 0.00 31.60 31.34 1iq8 h MET 7 CO 0.00 0.60 -0.83 -1.17 1.06 0.00 0.00 176.91 176.57 1iq8 s LEU 8 N -8.19 1.85 -0.00 1.22 1.98 -1.26 -4.02 118.68 110.25 1iq8 s LEU 8 Ca -0.04 -0.35 0.08 0.00 -2.89 0.00 0.00 54.13 50.92 1iq8 s LEU 8 Cb 0.13 -0.96 -0.02 0.00 0.66 0.00 0.00 46.19 46.00 1iq8 s LEU 8 CO 0.77 0.11 -0.24 -0.54 -1.89 0.00 0.00 176.35 174.56 1iq8 s LYS 9 N 0.28 2.07 -0.13 1.98 1.02 -0.58 -4.99 119.74 119.39 1iq8 s LYS 9 Ca -0.09 -0.96 -0.05 0.00 0.02 0.00 0.00 55.97 54.89 1iq8 s LYS 9 Cb -0.14 -2.07 0.06 0.00 -0.52 0.00 0.00 37.83 35.16 1iq8 s LYS 9 CO 0.03 0.55 0.28 0.12 -0.92 0.00 0.00 175.35 175.42 1iq8 s PHE 10 N -0.70 -0.45 0.01 3.18 5.36 -1.26 -1.65 117.98 122.48 1iq8 s PHE 10 Ca 0.11 1.00 0.02 0.00 -0.96 0.00 0.00 56.93 57.09 1iq8 s PHE 10 Cb -0.10 0.04 -0.01 0.00 -0.34 0.00 0.00 43.02 42.61 1iq8 s PHE 10 CO 0.00 -0.33 -0.05 -2.00 -1.46 0.00 0.00 175.22 171.38 1iq8 s GLU 11 N 2.05 0.41 -0.04 10.12 2.12 -0.95 -4.74 118.70 127.67 1iq8 s GLU 11 Ca -0.03 -0.36 -0.26 0.00 0.36 0.00 0.00 54.97 54.68 1iq8 s GLU 11 Cb -0.11 -0.31 -0.03 0.00 0.26 0.00 0.00 34.13 33.93 1iq8 s GLU 11 CO -0.09 0.08 0.83 0.42 -0.54 0.00 0.00 175.26 175.96 1iq8 s ILE 12 N -0.55 4.96 -0.17 -3.70 1.01 -1.26 -0.59 121.20 120.88 1iq8 s ILE 12 Ca -0.03 1.73 0.16 0.00 0.00 0.00 0.00 60.65 62.52 1iq8 s ILE 12 Cb -0.05 -4.17 -0.23 0.00 0.01 0.00 0.00 42.46 38.02 1iq8 s ILE 12 CO -0.00 0.20 0.08 0.29 0.00 0.00 0.00 174.94 175.51 1iq8 n LYS 13 N 3.93 0.99 -3.56 2.79 5.02 0.14 -4.94 118.16 122.54 1iq8 n LYS 13 Ca 0.02 -0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1iq8 n LYS 13 Cb 0.51 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.03 1iq8 n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1iq8 s ALA 14 N -2.49 -1.51 0.17 7.82 0.00 -1.04 -4.98 121.76 119.73 1iq8 s ALA 14 Ca -0.09 0.28 -0.23 0.00 0.00 0.00 0.00 51.96 51.93 1iq8 s ALA 14 Cb 0.06 0.84 0.06 0.00 0.00 0.00 0.00 23.12 24.08 1iq8 s ALA 14 CO 0.75 -0.85 0.61 -0.98 0.00 0.00 0.00 175.76 175.29 1iq8 s ARG 15 N -3.75 1.33 -0.30 0.00 1.70 -1.26 -0.83 118.95 115.85 1iq8 s ARG 15 Ca 0.04 -0.54 -0.13 0.00 -0.47 0.00 0.00 55.73 54.63 1iq8 s ARG 15 Cb -0.02 0.59 0.14 0.00 -0.57 0.00 0.00 34.95 35.08 1iq8 s ARG 15 CO -0.07 -0.59 0.83 0.34 -1.08 0.00 0.00 175.30 174.73 1iq8 s ASP 16 N -2.77 -0.82 0.54 -2.89 2.15 -0.68 -4.90 116.67 107.31 1iq8 s ASP 16 Ca 0.02 1.17 0.00 0.00 0.43 0.00 0.00 52.55 54.17 1iq8 s ASP 16 Cb -0.02 1.82 0.00 0.00 -0.30 0.00 0.00 42.92 44.42 1iq8 s ASP 16 CO -0.11 -0.17 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 1iq8 n GLY 17 N 4.92 0.95 0.36 2.66 0.00 -1.26 -1.35 105.19 111.47 1iq8 n GLY 17 Ca -0.13 -0.75 0.14 0.00 0.00 0.00 0.00 46.02 45.28 1iq8 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iq8 n ALA 18 N 6.43 2.60 -1.91 4.61 0.00 -1.20 -4.18 120.51 126.87 1iq8 n ALA 18 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 53.44 52.74 1iq8 n ALA 18 Cb 0.00 -1.24 -0.00 0.00 0.00 0.00 0.00 19.45 18.20 1iq8 n ALA 18 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1iq8 s GLY 19 N -1.96 1.74 -0.01 0.00 0.00 -0.46 -3.48 107.32 103.16 1iq8 s GLY 19 Ca 0.40 -0.07 -0.29 0.00 0.00 0.00 0.00 44.72 44.76 1iq8 s GLY 19 CO 0.34 0.19 0.67 1.09 0.00 0.00 0.00 173.10 175.39 1iq8 s ARG 20 N -4.86 1.09 -0.25 2.90 1.70 -1.26 -1.68 118.95 116.59 1iq8 s ARG 20 Ca 0.55 0.09 -0.09 0.00 -0.47 0.00 0.00 55.73 55.81 1iq8 s ARG 20 Cb -0.11 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.75 1iq8 s ARG 20 CO 0.48 -0.38 0.11 0.42 -1.08 0.00 0.00 175.30 174.85 1iq8 s ILE 21 N -1.78 4.72 0.27 4.99 1.01 -0.01 -3.94 121.20 126.46 1iq8 s ILE 21 Ca -0.08 -0.03 0.07 0.00 0.00 0.00 0.00 60.65 60.61 1iq8 s ILE 21 Cb -0.00 -3.21 -0.06 0.00 0.01 0.00 0.00 42.46 39.20 1iq8 s ILE 21 CO 0.04 0.33 -0.07 -0.83 0.00 0.00 0.00 174.94 174.41 1iq8 s GLY 22 N 1.47 1.77 -0.30 6.18 0.00 -0.08 0.26 107.32 116.63 1iq8 s GLY 22 Ca 0.06 -1.87 -0.07 0.00 0.00 0.00 0.00 44.72 42.85 1iq8 s GLY 22 CO 0.06 -1.83 0.08 1.25 0.00 0.00 0.00 173.10 172.65 1iq8 s LYS 23 N -3.71 3.05 -0.18 2.90 2.20 0.24 -0.24 119.74 124.00 1iq8 s LYS 23 Ca 0.29 -0.88 -0.03 0.00 -0.36 0.00 0.00 55.97 54.98 1iq8 s LYS 23 Cb 0.03 -3.36 -0.02 0.00 -1.51 0.00 0.00 37.83 32.97 1iq8 s LYS 23 CO 0.11 -0.45 -0.05 -1.17 -0.36 0.00 0.00 175.35 173.43 1iq8 s LEU 24 N 1.49 3.02 -0.08 5.43 0.20 0.67 -2.24 118.68 127.17 1iq8 s LEU 24 Ca 0.02 -0.27 0.03 0.00 0.69 0.00 0.00 54.13 54.60 1iq8 s LEU 24 Cb -0.17 -1.74 0.01 0.00 -0.43 0.00 0.00 46.19 43.85 1iq8 s LEU 24 CO 0.02 0.08 -0.17 -0.70 -0.29 0.00 0.00 176.35 175.30 1iq8 s GLU 25 N 0.86 2.23 -0.06 1.98 2.12 -0.66 0.09 118.70 125.27 1iq8 s GLU 25 Ca -0.01 -0.60 -0.03 0.00 0.36 0.00 0.00 54.97 54.69 1iq8 s GLU 25 Cb -0.15 -1.76 0.04 0.00 0.26 0.00 0.00 34.13 32.52 1iq8 s GLU 25 CO 0.01 0.09 0.13 0.08 -0.54 0.00 0.00 175.26 175.03 1iq8 s VAL 26 N 0.52 -0.05 -1.46 3.70 1.01 0.10 -1.52 120.40 122.71 1iq8 s VAL 26 Ca -0.16 0.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 1iq8 s VAL 26 Cb -0.17 -0.22 0.03 0.00 0.00 0.00 0.00 36.38 36.03 1iq8 s VAL 26 CO 0.06 0.07 0.81 0.59 0.00 0.00 0.00 175.10 176.63 1iq8 n ASN 27 N 4.14 -5.55 0.00 3.32 4.13 -1.26 -0.88 115.26 119.17 1iq8 n ASN 27 Ca -0.26 -0.46 0.00 0.00 1.68 0.00 0.00 54.58 55.54 1iq8 n ASN 27 Cb 0.52 -4.45 0.00 0.00 -1.54 0.00 0.00 39.78 34.31 1iq8 n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1iq8 n GLY 28 N -1.62 3.01 3.72 7.41 0.00 -1.26 -4.98 105.19 111.47 1iq8 n GLY 28 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1iq8 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iq8 s LYS 29 N -0.03 4.63 0.09 1.61 1.02 -0.06 -5.06 119.74 121.94 1iq8 s LYS 29 Ca 0.00 1.39 0.08 0.00 0.02 0.00 0.00 55.97 57.45 1iq8 s LYS 29 Cb 0.00 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1iq8 s LYS 29 CO 0.00 0.15 -0.15 0.15 -0.92 0.00 0.00 175.35 174.58 1iq8 s LYS 30 N 0.29 2.01 -0.01 1.68 1.02 -1.26 0.02 119.74 123.49 1iq8 s LYS 30 Ca 0.47 -1.05 -0.12 0.00 0.02 0.00 0.00 55.97 55.28 1iq8 s LYS 30 Cb -0.22 -2.22 0.02 0.00 -0.52 0.00 0.00 37.83 34.88 1iq8 s LYS 30 CO 0.28 0.51 0.26 0.42 -0.92 0.00 0.00 175.35 175.90 1iq8 s ILE 31 N -1.11 0.06 -0.08 2.17 1.01 0.11 -4.98 121.20 118.38 1iq8 s ILE 31 Ca 0.18 -0.53 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 1iq8 s ILE 31 Cb -0.11 -0.56 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 1iq8 s ILE 31 CO 0.10 -0.29 0.18 -0.70 0.00 0.00 0.00 174.94 174.23 1iq8 s GLU 32 N -1.32 3.49 0.25 2.79 2.12 -1.26 -0.23 118.70 124.53 1iq8 s GLU 32 Ca -0.14 -0.11 0.11 0.00 0.36 0.00 0.00 54.97 55.19 1iq8 s GLU 32 Cb -0.06 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 1iq8 s GLU 32 CO 0.03 0.74 -0.20 0.95 -0.54 0.00 0.00 175.26 176.25 1iq8 s THR 33 N -1.11 2.31 0.27 -1.70 -4.23 0.67 -4.22 115.64 107.63 1iq8 s THR 33 Ca 0.19 -2.30 -0.30 0.00 -1.18 0.00 0.00 61.69 58.10 1iq8 s THR 33 Cb -0.13 -2.21 -0.13 0.00 1.34 0.00 0.00 72.50 71.37 1iq8 s THR 33 CO 0.08 -0.38 1.31 -2.65 -0.54 0.00 0.00 174.62 172.43 1iq8 n PRO 34 N -0.40 1.91 -4.09 3.99 -0.02 -1.25 -0.90 135.00 134.24 1iq8 n PRO 34 Ca -0.07 0.67 -0.13 0.00 -2.02 0.00 0.00 63.50 61.95 1iq8 n PRO 34 Cb 0.59 -2.26 -0.11 0.00 -0.02 0.00 0.00 33.50 31.70 1iq8 n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iq8 s ALA 35 N -0.48 0.68 -0.09 3.55 0.00 -0.56 -5.02 121.76 119.83 1iq8 s ALA 35 Ca 0.64 -0.86 0.04 0.00 0.00 0.00 0.00 51.96 51.78 1iq8 s ALA 35 Cb -0.65 0.04 -0.00 0.00 0.00 0.00 0.00 23.12 22.51 1iq8 s ALA 35 CO 0.55 -0.03 -0.24 -1.50 0.00 0.00 0.00 175.76 174.54 1iq8 s ILE 36 N -1.65 2.04 -0.28 0.00 1.10 -1.26 -1.40 121.20 119.75 1iq8 s ILE 36 Ca -0.06 -1.02 -0.07 0.00 -0.51 0.00 0.00 60.65 58.99 1iq8 s ILE 36 Cb -0.08 -1.76 -0.00 0.00 0.15 0.00 0.00 42.46 40.77 1iq8 s ILE 36 CO -0.00 0.56 0.07 0.00 -2.11 0.00 0.00 174.94 173.46 1iq8 s MET 37 N 0.24 3.27 0.40 3.50 0.23 0.77 -4.83 119.30 122.89 1iq8 s MET 37 Ca -0.16 -0.73 -0.26 0.00 -1.03 0.00 0.00 55.69 53.51 1iq8 s MET 37 Cb -0.17 -3.34 -0.09 0.00 -1.53 0.00 0.00 34.83 29.70 1iq8 s MET 37 CO 0.08 -0.36 1.33 -2.14 -2.03 0.00 0.00 175.02 171.90 1iq8 s PRO 38 N 1.54 4.00 -0.31 3.16 0.02 -1.25 -1.51 135.00 140.63 1iq8 s PRO 38 Ca 0.04 2.21 -0.20 0.00 0.02 0.00 0.00 61.00 63.08 1iq8 s PRO 38 Cb -0.16 -2.80 -0.01 0.00 0.02 0.00 0.00 34.50 31.55 1iq8 s PRO 38 CO 0.03 -0.49 0.60 0.08 -0.33 0.00 0.00 177.00 176.88 1iq8 s VAL 39 N -1.23 4.96 -0.18 3.83 1.01 0.23 -1.94 120.40 127.08 1iq8 s VAL 39 Ca 0.56 0.74 -0.07 0.00 0.00 0.00 0.00 61.98 63.21 1iq8 s VAL 39 Cb -0.39 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1iq8 s VAL 39 CO 0.51 -0.15 0.05 0.68 0.00 0.00 0.00 175.10 176.19 1iq8 s VAL 40 N 2.55 4.64 -0.21 2.92 -7.23 -0.21 -4.78 120.40 118.07 1iq8 s VAL 40 Ca 0.24 -0.09 -0.16 0.00 -1.81 0.00 0.00 61.98 60.16 1iq8 s VAL 40 Cb -0.15 -3.09 -0.04 0.00 0.56 0.00 0.00 36.38 33.66 1iq8 s VAL 40 CO 0.12 0.45 0.39 0.21 -0.31 0.00 0.00 175.10 175.97 1iq8 s ASN 41 N 0.47 6.41 0.43 4.85 3.04 -1.23 -4.37 114.94 124.54 1iq8 s ASN 41 Ca 0.02 0.48 0.10 0.00 0.04 0.00 0.00 52.86 53.50 1iq8 s ASN 41 Cb -0.13 -2.23 0.95 0.00 -1.54 0.00 0.00 41.25 38.31 1iq8 s ASN 41 CO 0.01 -0.09 2.06 -0.65 -3.04 0.00 0.00 177.10 175.39 1iq8 h PRO 42 N 7.48 0.35 0.00 0.43 0.11 -1.98 -2.57 132.00 135.83 1iq8 h PRO 42 Ca -0.35 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1iq8 h PRO 42 Cb 1.16 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1iq8 h PRO 42 CO 0.71 0.27 -0.54 0.87 -0.21 0.00 0.00 178.00 179.10 1iq8 h LYS 43 N 0.36 0.00 -2.57 1.05 1.57 -1.98 -3.45 116.57 111.55 1iq8 h LYS 43 Ca 0.09 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 1iq8 h LYS 43 Cb 0.02 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.06 1iq8 h LYS 43 CO -0.01 0.00 -0.37 -0.65 -0.57 0.00 0.00 179.45 177.84 1iq8 s GLN 44 N -3.20 0.32 -0.36 3.15 -0.21 -0.97 -5.12 119.66 113.28 1iq8 s GLN 44 Ca 0.06 0.96 0.01 0.00 0.02 0.00 0.00 55.36 56.41 1iq8 s GLN 44 Cb 0.12 0.23 0.11 0.00 1.00 0.00 0.00 33.01 34.47 1iq8 s GLN 44 CO 0.71 -0.24 0.15 -1.64 -2.12 0.00 0.00 175.29 172.15 1iq8 s MET 45 N 2.38 0.95 0.23 2.91 -1.94 -1.25 -3.53 119.30 119.04 1iq8 s MET 45 Ca -0.03 -1.46 -0.07 0.00 -1.71 0.00 0.00 55.69 52.43 1iq8 s MET 45 Cb -0.11 -2.15 0.28 0.00 2.01 0.00 0.00 34.83 34.85 1iq8 s MET 45 CO -0.12 -1.05 1.85 0.28 -0.01 0.00 0.00 175.02 175.96 1iq8 h VAL 46 N 6.01 1.05 -3.53 -6.03 2.07 -1.98 -3.39 116.25 110.45 1iq8 h VAL 46 Ca -0.08 -0.31 -0.57 0.00 0.82 0.00 0.00 66.70 66.56 1iq8 h VAL 46 Cb 0.98 0.06 -0.33 0.00 -1.52 0.00 0.00 31.29 30.48 1iq8 h VAL 46 CO 0.47 0.17 -0.84 0.68 0.02 0.00 0.00 177.57 178.07 1iq8 s VAL 47 N -6.08 1.46 0.43 2.57 -7.23 -1.26 -4.90 120.40 105.39 1iq8 s VAL 47 Ca -0.13 -0.69 -0.24 0.00 -1.81 0.00 0.00 61.98 59.12 1iq8 s VAL 47 Cb 0.17 -1.29 -0.08 0.00 0.56 0.00 0.00 36.38 35.74 1iq8 s VAL 47 CO 0.78 0.42 1.12 -1.61 -0.31 0.00 0.00 175.10 175.51 1iq8 s GLU 48 N 0.41 3.95 0.37 4.82 0.41 -1.26 -4.87 118.70 122.53 1iq8 s GLU 48 Ca -0.13 1.69 0.06 0.00 -0.41 0.00 0.00 54.97 56.18 1iq8 s GLU 48 Cb -0.15 -2.50 0.75 0.00 -1.78 0.00 0.00 34.13 30.45 1iq8 s GLU 48 CO 0.05 -0.36 1.98 -1.35 -0.49 0.00 0.00 175.26 175.08 1iq8 h PRO 49 N 2.31 0.72 -0.48 0.39 0.11 -1.91 0.93 132.00 134.07 1iq8 h PRO 49 Ca -0.49 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.65 1iq8 h PRO 49 Cb 1.23 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 1iq8 h PRO 49 CO 0.61 0.48 0.15 0.87 -0.21 0.00 0.00 178.00 179.90 1iq8 h LYS 50 N 0.74 0.30 -0.33 1.05 1.57 -1.78 0.62 116.57 118.74 1iq8 h LYS 50 Ca 0.29 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.92 1iq8 h LYS 50 Cb 0.19 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1iq8 h LYS 50 CO -0.09 0.20 -0.30 1.49 -0.57 0.00 0.00 179.45 180.18 1iq8 h GLU 51 N 0.31 0.70 -0.45 3.15 4.81 -1.48 -1.85 114.58 119.77 1iq8 h GLU 51 Ca 0.23 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 1iq8 h GLU 51 Cb 0.27 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1iq8 h GLU 51 CO -0.26 0.92 0.18 -0.07 -0.73 0.00 0.00 179.01 179.05 1iq8 h LEU 52 N 0.60 0.63 -1.30 1.64 3.38 0.50 -0.90 115.31 119.86 1iq8 h LEU 52 Ca 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1iq8 h LEU 52 Cb 0.82 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1iq8 h LEU 52 CO 0.07 0.63 0.32 -0.08 0.09 0.00 0.00 178.44 179.47 1iq8 h GLU 53 N 0.59 0.80 0.00 1.13 4.81 0.40 -0.83 114.58 121.48 1iq8 h GLU 53 Ca 0.15 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 1iq8 h GLU 53 Cb 0.20 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 1iq8 h GLU 53 CO -0.01 0.59 -0.47 0.87 -0.73 0.00 0.00 179.01 179.26 1iq8 h LYS 54 N 0.81 0.00 0.00 1.92 1.57 -0.77 -2.09 116.57 118.01 1iq8 h LYS 54 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1iq8 h LYS 54 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1iq8 h LYS 54 CO -0.03 0.47 0.00 -1.33 -0.57 0.00 0.00 179.45 177.98 1iq8 n MET 55 N -3.88 0.78 -0.04 3.15 2.81 -0.39 -4.87 117.12 114.67 1iq8 n MET 55 Ca -0.01 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 1iq8 n MET 55 Cb 0.50 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 1iq8 n MET 55 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iq8 n GLY 56 N 0.91 0.70 3.52 3.03 0.00 -0.78 -5.02 105.19 107.54 1iq8 n GLY 56 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1iq8 n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iq8 s PHE 57 N -2.05 2.60 -1.69 1.61 0.40 -0.43 -4.83 117.98 113.59 1iq8 s PHE 57 Ca 0.00 -0.67 0.08 0.00 -0.60 0.00 0.00 56.93 55.74 1iq8 s PHE 57 Cb 0.00 -4.53 0.27 0.00 0.51 0.00 0.00 43.02 39.27 1iq8 s PHE 57 CO 0.00 -1.84 1.16 0.39 0.70 0.00 0.00 175.22 175.63 1iq8 n GLU 58 N 8.37 1.87 -3.69 0.44 -0.58 -1.26 -3.95 120.64 121.84 1iq8 n GLU 58 Ca 0.16 -1.08 -0.10 0.00 -0.42 0.00 0.00 57.16 55.72 1iq8 n GLU 58 Cb 0.49 -1.36 -0.11 0.00 -0.57 0.00 0.00 31.44 29.89 1iq8 n GLU 58 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1iq8 s ILE 59 N -1.63 -0.06 0.35 -3.67 2.07 -1.26 -1.32 121.20 115.69 1iq8 s ILE 59 Ca 0.20 0.10 0.03 0.00 -1.41 0.00 0.00 60.65 59.57 1iq8 s ILE 59 Cb 0.11 -0.61 -0.04 0.00 0.13 0.00 0.00 42.46 42.06 1iq8 s ILE 59 CO 0.11 0.04 0.11 0.27 -1.91 0.00 0.00 174.94 173.57 1iq8 s ILE 60 N 1.46 0.69 -0.01 2.00 -4.36 -0.44 -3.92 121.20 116.63 1iq8 s ILE 60 Ca -0.09 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.28 1iq8 s ILE 60 Cb -0.09 -2.53 0.00 0.00 1.25 0.00 0.00 42.46 41.10 1iq8 s ILE 60 CO -0.13 0.00 0.04 -0.51 0.24 0.00 0.00 174.94 174.59 1iq8 s ILE 61 N -3.37 0.01 0.24 8.37 2.07 -0.82 -0.93 121.20 126.78 1iq8 s ILE 61 Ca 0.31 -0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.48 1iq8 s ILE 61 Cb 0.05 -0.10 -0.04 0.00 0.13 0.00 0.00 42.46 42.50 1iq8 s ILE 61 CO 0.15 -0.04 0.12 -0.89 -1.91 0.00 0.00 174.94 172.37 1iq8 s THR 62 N -0.11 0.30 -0.41 4.00 2.01 -0.78 -1.05 115.64 119.60 1iq8 s THR 62 Ca -0.01 -2.00 -0.17 0.00 0.31 0.00 0.00 61.69 59.81 1iq8 s THR 62 Cb -0.01 -2.57 0.02 0.00 0.01 0.00 0.00 72.50 69.95 1iq8 s THR 62 CO 0.00 0.00 0.44 0.21 -0.69 0.00 0.00 174.62 174.58 1iq8 s ASN 63 N -3.26 6.20 0.29 3.53 3.84 -1.26 0.75 114.94 125.03 1iq8 s ASN 63 Ca 0.38 -0.63 0.02 0.00 0.21 0.00 0.00 52.86 52.85 1iq8 s ASN 63 Cb 0.07 -2.22 0.46 0.00 -0.55 0.00 0.00 41.25 39.00 1iq8 s ASN 63 CO 0.14 -0.56 1.78 0.77 -2.79 0.00 0.00 177.10 176.43 1iq8 h SER 64 N 8.71 0.54 0.15 -4.21 4.64 -1.69 -2.74 113.55 118.94 1iq8 h SER 64 Ca -0.27 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 60.90 1iq8 h SER 64 Cb 1.11 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1iq8 h SER 64 CO 0.79 0.70 -0.07 0.22 -0.87 0.00 0.00 176.83 177.59 1iq8 h TYR 65 N 0.51 -0.19 -0.96 4.77 3.20 -1.78 0.60 116.97 123.11 1iq8 h TYR 65 Ca 0.09 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.08 1iq8 h TYR 65 Cb 0.52 0.06 -0.09 0.00 1.54 0.00 0.00 36.73 38.77 1iq8 h TYR 65 CO 0.02 -0.03 0.59 0.82 -1.64 0.00 0.00 178.16 177.91 1iq8 h ILE 66 N -0.30 0.88 0.12 1.81 2.04 -1.90 0.24 117.51 120.39 1iq8 h ILE 66 Ca -0.02 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 1iq8 h ILE 66 Cb 0.24 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 1iq8 h ILE 66 CO 0.03 0.17 -0.06 0.40 0.00 0.00 0.00 178.15 178.69 1iq8 h ILE 67 N 0.91 1.06 -0.68 -0.67 2.04 -1.14 -3.07 117.51 115.96 1iq8 h ILE 67 Ca 0.49 -0.84 0.12 0.00 1.00 0.00 0.00 64.86 65.63 1iq8 h ILE 67 Cb 0.52 1.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 1iq8 h ILE 67 CO -0.28 0.20 0.45 0.22 0.00 0.00 0.00 178.15 178.74 1iq8 h TYR 68 N -0.56 0.47 -0.36 1.37 3.20 0.10 -2.05 116.97 119.13 1iq8 h TYR 68 Ca -0.02 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1iq8 h TYR 68 Cb 0.45 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1iq8 h TYR 68 CO 0.05 0.20 0.00 1.63 -1.64 0.00 0.00 178.16 178.41 1iq8 n LYS 69 N -4.47 2.03 -4.01 1.82 4.76 0.76 -4.77 118.16 114.28 1iq8 n LYS 69 Ca 0.12 -1.58 -0.34 0.00 -2.87 0.00 0.00 58.31 53.64 1iq8 n LYS 69 Cb 0.44 -1.39 -0.15 0.00 -1.84 0.00 0.00 35.03 32.09 1iq8 n LYS 69 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1iq8 s ASP 70 N -1.24 4.21 0.01 4.39 -1.08 -0.78 -5.04 116.67 117.14 1iq8 s ASP 70 Ca 0.33 -1.02 -0.02 0.00 -0.52 0.00 0.00 52.55 51.32 1iq8 s ASP 70 Cb 0.17 -1.61 -0.00 0.00 -1.46 0.00 0.00 42.92 40.02 1iq8 s ASP 70 CO 0.24 -0.14 1.00 -0.62 0.52 0.00 0.00 175.17 176.18 1iq8 n GLU 71 N 4.59 -0.03 -0.04 4.34 1.02 -1.26 0.44 120.64 129.71 1iq8 n GLU 71 Ca -0.16 1.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.93 1iq8 n GLU 71 Cb 0.46 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.35 1iq8 n GLU 71 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1iq8 h GLU 72 N 0.00 -0.15 -0.84 3.49 4.39 -1.96 0.16 114.58 119.68 1iq8 h GLU 72 Ca 0.01 0.01 0.20 0.00 0.34 0.00 0.00 59.36 59.92 1iq8 h GLU 72 Cb 0.02 0.03 -0.13 0.00 -0.10 0.00 0.00 28.75 28.58 1iq8 h GLU 72 CO -0.06 -0.10 0.26 -0.07 -1.16 0.00 0.00 179.01 177.89 1iq8 h LEU 73 N -0.15 0.10 0.29 1.33 4.07 -1.77 -0.35 115.31 118.82 1iq8 h LEU 73 Ca 0.02 0.17 -0.01 0.00 0.08 0.00 0.00 57.88 58.14 1iq8 h LEU 73 Cb 0.21 0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.16 1iq8 h LEU 73 CO -0.19 -0.07 -0.15 -0.09 -1.08 0.00 0.00 178.44 176.87 1iq8 h ARG 74 N 0.29 -0.38 0.05 1.13 2.43 0.79 0.15 114.38 118.83 1iq8 h ARG 74 Ca 0.51 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.73 1iq8 h ARG 74 Cb 0.95 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 1iq8 h ARG 74 CO -0.57 -0.26 -0.34 0.00 -1.51 0.00 0.00 179.97 177.29 1iq8 h ARG 75 N -0.40 -0.51 -0.91 0.20 3.08 0.77 -0.91 114.38 115.69 1iq8 h ARG 75 Ca -0.04 0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.11 1iq8 h ARG 75 Cb 0.31 0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.41 1iq8 h ARG 75 CO 0.06 -0.34 0.57 0.87 -1.07 0.00 0.00 179.97 180.06 1iq8 h LYS 76 N -0.53 1.00 0.62 0.04 1.57 -1.04 0.19 116.57 118.42 1iq8 h LYS 76 Ca 0.05 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1iq8 h LYS 76 Cb 0.59 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1iq8 h LYS 76 CO -0.25 0.66 -0.45 0.00 -0.57 0.00 0.00 179.45 178.85 1iq8 h ALA 77 N 1.43 -1.08 0.00 3.86 0.00 0.17 0.33 119.26 123.97 1iq8 h ALA 77 Ca 0.40 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1iq8 h ALA 77 Cb 0.19 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1iq8 h ALA 77 CO -0.18 -1.13 -0.08 -0.07 0.00 0.00 0.00 179.25 177.79 1iq8 h LEU 78 N -1.03 0.00 0.13 0.00 3.38 -1.02 0.33 115.31 117.10 1iq8 h LEU 78 Ca -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1iq8 h LEU 78 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1iq8 h LEU 78 CO 0.03 0.08 -0.06 -0.08 0.09 0.00 0.00 178.44 178.50 1iq8 h GLU 79 N 0.00 -0.17 0.00 1.13 4.57 0.14 -3.41 114.58 116.84 1iq8 h GLU 79 Ca -0.00 0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.09 1iq8 h GLU 79 Cb 0.41 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 1iq8 h GLU 79 CO 0.01 -0.11 -1.98 1.28 -1.18 0.00 0.00 179.01 177.02 1iq8 n LEU 80 N -3.65 0.12 0.00 1.64 4.77 0.11 -5.07 117.00 114.92 1iq8 n LEU 80 Ca -0.02 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1iq8 n LEU 80 Cb 0.07 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1iq8 n LEU 80 CO 0.05 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 1iq8 n GLY 81 N 1.38 1.60 0.30 -0.72 0.00 0.11 -4.32 105.19 103.55 1iq8 n GLY 81 Ca -0.11 -1.68 0.02 0.00 0.00 0.00 0.00 46.02 44.24 1iq8 n GLY 81 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1iq8 h ILE 82 N 0.00 0.95 -0.62 -0.61 -0.00 -1.45 0.33 117.51 116.11 1iq8 h ILE 82 Ca 0.00 -0.28 0.13 0.00 -0.00 0.00 0.00 64.86 64.71 1iq8 h ILE 82 Cb 0.00 0.06 -0.10 0.00 -0.00 0.00 0.00 36.82 36.78 1iq8 h ILE 82 CO 0.00 0.15 0.04 0.45 -0.00 0.00 0.00 178.15 178.79 1iq8 h HIS 83 N 0.82 0.04 0.00 0.16 3.86 -1.81 0.16 115.15 118.37 1iq8 h HIS 83 Ca 0.37 0.04 -0.15 0.00 -1.16 0.00 0.00 60.37 59.48 1iq8 h HIS 83 Cb 0.28 0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.81 1iq8 h HIS 83 CO -0.06 -0.13 -0.92 0.00 0.86 0.00 0.00 177.93 177.68 1iq8 h ARG 84 N 0.16 0.00 -0.24 2.45 2.47 -1.65 -0.62 114.38 116.94 1iq8 h ARG 84 Ca 0.33 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.94 1iq8 h ARG 84 Cb 0.53 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.84 1iq8 h ARG 84 CO -0.50 0.50 -0.31 1.98 0.56 0.00 0.00 179.97 182.20 1iq8 h MET 85 N 0.00 0.48 -0.05 0.04 4.05 0.13 -2.91 114.93 116.67 1iq8 h MET 85 Ca -0.07 -0.20 0.00 0.00 -0.28 0.00 0.00 59.70 59.15 1iq8 h MET 85 Cb 1.53 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 32.31 1iq8 h MET 85 CO 0.07 0.74 0.00 1.28 0.23 0.00 0.00 176.91 179.23 1iq8 n LEU 86 N -4.09 3.02 -3.76 3.39 4.32 0.45 -4.97 117.00 115.37 1iq8 n LEU 86 Ca -0.01 -1.03 -0.23 0.00 -0.02 0.00 0.00 56.01 54.73 1iq8 n LEU 86 Cb 0.44 -0.01 0.02 0.00 -1.62 0.00 0.00 43.42 42.25 1iq8 n LEU 86 CO 0.43 0.51 -0.07 -0.67 -1.22 0.00 0.00 177.39 176.37 1iq8 n ASP 87 N 1.36 -1.45 -3.86 -1.43 -0.08 -0.94 -4.44 116.55 105.70 1iq8 n ASP 87 Ca 0.14 -0.84 -0.24 0.00 -1.51 0.00 0.00 54.79 52.34 1iq8 n ASP 87 Cb 0.60 -3.89 -0.17 0.00 2.34 0.00 0.00 41.12 40.00 1iq8 n ASP 87 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1iq8 s TYR 88 N -3.67 1.04 -0.43 -0.67 5.04 -0.28 -4.08 117.35 114.30 1iq8 s TYR 88 Ca 0.08 -0.41 0.05 0.00 -2.44 0.00 0.00 57.07 54.35 1iq8 s TYR 88 Cb -0.04 -0.95 0.55 0.00 0.35 0.00 0.00 41.96 41.87 1iq8 s TYR 88 CO 0.83 -0.37 1.72 0.09 -1.34 0.00 0.00 175.55 176.48 1iq8 n ASN 89 N 4.78 4.19 -1.03 4.32 3.02 -1.26 -4.59 115.26 124.68 1iq8 n ASN 89 Ca -0.13 -3.73 0.00 0.00 -0.03 0.00 0.00 54.58 50.69 1iq8 n ASN 89 Cb 0.50 -0.75 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 1iq8 n ASN 89 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1iq8 n GLY 90 N -1.06 3.57 3.67 7.41 0.00 -1.26 -5.06 105.19 112.45 1iq8 n GLY 90 Ca 0.50 -2.10 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 1iq8 n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iq8 s ILE 91 N 0.87 4.69 -0.21 -0.61 1.01 -0.43 -4.97 121.20 121.54 1iq8 s ILE 91 Ca 0.00 2.02 -0.04 0.00 0.00 0.00 0.00 60.65 62.62 1iq8 s ILE 91 Cb 0.00 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.15 1iq8 s ILE 91 CO 0.00 -0.13 -0.02 -0.63 0.00 0.00 0.00 174.94 174.16 1iq8 s ILE 92 N 2.89 3.65 0.19 2.92 1.01 -1.26 -1.32 121.20 129.28 1iq8 s ILE 92 Ca 0.46 -0.41 0.07 0.00 0.00 0.00 0.00 60.65 60.76 1iq8 s ILE 92 Cb -0.16 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 1iq8 s ILE 92 CO 0.09 0.42 0.10 -0.70 0.00 0.00 0.00 174.94 174.85 1iq8 s GLU 93 N 1.30 2.70 0.02 2.79 2.12 -0.11 -1.64 118.70 125.88 1iq8 s GLU 93 Ca 0.04 -1.03 0.03 0.00 0.36 0.00 0.00 54.97 54.37 1iq8 s GLU 93 Cb -0.14 -2.50 -0.01 0.00 0.26 0.00 0.00 34.13 31.73 1iq8 s GLU 93 CO -0.00 0.45 -0.09 0.54 -0.54 0.00 0.00 175.26 175.62 1iq8 s VAL 94 N -1.88 0.66 -0.19 3.70 0.11 -0.72 -1.87 120.40 120.22 1iq8 s VAL 94 Ca 0.30 -0.69 -0.20 0.00 -2.93 0.00 0.00 61.98 58.46 1iq8 s VAL 94 Cb -0.09 -0.62 -0.03 0.00 -1.53 0.00 0.00 36.38 34.11 1iq8 s VAL 94 CO 0.22 -0.05 0.58 -0.62 -3.33 0.00 0.00 175.10 171.90 1iq8 s ASP 95 N -0.83 6.65 0.00 3.54 -1.08 0.23 -4.20 116.67 120.98 1iq8 s ASP 95 Ca -0.02 0.79 0.00 0.00 -0.52 0.00 0.00 52.55 52.80 1iq8 s ASP 95 Cb -0.06 -2.33 0.00 0.00 -1.46 0.00 0.00 42.92 39.07 1iq8 s ASP 95 CO 0.00 -0.21 0.34 -1.54 0.52 0.00 0.00 175.17 174.28 1iq8 n SER 96 N 4.81 0.00 0.00 -0.34 3.41 -1.26 -1.84 113.62 118.40 1iq8 n SER 96 Ca -0.03 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1iq8 n SER 96 Cb 0.50 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1iq8 n SER 96 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iq8 n GLY 97 N -0.84 1.73 0.01 5.00 0.00 -1.26 -4.45 105.19 105.38 1iq8 n GLY 97 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1iq8 n GLY 97 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1iq8 n SER 98 N 0.00 0.04 0.07 1.61 3.41 -1.26 -1.25 113.62 116.24 1iq8 n SER 98 Ca 0.00 0.43 0.08 0.00 -0.26 0.00 0.00 58.87 59.12 1iq8 n SER 98 Cb 0.00 -0.43 0.37 0.00 -0.26 0.00 0.00 64.21 63.89 1iq8 n SER 98 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1iq8 n PHE 99 N -1.47 0.40 0.04 7.33 7.35 -1.26 -0.38 117.46 129.46 1iq8 n PHE 99 Ca -0.00 0.17 0.05 0.00 -0.76 0.00 0.00 57.45 56.91 1iq8 n PHE 99 Cb 0.10 -0.77 -0.08 0.00 0.35 0.00 0.00 39.48 39.08 1iq8 n PHE 99 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 1iq8 n GLN 100 N -1.88 0.63 0.04 -4.13 3.00 -0.38 -3.10 117.38 111.56 1iq8 n GLN 100 Ca 0.02 0.09 0.09 0.00 -0.01 0.00 0.00 57.00 57.19 1iq8 n GLN 100 Cb 0.15 -1.74 0.39 0.00 0.00 0.00 0.00 30.24 29.05 1iq8 n GLN 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 1iq8 n LEU 101 N -2.68 0.22 -0.13 1.08 7.94 0.48 0.83 117.00 124.74 1iq8 n LEU 101 Ca -0.07 0.55 -0.20 0.00 -1.11 0.00 0.00 56.01 55.17 1iq8 n LEU 101 Cb 0.71 -0.51 -0.11 0.00 0.53 0.00 0.00 43.42 44.03 1iq8 n LEU 101 CO 0.42 -0.30 -1.35 0.80 -1.11 0.00 0.00 177.39 175.85 1iq8 n MET 102 N -1.73 0.62 0.04 1.96 1.56 -1.12 -2.32 117.12 116.12 1iq8 n MET 102 Ca 0.04 0.17 0.13 0.00 -0.27 0.00 0.00 57.70 57.77 1iq8 n MET 102 Cb 0.22 -1.50 0.37 0.00 2.15 0.00 0.00 33.22 34.46 1iq8 n MET 102 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 175.97 176.87 1iq8 n LYS 103 N -3.48 0.14 0.00 2.12 5.02 -1.10 -4.29 118.16 116.57 1iq8 n LYS 103 Ca -0.47 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 55.89 1iq8 n LYS 103 Cb 0.95 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 34.34 1iq8 n LYS 103 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1iq8 n TYR 104 N -1.84 0.00 0.00 2.13 4.02 0.24 -5.04 117.16 116.68 1iq8 n TYR 104 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1iq8 n TYR 104 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.71 1iq8 n TYR 104 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1iq8 n GLY 105 N 0.91 2.21 3.63 2.72 0.00 -0.98 -4.98 105.19 108.70 1iq8 n GLY 105 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1iq8 n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iq8 s SER 106 N -3.45 -0.63 0.19 1.61 1.04 -1.26 -4.90 113.70 106.30 1iq8 s SER 106 Ca 0.00 1.21 0.09 0.00 0.48 0.00 0.00 55.95 57.73 1iq8 s SER 106 Cb 0.00 1.23 -0.04 0.00 0.10 0.00 0.00 66.02 67.30 1iq8 s SER 106 CO 0.00 -0.22 -0.17 0.27 0.98 0.00 0.00 173.24 174.10 1iq8 s ILE 107 N 0.30 1.88 -1.09 -1.02 -4.36 -1.26 -4.76 121.20 110.89 1iq8 s ILE 107 Ca 0.01 -2.09 -0.07 0.00 -0.26 0.00 0.00 60.65 58.24 1iq8 s ILE 107 Cb -0.05 -1.98 0.28 0.00 1.25 0.00 0.00 42.46 41.97 1iq8 s ILE 107 CO -0.02 -0.43 1.17 -0.62 0.24 0.00 0.00 174.94 175.29 1iq8 n GLU 108 N -0.07 3.68 0.00 0.37 4.71 -1.26 -4.90 120.64 123.17 1iq8 n GLU 108 Ca -0.10 -4.49 0.00 0.00 -0.01 0.00 0.00 57.16 52.56 1iq8 n GLU 108 Cb 0.59 -2.53 0.00 0.00 -1.01 0.00 0.00 31.44 28.49 1iq8 n GLU 108 CO 0.00 0.00 0.00 1.55 0.09 0.00 0.00 177.13 178.77 1iq8 n VAL 109 N 2.30 0.00 -2.29 2.62 3.14 -1.26 -5.09 118.33 117.75 1iq8 n VAL 109 Ca 0.24 0.00 -0.28 0.00 -2.96 0.00 0.00 64.34 61.34 1iq8 n VAL 109 Cb 0.37 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.17 1iq8 n VAL 109 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1iq8 s SER 110 N 0.00 6.00 0.14 6.55 1.04 -1.26 -4.92 113.70 121.25 1iq8 s SER 110 Ca 0.00 1.03 -0.19 0.00 0.48 0.00 0.00 55.95 57.27 1iq8 s SER 110 Cb 0.00 -2.14 0.01 0.00 0.10 0.00 0.00 66.02 63.99 1iq8 s SER 110 CO 0.00 -0.86 1.70 -1.13 0.98 0.00 0.00 173.24 173.93 1iq8 h ASN 111 N -0.12 -0.19 -0.92 7.02 -0.00 -1.99 -2.07 115.58 117.32 1iq8 h ASN 111 Ca -0.46 0.07 -0.01 0.00 -0.00 0.00 0.00 56.30 55.91 1iq8 h ASN 111 Cb 1.22 0.14 -0.04 0.00 -0.00 0.00 0.00 38.32 39.63 1iq8 h ASN 111 CO 0.62 -0.06 0.55 -0.09 -0.00 0.00 0.00 177.43 178.44 1iq8 h ARG 112 N 0.03 1.25 0.44 6.67 9.65 -1.96 -2.51 114.38 127.96 1iq8 h ARG 112 Ca 0.13 -0.12 -0.02 0.00 -1.10 0.00 0.00 59.98 58.87 1iq8 h ARG 112 Cb 0.18 -0.26 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 1iq8 h ARG 112 CO -0.25 0.88 -0.21 0.93 2.80 0.00 0.00 179.97 184.12 1iq8 h GLU 113 N 1.27 -0.58 -0.42 0.20 5.08 -1.77 -2.20 114.58 116.16 1iq8 h GLU 113 Ca 0.33 0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.75 1iq8 h GLU 113 Cb -0.04 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1iq8 h GLU 113 CO -0.06 -0.28 0.28 -0.84 -1.00 0.00 0.00 179.01 177.11 1iq8 h ILE 114 N -0.83 1.05 -0.65 3.13 -0.00 -1.41 -0.17 117.51 118.63 1iq8 h ILE 114 Ca -0.06 -0.17 -0.09 0.00 -0.00 0.00 0.00 64.86 64.55 1iq8 h ILE 114 Cb 0.56 0.53 -0.02 0.00 -0.00 0.00 0.00 36.82 37.88 1iq8 h ILE 114 CO 0.10 0.09 0.07 0.40 -0.00 0.00 0.00 178.15 178.81 1iq8 h ILE 115 N 0.48 1.26 -0.00 0.16 2.04 -1.35 -1.07 117.51 119.03 1iq8 h ILE 115 Ca 0.17 -1.08 -0.17 0.00 1.00 0.00 0.00 64.86 64.77 1iq8 h ILE 115 Cb 0.07 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 1iq8 h ILE 115 CO -0.04 0.40 -0.79 -0.33 0.00 0.00 0.00 178.15 177.39 1iq8 h GLU 116 N 1.01 0.08 -0.26 2.37 5.08 -0.69 -2.85 114.58 119.32 1iq8 h GLU 116 Ca 0.19 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 1iq8 h GLU 116 Cb 0.48 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1iq8 h GLU 116 CO 0.02 0.83 -0.25 0.35 -1.00 0.00 0.00 179.01 178.96 1iq8 h PHE 117 N 0.05 0.56 -0.41 4.33 3.57 -0.74 -1.89 116.94 122.40 1iq8 h PHE 117 Ca -0.02 -0.12 -0.14 0.00 3.53 0.00 0.00 57.97 61.22 1iq8 h PHE 117 Cb 1.39 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 1iq8 h PHE 117 CO 0.01 0.71 -0.29 1.96 -2.23 0.00 0.00 178.31 178.47 1iq8 h GLN 118 N 0.44 0.89 -0.47 1.11 4.20 -1.11 -2.52 115.11 117.65 1iq8 h GLN 118 Ca 0.06 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.37 1iq8 h GLN 118 Cb 0.67 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 1iq8 h GLN 118 CO 0.05 1.06 0.30 0.45 -0.67 0.00 0.00 178.83 180.02 1iq8 h HIS 119 N 0.75 0.60 -0.28 2.96 3.86 -1.25 -3.01 115.15 118.78 1iq8 h HIS 119 Ca 0.09 0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 59.23 1iq8 h HIS 119 Cb 0.85 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 1iq8 h HIS 119 CO 0.05 0.39 -0.16 0.00 0.86 0.00 0.00 177.93 179.07 1iq8 h ARG 120 N 0.63 0.49 -0.16 2.45 3.08 -1.18 -3.01 114.38 116.68 1iq8 h ARG 120 Ca 0.17 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1iq8 h ARG 120 Cb -0.05 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1iq8 h ARG 120 CO -0.04 0.63 0.00 0.44 -1.07 0.00 0.00 179.97 179.94 1iq8 n ILE 121 N -4.18 0.21 -2.17 2.04 -5.35 -0.97 -4.88 119.36 104.05 1iq8 n ILE 121 Ca 0.00 -0.29 -0.05 0.00 -0.27 0.00 0.00 62.75 62.15 1iq8 n ILE 121 Cb 0.34 0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.46 1iq8 n ILE 121 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1iq8 n GLY 122 N 1.03 0.25 3.77 3.28 0.00 -1.14 -1.65 105.19 110.72 1iq8 n GLY 122 Ca 0.14 -0.67 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 1iq8 n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iq8 s VAL 123 N -2.34 2.82 -0.03 1.61 1.01 -1.14 -4.79 120.40 117.54 1iq8 s VAL 123 Ca 0.02 0.70 -0.21 0.00 0.00 0.00 0.00 61.98 62.49 1iq8 s VAL 123 Cb -0.01 -3.40 -0.29 0.00 0.00 0.00 0.00 36.38 32.68 1iq8 s VAL 123 CO 0.02 0.07 0.95 0.44 0.00 0.00 0.00 175.10 176.59 1iq8 h ASP 124 N 2.53 0.49 -3.24 3.32 3.32 -1.67 -3.45 116.42 117.73 1iq8 h ASP 124 Ca -0.49 -0.90 -0.51 0.00 0.02 0.00 0.00 57.03 55.14 1iq8 h ASP 124 Cb 1.25 -0.16 -0.36 0.00 0.22 0.00 0.00 39.33 40.28 1iq8 h ASP 124 CO 0.62 1.35 -0.80 -0.63 -1.72 0.00 0.00 179.24 178.06 1iq8 s ILE 125 N -2.65 0.99 0.14 0.35 1.01 -0.99 -3.85 121.20 116.20 1iq8 s ILE 125 Ca -0.13 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.24 1iq8 s ILE 125 Cb 0.02 -1.00 0.02 0.00 0.01 0.00 0.00 42.46 41.51 1iq8 s ILE 125 CO 0.83 0.35 0.13 0.61 0.00 0.00 0.00 174.94 176.87 1iq8 n GLY 126 N 4.71 2.65 3.32 6.18 0.00 -0.28 -1.76 105.19 120.02 1iq8 n GLY 126 Ca -0.15 -2.19 -0.11 0.00 0.00 0.00 0.00 46.02 43.58 1iq8 n GLY 126 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iq8 s THR 127 N -0.43 0.06 0.54 2.61 2.01 -1.26 -0.97 115.64 118.21 1iq8 s THR 127 Ca 0.10 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 61.65 1iq8 s THR 127 Cb -0.01 -1.15 0.04 0.00 0.01 0.00 0.00 72.50 71.40 1iq8 s THR 127 CO 0.06 -0.29 0.49 0.72 -0.69 0.00 0.00 174.62 174.91 1iq8 s PHE 128 N -3.76 1.67 -1.36 4.92 -0.12 -1.26 -4.65 117.98 113.41 1iq8 s PHE 128 Ca 0.03 -0.78 -0.14 0.00 -0.05 0.00 0.00 56.93 55.98 1iq8 s PHE 128 Cb 0.02 -2.00 0.08 0.00 -0.63 0.00 0.00 43.02 40.49 1iq8 s PHE 128 CO -0.12 -0.59 1.96 1.28 -0.05 0.00 0.00 175.22 177.70 1iq8 n LEU 129 N -1.85 6.15 -4.80 -1.99 4.77 -1.26 -4.68 117.00 113.35 1iq8 n LEU 129 Ca 0.03 -4.20 -0.35 0.00 -0.03 0.00 0.00 56.01 51.45 1iq8 n LEU 129 Cb 0.63 -1.65 -0.05 0.00 -2.33 0.00 0.00 43.42 40.03 1iq8 n LEU 129 CO 0.39 0.86 0.70 1.51 -1.33 0.00 0.00 177.39 179.52 1iq8 s ASP 130 N 3.02 6.77 -0.32 -1.43 1.47 -1.26 -4.80 116.67 120.12 1iq8 s ASP 130 Ca 0.47 1.89 -0.15 0.00 1.18 0.00 0.00 52.55 55.94 1iq8 s ASP 130 Cb 0.09 -2.57 -0.02 0.00 -0.34 0.00 0.00 42.92 40.08 1iq8 s ASP 130 CO -0.02 -0.48 0.37 -0.63 0.68 0.00 0.00 175.17 175.09 1iq8 s ILE 131 N -1.87 5.17 -1.19 2.11 1.01 -1.26 -4.82 121.20 120.34 1iq8 s ILE 131 Ca 0.60 0.21 -0.18 0.00 0.00 0.00 0.00 60.65 61.28 1iq8 s ILE 131 Cb -0.17 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1iq8 s ILE 131 CO 0.21 -0.02 2.00 -2.65 0.00 0.00 0.00 174.94 174.49 1iq8 n PRO 132 N 5.38 2.35 -1.66 2.79 -0.02 -1.26 -4.90 135.00 137.68 1iq8 n PRO 132 Ca -0.09 -2.49 -0.47 0.00 -2.02 0.00 0.00 63.50 58.43 1iq8 n PRO 132 Cb 0.50 -3.28 -0.04 0.00 -0.02 0.00 0.00 33.50 30.65 1iq8 n PRO 132 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1iq8 n THR 133 N 5.98 0.05 -1.12 3.45 -1.04 -1.26 -4.80 114.28 115.55 1iq8 n THR 133 Ca 0.50 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.05 62.16 1iq8 n THR 133 Cb 0.42 -1.46 0.13 0.00 -1.82 0.00 0.00 70.33 67.60 1iq8 n THR 133 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1iq8 s PRO 134 N 1.14 1.63 0.17 -2.82 0.02 -1.26 -4.40 135.00 129.48 1iq8 s PRO 134 Ca 0.81 1.76 -0.30 0.00 0.02 0.00 0.00 61.00 63.29 1iq8 s PRO 134 Cb -0.72 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 31.98 1iq8 s PRO 134 CO 0.41 -2.22 1.54 -1.35 -0.33 0.00 0.00 177.00 175.05 1iq8 h PRO 135 N -0.90 -0.02 -2.29 5.54 0.11 -1.92 -3.21 132.00 129.32 1iq8 h PRO 135 Ca -0.46 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.98 1iq8 h PRO 135 Cb 1.30 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 32.04 1iq8 h PRO 135 CO 0.46 -0.01 -0.07 -0.25 -0.21 0.00 0.00 178.00 177.92 1iq8 n ASP 136 N -5.28 5.41 -4.88 -2.05 8.00 -1.26 -2.31 116.55 114.18 1iq8 n ASP 136 Ca 0.03 -3.67 -0.30 0.00 0.71 0.00 0.00 54.79 51.56 1iq8 n ASP 136 Cb 0.28 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.12 40.58 1iq8 n ASP 136 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iq8 s ALA 137 N -3.66 3.33 0.45 2.24 0.00 -1.21 -5.02 121.76 117.88 1iq8 s ALA 137 Ca 0.45 -0.27 -0.25 0.00 0.00 0.00 0.00 51.96 51.89 1iq8 s ALA 137 Cb 0.24 -2.72 -0.08 0.00 0.00 0.00 0.00 23.12 20.55 1iq8 s ALA 137 CO -0.12 -0.19 1.38 -2.14 0.00 0.00 0.00 175.76 174.69 1iq8 s PRO 138 N -4.25 3.72 0.33 0.00 0.02 -1.26 -4.78 135.00 128.78 1iq8 s PRO 138 Ca 0.51 2.31 0.08 0.00 0.02 0.00 0.00 61.00 63.91 1iq8 s PRO 138 Cb -0.10 -2.64 0.78 0.00 0.02 0.00 0.00 34.50 32.55 1iq8 s PRO 138 CO 0.37 -0.75 1.81 -0.09 -0.33 0.00 0.00 177.00 178.02 1iq8 h ARG 139 N 2.34 0.72 -0.98 5.54 2.43 -1.99 -0.19 114.38 122.25 1iq8 h ARG 139 Ca -0.50 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 58.69 1iq8 h ARG 139 Cb 1.26 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 30.58 1iq8 h ARG 139 CO 0.61 0.47 0.62 0.93 -1.51 0.00 0.00 179.97 181.10 1iq8 h GLU 140 N 0.74 1.08 -0.05 0.20 5.08 -1.99 0.61 114.58 120.25 1iq8 h GLU 140 Ca 0.53 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.80 1iq8 h GLU 140 Cb 0.85 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 1iq8 h GLU 140 CO -0.30 0.71 -0.05 0.37 -1.00 0.00 0.00 179.01 178.74 1iq8 h GLN 141 N 1.11 0.13 -0.92 2.33 4.15 -1.41 -1.17 115.11 119.35 1iq8 h GLN 141 Ca 0.43 -0.07 0.07 0.00 0.77 0.00 0.00 58.65 59.85 1iq8 h GLN 141 Cb 0.21 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.84 1iq8 h GLN 141 CO -0.19 0.58 0.57 0.00 -1.93 0.00 0.00 178.83 177.87 1iq8 h ALA 142 N 0.55 1.29 -0.18 3.38 0.00 -0.96 -0.90 119.26 122.44 1iq8 h ALA 142 Ca 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1iq8 h ALA 142 Cb 0.55 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1iq8 h ALA 142 CO 0.01 0.30 -0.08 0.28 0.00 0.00 0.00 179.25 179.76 1iq8 h VAL 143 N 1.02 1.31 0.66 0.00 2.07 -0.86 -2.02 116.25 118.43 1iq8 h VAL 143 Ca 0.41 -1.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1iq8 h VAL 143 Cb 0.23 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1iq8 h VAL 143 CO -0.19 0.34 -0.44 0.50 0.02 0.00 0.00 177.57 177.79 1iq8 h LYS 144 N 0.07 -1.01 -0.54 1.57 3.64 -0.75 -1.77 116.57 117.77 1iq8 h LYS 144 Ca 0.04 0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 1iq8 h LYS 144 Cb 0.56 0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.58 1iq8 h LYS 144 CO 0.03 -0.67 0.36 0.93 -2.27 0.00 0.00 179.45 177.82 1iq8 h GLU 145 N -1.05 0.52 -0.52 1.90 5.08 -1.27 -1.85 114.58 117.39 1iq8 h GLU 145 Ca -0.08 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 1iq8 h GLU 145 Cb 0.86 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1iq8 h GLU 145 CO 0.06 0.34 -0.10 1.25 -1.00 0.00 0.00 179.01 179.56 1iq8 h LEU 146 N 0.53 0.98 -0.88 1.33 5.85 -1.00 0.19 115.31 122.31 1iq8 h LEU 146 Ca 0.23 -0.35 -0.11 0.00 0.84 0.00 0.00 57.88 58.49 1iq8 h LEU 146 Cb 0.23 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1iq8 h LEU 146 CO -0.06 1.10 -0.36 -0.33 -0.34 0.00 0.00 178.44 178.45 1iq8 h GLU 147 N 0.84 0.40 -0.24 1.25 4.39 -0.66 0.34 114.58 120.91 1iq8 h GLU 147 Ca 0.13 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1iq8 h GLU 147 Cb 0.66 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1iq8 h GLU 147 CO 0.05 0.71 -0.06 0.82 -1.16 0.00 0.00 179.01 179.36 1iq8 h ILE 148 N 0.34 1.28 -0.47 3.13 2.04 -1.13 -1.40 117.51 121.30 1iq8 h ILE 148 Ca 0.04 -1.06 0.08 0.00 1.00 0.00 0.00 64.86 64.92 1iq8 h ILE 148 Cb 0.79 1.49 -0.07 0.00 -0.74 0.00 0.00 36.82 38.29 1iq8 h ILE 148 CO 0.06 0.33 0.05 0.74 0.00 0.00 0.00 178.15 179.33 1iq8 h THR 149 N 0.20 0.68 -0.30 -0.27 2.02 -0.60 -1.00 112.91 113.65 1iq8 h THR 149 Ca 0.06 -0.06 -0.08 0.00 0.77 0.00 0.00 66.41 67.11 1iq8 h THR 149 Cb 0.52 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1iq8 h THR 149 CO 0.02 0.03 -0.15 -0.07 0.37 0.00 0.00 175.52 175.73 1iq8 h LEU 150 N 0.17 0.50 -0.74 2.58 3.38 -0.74 -1.05 115.31 119.40 1iq8 h LEU 150 Ca 0.24 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1iq8 h LEU 150 Cb 0.33 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1iq8 h LEU 150 CO -0.35 0.67 -0.17 0.77 0.09 0.00 0.00 178.44 179.45 1iq8 h SER 151 N 0.47 0.78 0.42 -0.43 4.64 -0.58 0.06 113.55 118.91 1iq8 h SER 151 Ca 0.08 -0.26 -0.08 0.00 -0.47 0.00 0.00 61.79 61.06 1iq8 h SER 151 Cb 0.53 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 1iq8 h SER 151 CO 0.03 0.95 -0.39 0.03 -0.87 0.00 0.00 176.83 176.59 1iq8 h ARG 152 N 0.69 0.00 -0.06 4.77 3.08 -0.75 -2.17 114.38 119.94 1iq8 h ARG 152 Ca 0.11 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.99 1iq8 h ARG 152 Cb 0.67 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1iq8 h ARG 152 CO 0.05 0.39 -0.68 0.00 -1.07 0.00 0.00 179.97 178.66 1iq8 h ALA 153 N 1.61 0.72 -0.48 0.04 0.00 -0.40 -1.93 119.26 118.82 1iq8 h ALA 153 Ca -0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 1iq8 h ALA 153 Cb 0.70 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1iq8 h ALA 153 CO 0.05 0.77 0.12 0.00 0.00 0.00 0.00 179.25 180.19 1iq8 h ARG 154 N 0.20 0.77 -0.42 0.00 3.08 -0.40 -0.18 114.38 117.43 1iq8 h ARG 154 Ca -0.02 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.79 1iq8 h ARG 154 Cb 1.22 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.16 1iq8 h ARG 154 CO 0.11 0.76 0.04 1.49 -1.07 0.00 0.00 179.97 181.30 1iq8 h GLU 155 N 0.66 0.71 -0.46 0.04 4.81 -1.36 -2.82 114.58 116.16 1iq8 h GLU 155 Ca 0.15 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1iq8 h GLU 155 Cb 0.33 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1iq8 h GLU 155 CO 0.00 0.76 0.30 0.00 -0.73 0.00 0.00 179.01 179.34 1iq8 h ALA 156 N 0.92 0.58 -0.44 2.92 0.00 -1.16 -1.41 119.26 120.67 1iq8 h ALA 156 Ca 0.12 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1iq8 h ALA 156 Cb 0.42 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1iq8 h ALA 156 CO 0.01 0.03 0.29 1.49 0.00 0.00 0.00 179.25 181.08 1iq8 h GLU 157 N 0.62 0.42 0.09 0.00 4.81 -0.92 0.45 114.58 120.05 1iq8 h GLU 157 Ca 0.17 -0.03 -0.27 0.00 -0.13 0.00 0.00 59.36 59.11 1iq8 h GLU 157 Cb -0.06 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1iq8 h GLU 157 CO -0.04 0.28 -1.27 0.93 -0.73 0.00 0.00 179.01 178.18 1iq8 h GLU 158 N 0.43 0.18 0.00 1.92 5.08 -1.17 -3.35 114.58 117.66 1iq8 h GLU 158 Ca 0.18 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1iq8 h GLU 158 Cb 0.19 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1iq8 h GLU 158 CO -0.04 1.10 -1.12 -0.89 -1.00 0.00 0.00 179.01 177.06 1iq8 n ILE 159 N -3.44 0.10 -1.65 3.13 5.41 -0.58 -4.99 119.36 117.35 1iq8 n ILE 159 Ca -0.08 -0.21 -0.48 0.00 1.00 0.00 0.00 62.75 62.98 1iq8 n ILE 159 Cb 1.01 0.36 -0.05 0.00 -0.71 0.00 0.00 39.64 40.25 1iq8 n ILE 159 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1iq8 n LYS 160 N -1.88 1.90 -0.81 0.38 4.81 0.16 -4.88 118.16 117.84 1iq8 n LYS 160 Ca 0.02 0.69 0.03 0.00 -0.87 0.00 0.00 58.31 58.18 1iq8 n LYS 160 Cb 0.42 -2.43 0.04 0.00 0.02 0.00 0.00 35.03 33.09 1iq8 n LYS 160 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1iq8 n GLU 161 N 3.28 0.29 -3.58 1.64 -0.58 -1.26 -5.03 120.64 115.40 1iq8 n GLU 161 Ca 0.17 -1.74 -0.12 0.00 -0.42 0.00 0.00 57.16 55.05 1iq8 n GLU 161 Cb 0.26 -0.54 -0.05 0.00 -0.57 0.00 0.00 31.44 30.54 1iq8 n GLU 161 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1iq8 s ILE 162 N -0.63 0.04 0.37 -3.67 1.01 -1.26 -5.08 121.20 111.99 1iq8 s ILE 162 Ca 0.19 -0.37 -0.28 0.00 0.00 0.00 0.00 60.65 60.20 1iq8 s ILE 162 Cb 0.20 -1.06 -0.10 0.00 0.01 0.00 0.00 42.46 41.51 1iq8 s ILE 162 CO -0.06 -0.20 1.37 -2.84 0.00 0.00 0.00 174.94 173.21 1iq8 s PRO 163 N -3.26 4.16 0.05 2.79 0.02 -1.25 -4.86 135.00 132.65 1iq8 s PRO 163 Ca -0.01 2.33 0.02 0.00 0.02 0.00 0.00 61.00 63.37 1iq8 s PRO 163 Cb 0.00 -2.95 -0.03 0.00 0.02 0.00 0.00 34.50 31.55 1iq8 s PRO 163 CO -0.08 -0.40 -0.08 -1.64 -0.33 0.00 0.00 177.00 174.47 1iq8 s MET 164 N -2.02 0.56 0.12 5.54 -1.94 -1.26 -1.13 119.30 119.16 1iq8 s MET 164 Ca 0.52 -0.81 -0.24 0.00 -1.71 0.00 0.00 55.69 53.46 1iq8 s MET 164 Cb -0.42 -0.28 -0.07 0.00 2.01 0.00 0.00 34.83 36.07 1iq8 s MET 164 CO 0.56 0.04 0.73 -0.80 -0.01 0.00 0.00 175.02 175.54 1iq8 s ASN 165 N -1.71 7.27 -0.42 3.03 0.02 -0.14 -2.69 114.94 120.31 1iq8 s ASN 165 Ca -0.08 1.51 0.03 0.00 -1.02 0.00 0.00 52.86 53.30 1iq8 s ASN 165 Cb -0.09 -2.46 0.12 0.00 0.02 0.00 0.00 41.25 38.84 1iq8 s ASN 165 CO -0.00 0.18 0.18 0.00 0.02 0.00 0.00 177.10 177.48 1iq8 s ALA 166 N -0.89 2.55 -0.02 0.60 0.00 -0.05 -4.34 121.76 119.61 1iq8 s ALA 166 Ca 0.35 -2.62 -0.30 0.00 0.00 0.00 0.00 51.96 49.39 1iq8 s ALA 166 Cb -0.22 -1.94 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 1iq8 s ALA 166 CO 0.24 -1.90 1.24 0.99 0.00 0.00 0.00 175.76 176.33 1iq8 s THR 167 N 0.51 4.10 0.01 0.00 2.01 -1.26 -3.85 115.64 117.16 1iq8 s THR 167 Ca 0.15 1.46 -0.30 0.00 0.31 0.00 0.00 61.69 63.30 1iq8 s THR 167 Cb -0.22 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 1iq8 s THR 167 CO -0.06 0.02 1.13 -0.63 -0.69 0.00 0.00 174.62 174.38 1iq8 s ILE 168 N 2.06 4.35 -0.41 1.82 1.01 -0.40 -4.88 121.20 124.77 1iq8 s ILE 168 Ca 0.58 1.68 0.04 0.00 0.00 0.00 0.00 60.65 62.95 1iq8 s ILE 168 Cb -0.27 -4.08 0.16 0.00 0.01 0.00 0.00 42.46 38.28 1iq8 s ILE 168 CO 0.24 0.10 0.39 -1.58 0.00 0.00 0.00 174.94 174.08 1iq8 s GLN 169 N 1.33 0.80 -0.17 2.79 2.00 -1.26 -1.46 119.66 123.69 1iq8 s GLN 169 Ca 0.56 -1.49 0.16 0.00 -2.00 0.00 0.00 55.36 52.59 1iq8 s GLN 169 Cb -0.25 -1.00 0.44 0.00 0.80 0.00 0.00 33.01 32.99 1iq8 s GLN 169 CO 0.27 -1.30 1.19 0.41 -0.50 0.00 0.00 175.29 175.36 1iq8 n GLY 170 N 3.44 3.81 7.00 2.59 0.00 -1.26 -4.56 105.19 116.21 1iq8 n GLY 170 Ca 0.20 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1iq8 n GLY 170 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iq8 n SER 171 N -0.53 0.00 -1.35 1.61 2.88 -1.26 -2.29 113.62 112.67 1iq8 n SER 171 Ca 0.18 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.71 1iq8 n SER 171 Cb 0.88 0.00 0.18 0.00 -0.75 0.00 0.00 64.21 64.52 1iq8 n SER 171 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1iq8 n THR 172 N 0.00 1.66 -3.49 2.46 -2.24 -0.98 -4.82 114.28 106.87 1iq8 n THR 172 Ca 0.00 -0.81 -0.42 0.00 -2.27 0.00 0.00 64.05 60.54 1iq8 n THR 172 Cb 0.00 -0.48 -0.09 0.00 -2.10 0.00 0.00 70.33 67.66 1iq8 n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1iq8 s TYR 173 N -1.87 3.27 0.32 4.78 1.51 -0.97 -4.96 117.35 119.43 1iq8 s TYR 173 Ca 0.29 -1.09 0.06 0.00 -1.01 0.00 0.00 57.07 55.32 1iq8 s TYR 173 Cb 0.23 -2.94 0.72 0.00 -0.11 0.00 0.00 41.96 39.86 1iq8 s TYR 173 CO 0.08 -0.77 1.83 1.79 -1.11 0.00 0.00 175.55 177.36 1iq8 h THR 174 N 5.86 0.82 -0.23 -0.71 1.35 -1.87 -0.33 112.91 117.81 1iq8 h THR 174 Ca -0.26 -0.28 -0.09 0.00 -0.55 0.00 0.00 66.41 65.23 1iq8 h THR 174 Cb 1.10 -0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.45 1iq8 h THR 174 CO 0.80 0.15 -0.24 -2.24 -0.25 0.00 0.00 175.52 173.73 1iq8 h ASP 175 N 0.81 0.42 -0.29 5.36 2.03 -1.95 -0.90 116.42 121.89 1iq8 h ASP 175 Ca 0.50 -0.14 -0.18 0.00 -0.73 0.00 0.00 57.03 56.49 1iq8 h ASP 175 Cb 0.72 -0.11 -0.00 0.00 -0.83 0.00 0.00 39.33 39.10 1iq8 h ASP 175 CO -0.27 0.67 -0.49 -0.07 -1.03 0.00 0.00 179.24 178.04 1iq8 h LEU 176 N 0.38 0.96 -0.34 0.15 3.38 -1.40 -0.27 115.31 118.17 1iq8 h LEU 176 Ca 0.06 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1iq8 h LEU 176 Cb 0.63 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1iq8 h LEU 176 CO 0.05 1.28 0.22 0.03 0.09 0.00 0.00 178.44 180.11 1iq8 h ARG 177 N 0.69 0.45 -0.44 1.13 2.47 -1.05 0.35 114.38 117.98 1iq8 h ARG 177 Ca 0.03 -0.03 0.04 0.00 -1.26 0.00 0.00 59.98 58.76 1iq8 h ARG 177 Cb 1.09 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 29.27 1iq8 h ARG 177 CO 0.11 0.31 0.21 -0.09 0.56 0.00 0.00 179.97 181.07 1iq8 h ARG 178 N 0.45 0.40 -0.10 0.04 2.43 -0.99 0.15 114.38 116.76 1iq8 h ARG 178 Ca 0.12 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1iq8 h ARG 178 Cb -0.04 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1iq8 h ARG 178 CO -0.03 0.27 0.05 -0.92 -1.51 0.00 0.00 179.97 177.83 1iq8 h TYR 179 N 0.41 0.15 -0.31 2.20 3.20 -0.61 -0.52 116.97 121.49 1iq8 h TYR 179 Ca 0.19 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.08 1iq8 h TYR 179 Cb 0.12 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 1iq8 h TYR 179 CO -0.11 0.23 0.12 0.00 -1.64 0.00 0.00 178.16 176.75 1iq8 h ALA 180 N 0.91 0.36 -0.64 1.82 0.00 0.12 -1.30 119.26 120.53 1iq8 h ALA 180 Ca 0.03 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1iq8 h ALA 180 Cb 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1iq8 h ALA 180 CO -0.00 -0.27 0.26 0.00 0.00 0.00 0.00 179.25 179.23 1iq8 h ALA 181 N 1.19 0.83 -0.52 0.00 0.00 -0.59 -1.42 119.26 118.75 1iq8 h ALA 181 Ca 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1iq8 h ALA 181 Cb 0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1iq8 h ALA 181 CO -0.13 0.44 0.29 0.00 0.00 0.00 0.00 179.25 179.85 1iq8 h ARG 182 N 0.90 0.72 0.50 0.00 3.08 -0.71 -0.54 114.38 118.33 1iq8 h ARG 182 Ca 0.21 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 1iq8 h ARG 182 Cb 0.20 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1iq8 h ARG 182 CO -0.02 0.56 -0.24 0.00 -1.07 0.00 0.00 179.97 179.20 1iq8 h ARG 183 N 0.70 -0.65 -0.24 0.04 2.47 -1.04 -2.79 114.38 112.88 1iq8 h ARG 183 Ca 0.18 0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 58.91 1iq8 h ARG 183 Cb 0.04 0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.49 1iq8 h ARG 183 CO -0.03 -0.34 -0.02 -0.07 0.56 0.00 0.00 179.97 180.07 1iq8 h LEU 184 N -0.94 0.33 -1.59 3.04 -0.00 -1.30 -1.95 115.31 112.89 1iq8 h LEU 184 Ca -0.07 -0.05 -0.05 0.00 -0.00 0.00 0.00 57.88 57.72 1iq8 h LEU 184 Cb 0.60 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.17 1iq8 h LEU 184 CO 0.11 0.40 -0.22 -1.28 -0.00 0.00 0.00 178.44 177.45 1iq8 h SER 185 N 0.34 0.00 1.52 -0.43 0.87 -1.11 -2.01 113.55 112.73 1iq8 h SER 185 Ca 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1iq8 h SER 185 Cb 0.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1iq8 h SER 185 CO 0.01 0.22 -0.34 0.77 -0.53 0.00 0.00 176.83 176.96 1iq8 h SER 186 N 0.00 0.00 -3.48 6.23 4.64 -1.07 -3.45 113.55 116.42 1iq8 h SER 186 Ca -0.00 -0.03 -0.48 0.00 -0.47 0.00 0.00 61.79 60.81 1iq8 h SER 186 Cb 0.41 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.54 1iq8 h SER 186 CO 0.03 0.01 0.09 -0.04 -0.87 0.00 0.00 176.83 176.05 1iq8 s MET 187 N -3.23 3.37 -1.00 4.77 1.00 -0.76 -5.00 119.30 118.45 1iq8 s MET 187 Ca 0.06 0.07 -0.17 0.00 0.00 0.00 0.00 55.69 55.65 1iq8 s MET 187 Cb 0.08 -2.38 0.14 0.00 0.00 0.00 0.00 34.83 32.68 1iq8 s MET 187 CO 0.70 -0.30 1.20 0.54 0.00 0.00 0.00 175.02 177.16 1iq8 s ASN 188 N -4.15 6.76 0.30 3.03 4.22 -1.26 -4.95 114.94 118.88 1iq8 s ASN 188 Ca 0.48 -2.33 0.08 0.00 -2.14 0.00 0.00 52.86 48.96 1iq8 s ASN 188 Cb -0.10 -2.39 -0.06 0.00 1.28 0.00 0.00 41.25 39.97 1iq8 s ASN 188 CO 0.44 -0.96 -0.08 -0.36 -2.04 0.00 0.00 177.10 174.10 1iq8 s PHE 189 N 2.31 2.09 -0.15 1.54 0.40 -1.26 -4.95 117.98 117.96 1iq8 s PHE 189 Ca 0.35 -0.62 0.16 0.00 -0.60 0.00 0.00 56.93 56.22 1iq8 s PHE 189 Cb -0.04 -1.17 -0.23 0.00 0.51 0.00 0.00 43.02 42.09 1iq8 s PHE 189 CO -0.07 0.39 0.11 -0.85 0.70 0.00 0.00 175.22 175.51 1iq8 n GLU 190 N -0.64 1.07 -4.11 0.44 0.00 -1.09 -5.01 120.64 111.30 1iq8 n GLU 190 Ca -0.05 -0.03 -0.14 0.00 0.00 0.00 0.00 57.16 56.93 1iq8 n GLU 190 Cb 0.63 -1.45 -0.13 0.00 0.00 0.00 0.00 31.44 30.50 1iq8 n GLU 190 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1iq8 s ILE 191 N -2.55 0.49 -0.38 3.84 1.01 -1.17 -3.99 121.20 118.45 1iq8 s ILE 191 Ca -0.08 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 59.91 1iq8 s ILE 191 Cb 0.06 -0.50 0.11 0.00 0.01 0.00 0.00 42.46 42.14 1iq8 s ILE 191 CO 0.72 -0.15 0.10 -1.00 0.00 0.00 0.00 174.94 174.61 1iq8 s HIS 192 N -0.81 3.58 0.62 3.97 3.76 -0.75 -0.87 115.29 124.80 1iq8 s HIS 192 Ca -0.04 -3.02 -0.12 0.00 -0.15 0.00 0.00 55.06 51.72 1iq8 s HIS 192 Cb -0.06 -2.87 -0.03 0.00 1.11 0.00 0.00 32.58 30.72 1iq8 s HIS 192 CO 0.00 -0.90 1.03 -2.14 -0.85 0.00 0.00 174.74 171.89 1iq8 s PRO 193 N 0.63 3.44 -0.27 8.40 0.02 -1.25 -2.41 135.00 143.57 1iq8 s PRO 193 Ca 0.12 0.89 -0.04 0.00 0.02 0.00 0.00 61.00 61.99 1iq8 s PRO 193 Cb -0.21 -2.06 0.01 0.00 0.02 0.00 0.00 34.50 32.27 1iq8 s PRO 193 CO -0.06 -0.69 0.01 0.42 -0.33 0.00 0.00 177.00 176.34 1iq8 s ILE 194 N -2.98 3.47 0.54 2.83 1.01 0.96 -1.27 121.20 125.76 1iq8 s ILE 194 Ca 0.57 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 60.51 1iq8 s ILE 194 Cb -0.12 -2.75 0.06 0.00 0.01 0.00 0.00 42.46 39.65 1iq8 s ILE 194 CO 0.49 0.17 0.63 -0.83 0.00 0.00 0.00 174.94 175.40 1iq8 s GLY 195 N 1.43 1.95 -0.68 6.18 0.00 -0.53 -2.63 107.32 113.04 1iq8 s GLY 195 Ca 0.02 -1.85 0.00 0.00 0.00 0.00 0.00 44.72 42.89 1iq8 s GLY 195 CO -0.01 -1.73 0.00 0.61 0.00 0.00 0.00 173.10 171.97 1iq8 n GLY 196 N -2.02 0.86 0.38 0.20 0.00 -1.26 -4.79 105.19 98.56 1iq8 n GLY 196 Ca 0.09 -0.58 0.07 0.00 0.00 0.00 0.00 46.02 45.61 1iq8 n GLY 196 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1iq8 n VAL 197 N -2.75 0.00 0.05 1.61 0.24 -1.26 -4.41 118.33 111.80 1iq8 n VAL 197 Ca -0.06 -0.37 -0.11 0.00 -2.04 0.00 0.00 64.34 61.76 1iq8 n VAL 197 Cb 0.24 1.20 -0.05 0.00 -1.47 0.00 0.00 33.84 33.76 1iq8 n VAL 197 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1iq8 h VAL 198 N 1.89 0.71 -0.23 3.34 2.07 -1.91 -0.80 116.25 121.32 1iq8 h VAL 198 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1iq8 h VAL 198 Cb 0.53 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1iq8 h VAL 198 CO 0.00 0.00 0.15 -0.65 0.02 0.00 0.00 177.57 177.09 1iq8 h PRO 199 N -0.19 0.26 -0.13 1.57 0.11 -1.98 -1.67 132.00 129.97 1iq8 h PRO 199 Ca 0.04 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.07 1iq8 h PRO 199 Cb 0.25 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 1iq8 h PRO 199 CO -0.12 0.17 -0.18 -0.07 -0.21 0.00 0.00 178.00 177.59 1iq8 h LEU 200 N 0.26 0.38 -0.45 2.35 3.38 -1.66 -2.23 115.31 117.35 1iq8 h LEU 200 Ca 0.09 -0.52 0.01 0.00 0.09 0.00 0.00 57.88 57.55 1iq8 h LEU 200 Cb 0.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1iq8 h LEU 200 CO -0.02 0.83 0.29 -0.07 0.09 0.00 0.00 178.44 179.56 1iq8 h LEU 201 N -0.05 0.50 -1.30 1.67 3.38 -0.69 0.18 115.31 119.00 1iq8 h LEU 201 Ca 0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1iq8 h LEU 201 Cb 0.74 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1iq8 h LEU 201 CO 0.04 0.36 0.11 -0.33 0.09 0.00 0.00 178.44 178.72 1iq8 h GLU 202 N 0.60 0.59 -0.18 1.13 5.08 -1.34 -0.86 114.58 119.60 1iq8 h GLU 202 Ca 0.17 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1iq8 h GLU 202 Cb -0.05 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1iq8 h GLU 202 CO -0.05 0.53 0.00 0.43 -1.00 0.00 0.00 179.01 178.93 1iq8 n SER 203 N -4.34 1.33 -2.79 1.42 7.64 -0.84 -4.91 113.62 111.13 1iq8 n SER 203 Ca 0.03 -1.77 -0.21 0.00 1.01 0.00 0.00 58.87 57.93 1iq8 n SER 203 Cb 0.18 -0.12 0.01 0.00 -1.01 0.00 0.00 64.21 63.28 1iq8 n SER 203 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1iq8 n TYR 204 N 0.14 -1.58 -2.29 1.43 0.53 -0.33 -4.88 117.16 110.18 1iq8 n TYR 204 Ca 0.13 0.29 -0.41 0.00 -1.02 0.00 0.00 57.90 56.89 1iq8 n TYR 204 Cb 0.25 -3.96 0.00 0.00 -1.03 0.00 0.00 39.34 34.60 1iq8 n TYR 204 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 1iq8 n ARG 205 N -3.53 4.37 0.13 -0.72 1.74 0.48 -4.72 116.66 114.40 1iq8 n ARG 205 Ca -0.15 -3.74 0.02 0.00 -0.77 0.00 0.00 57.85 53.21 1iq8 n ARG 205 Cb 0.63 -2.69 0.38 0.00 -1.02 0.00 0.00 32.46 29.76 1iq8 n ARG 205 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1iq8 h PHE 206 N 5.02 0.21 -0.58 -1.55 0.05 -1.81 -2.88 116.94 115.40 1iq8 h PHE 206 Ca 0.53 -0.03 -0.04 0.00 3.82 0.00 0.00 57.97 62.25 1iq8 h PHE 206 Cb 0.44 -0.06 -0.02 0.00 2.00 0.00 0.00 35.95 38.31 1iq8 h PHE 206 CO 1.39 0.38 0.20 -0.09 -0.18 0.00 0.00 178.31 180.01 1iq8 h ARG 207 N 0.19 0.89 -0.46 1.51 2.43 -1.85 -0.93 114.38 116.16 1iq8 h ARG 207 Ca 0.04 -0.18 -0.06 0.00 -0.81 0.00 0.00 59.98 58.97 1iq8 h ARG 207 Cb 0.43 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1iq8 h ARG 207 CO 0.03 0.78 0.03 -0.44 -1.51 0.00 0.00 179.97 178.86 1iq8 h ASP 208 N 0.81 0.69 -0.67 -3.80 3.32 -1.92 -2.23 116.42 112.62 1iq8 h ASP 208 Ca 0.19 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 1iq8 h ASP 208 Cb 0.25 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1iq8 h ASP 208 CO -0.01 0.74 0.16 0.58 -1.72 0.00 0.00 179.24 178.99 1iq8 h VAL 209 N 0.69 1.26 -0.28 -1.35 2.07 -1.24 -1.51 116.25 115.89 1iq8 h VAL 209 Ca 0.14 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1iq8 h VAL 209 Cb 0.38 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1iq8 h VAL 209 CO 0.01 0.37 0.18 0.58 0.02 0.00 0.00 177.57 178.73 1iq8 h VAL 210 N 1.03 1.08 -0.47 2.57 2.07 -0.67 0.16 116.25 122.02 1iq8 h VAL 210 Ca 0.21 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.52 1iq8 h VAL 210 Cb 0.37 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1iq8 h VAL 210 CO 0.00 0.07 0.03 0.44 0.02 0.00 0.00 177.57 178.13 1iq8 h ASP 211 N 0.38 0.73 -0.24 0.57 3.32 -1.18 -0.12 116.42 119.88 1iq8 h ASP 211 Ca 0.10 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 1iq8 h ASP 211 Cb -0.04 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1iq8 h ASP 211 CO -0.02 0.78 -0.09 0.40 -1.72 0.00 0.00 179.24 178.59 1iq8 h ILE 212 N 0.72 1.29 -0.16 0.35 2.04 -0.89 -2.19 117.51 118.67 1iq8 h ILE 212 Ca 0.15 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 1iq8 h ILE 212 Cb 0.41 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1iq8 h ILE 212 CO 0.01 0.35 0.06 0.58 0.00 0.00 0.00 178.15 179.16 1iq8 h VAL 213 N 0.20 1.16 -0.57 1.67 2.07 -0.43 -2.19 116.25 118.16 1iq8 h VAL 213 Ca 0.06 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 1iq8 h VAL 213 Cb 0.57 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1iq8 h VAL 213 CO 0.03 0.15 -0.00 0.40 0.02 0.00 0.00 177.57 178.16 1iq8 h ILE 214 N 0.11 1.27 -0.87 4.57 2.04 -1.06 0.95 117.51 124.52 1iq8 h ILE 214 Ca 0.05 -1.14 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 1iq8 h ILE 214 Cb 0.17 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1iq8 h ILE 214 CO -0.00 0.41 0.54 0.28 0.00 0.00 0.00 178.15 179.38 1iq8 h SER 215 N 0.90 1.03 0.34 1.72 0.02 -1.37 -0.17 113.55 116.01 1iq8 h SER 215 Ca 0.16 -0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1iq8 h SER 215 Cb 0.55 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1iq8 h SER 215 CO 0.03 0.78 -0.16 0.28 -1.14 0.00 0.00 176.83 176.61 1iq8 h SER 216 N 1.19 -0.38 -0.75 3.07 0.02 -1.10 -3.19 113.55 112.40 1iq8 h SER 216 Ca 0.31 -0.10 0.08 0.00 -0.84 0.00 0.00 61.79 61.24 1iq8 h SER 216 Cb -0.08 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 1iq8 h SER 216 CO -0.06 -0.12 0.49 0.11 -1.14 0.00 0.00 176.83 176.11 1iq8 h LYS 217 N -0.64 0.72 -0.04 3.45 1.57 -0.52 -1.88 116.57 119.24 1iq8 h LYS 217 Ca -0.05 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1iq8 h LYS 217 Cb 0.46 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 1iq8 h LYS 217 CO 0.08 0.48 -0.00 0.52 -0.57 0.00 0.00 179.45 179.95 1iq8 h MET 218 N 0.74 0.05 -0.34 3.15 2.86 -1.02 -2.91 114.93 117.46 1iq8 h MET 218 Ca 0.33 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 1iq8 h MET 218 Cb 0.33 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1iq8 h MET 218 CO -0.12 0.06 0.00 0.00 1.06 0.00 0.00 176.91 177.91 1iq8 n ALA 219 N -2.53 2.77 -2.78 6.32 0.00 -0.72 -5.00 120.51 118.57 1iq8 n ALA 219 Ca -0.02 -1.83 -0.30 0.00 0.00 0.00 0.00 53.44 51.29 1iq8 n ALA 219 Cb 0.11 -0.67 -0.06 0.00 0.00 0.00 0.00 19.45 18.83 1iq8 n ALA 219 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1iq8 s LEU 220 N -2.11 3.81 0.05 0.00 1.43 -1.10 -3.50 118.68 117.27 1iq8 s LEU 220 Ca 0.37 -0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 53.15 1iq8 s LEU 220 Cb 0.27 -2.49 -0.08 0.00 0.03 0.00 0.00 46.19 43.92 1iq8 s LEU 220 CO 0.13 0.16 1.74 -0.13 0.23 0.00 0.00 176.35 178.48 1iq8 s ARG 221 N -2.46 4.17 0.45 1.70 0.52 -1.26 -4.85 118.95 117.22 1iq8 s ARG 221 Ca 0.30 2.40 0.31 0.00 -0.52 0.00 0.00 55.73 58.22 1iq8 s ARG 221 Cb -0.12 -3.76 1.58 0.00 0.52 0.00 0.00 34.95 33.16 1iq8 s ARG 221 CO 0.22 -0.81 1.94 -1.35 0.02 0.00 0.00 175.30 175.32 1iq8 h PRO 222 N 8.98 0.00 -0.01 3.54 0.11 -1.96 -2.82 132.00 139.84 1iq8 h PRO 222 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1iq8 h PRO 222 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1iq8 h PRO 222 CO 0.94 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.33 1iq8 n ASP 223 N -2.62 0.52 -4.67 -2.05 5.75 -1.26 -4.83 116.55 107.39 1iq8 n ASP 223 Ca -0.01 -1.21 -0.34 0.00 -0.01 0.00 0.00 54.79 53.21 1iq8 n ASP 223 Cb 0.11 -0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.10 1iq8 n ASP 223 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1iq8 s ARG 224 N -1.99 2.91 0.59 0.11 0.52 -1.07 -4.79 118.95 115.23 1iq8 s ARG 224 Ca 0.43 -0.47 -0.20 0.00 -0.52 0.00 0.00 55.73 54.97 1iq8 s ARG 224 Cb 0.21 -2.74 -0.03 0.00 0.52 0.00 0.00 34.95 32.90 1iq8 s ARG 224 CO 0.34 0.68 1.26 -2.14 0.02 0.00 0.00 175.30 175.46 1iq8 s PRO 225 N -1.06 2.95 -0.16 3.54 0.02 -1.26 -4.85 135.00 134.18 1iq8 s PRO 225 Ca 0.15 1.98 0.01 0.00 0.02 0.00 0.00 61.00 63.16 1iq8 s PRO 225 Cb -0.11 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.40 1iq8 s PRO 225 CO 0.04 -1.27 -0.17 0.08 -0.33 0.00 0.00 177.00 175.35 1iq8 s VAL 226 N -1.47 2.42 -0.25 3.83 1.01 -1.26 -1.80 120.40 122.89 1iq8 s VAL 226 Ca 0.77 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 1iq8 s VAL 226 Cb -0.35 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 34.02 1iq8 s VAL 226 CO 0.38 0.52 -0.00 -2.28 0.00 0.00 0.00 175.10 173.72 1iq8 s HIS 227 N 0.93 3.04 -0.84 5.22 5.04 -1.01 0.57 115.29 128.24 1iq8 s HIS 227 Ca -0.03 -0.98 -0.22 0.00 -1.54 0.00 0.00 55.06 52.29 1iq8 s HIS 227 Cb -0.15 -2.15 0.08 0.00 0.04 0.00 0.00 32.58 30.40 1iq8 s HIS 227 CO -0.03 -0.56 1.16 -1.17 -2.34 0.00 0.00 174.74 171.80 1iq8 s LEU 228 N 1.48 4.32 0.02 8.88 2.96 -0.19 -0.03 118.68 136.12 1iq8 s LEU 228 Ca 0.04 -1.41 -0.32 0.00 -0.22 0.00 0.00 54.13 52.22 1iq8 s LEU 228 Cb -0.15 -2.46 -0.10 0.00 0.50 0.00 0.00 46.19 43.98 1iq8 s LEU 228 CO -0.01 -1.36 1.91 0.33 -1.32 0.00 0.00 176.35 175.89 1iq8 n PHE 229 N 7.70 2.47 -0.89 5.38 7.35 -1.08 -2.15 117.46 136.24 1iq8 n PHE 229 Ca 0.14 -0.19 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 1iq8 n PHE 229 Cb 0.48 -2.74 0.00 0.00 0.35 0.00 0.00 39.48 37.57 1iq8 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1iq8 n GLY 230 N 4.40 0.73 3.49 7.13 0.00 -1.26 -4.43 105.19 115.25 1iq8 n GLY 230 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1iq8 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iq8 n ALA 231 N 0.67 3.79 -0.46 4.61 0.00 -0.91 -4.74 120.51 123.45 1iq8 n ALA 231 Ca 0.00 -4.05 0.10 0.00 0.00 0.00 0.00 53.44 49.49 1iq8 n ALA 231 Cb 0.00 -3.33 0.31 0.00 0.00 0.00 0.00 19.45 16.42 1iq8 n ALA 231 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iq8 n GLY 232 N 4.69 2.72 3.41 0.00 0.00 -1.10 -4.01 105.19 110.91 1iq8 n GLY 232 Ca 0.43 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 1iq8 n GLY 232 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1iq8 s HIS 233 N -1.40 2.97 0.65 1.61 2.46 -1.26 -4.61 115.29 115.70 1iq8 s HIS 233 Ca 0.45 -0.56 0.23 0.00 0.47 0.00 0.00 55.06 55.66 1iq8 s HIS 233 Cb 0.26 -2.00 1.21 0.00 -0.13 0.00 0.00 32.58 31.92 1iq8 s HIS 233 CO 0.26 -0.24 1.68 -1.35 -2.47 0.00 0.00 174.74 172.62 1iq8 h PRO 234 N 7.21 0.00 -0.24 2.88 0.11 -1.91 -2.67 132.00 137.38 1iq8 h PRO 234 Ca -0.33 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.84 1iq8 h PRO 234 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1iq8 h PRO 234 CO 0.60 0.00 0.17 0.97 -0.21 0.00 0.00 178.00 179.53 1iq8 h ILE 235 N 0.00 0.90 -0.02 4.15 2.10 -1.78 -2.61 117.51 120.25 1iq8 h ILE 235 Ca 0.07 -0.01 0.00 0.00 1.08 0.00 0.00 64.86 66.00 1iq8 h ILE 235 Cb 1.20 0.87 0.00 0.00 -1.09 0.00 0.00 36.82 37.80 1iq8 h ILE 235 CO -0.00 0.01 -0.24 1.33 -1.08 0.00 0.00 178.15 178.16 1iq8 n VAL 236 N -4.47 0.00 0.13 2.19 0.24 -1.01 -4.72 118.33 110.69 1iq8 n VAL 236 Ca 0.03 -0.38 -0.15 0.00 -2.04 0.00 0.00 64.34 61.79 1iq8 n VAL 236 Cb 0.30 1.33 -0.08 0.00 -1.47 0.00 0.00 33.84 33.92 1iq8 n VAL 236 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 1iq8 h PHE 237 N 3.14 -1.30 -0.24 6.34 0.05 -1.63 0.13 116.94 123.43 1iq8 h PHE 237 Ca 0.00 0.03 0.05 0.00 3.82 0.00 0.00 57.97 61.87 1iq8 h PHE 237 Cb 0.79 0.55 -0.05 0.00 2.00 0.00 0.00 35.95 39.24 1iq8 h PHE 237 CO 0.00 -0.55 -0.06 0.00 -0.18 0.00 0.00 178.31 177.51 1iq8 h ALA 238 N -0.32 0.16 -0.14 2.45 0.00 -1.84 0.57 119.26 120.13 1iq8 h ALA 238 Ca 0.01 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1iq8 h ALA 238 Cb 0.72 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1iq8 h ALA 238 CO -0.25 -0.47 0.04 1.25 0.00 0.00 0.00 179.25 179.82 1iq8 h LEU 239 N -0.01 0.03 -0.63 0.00 5.85 -1.82 -0.94 115.31 117.79 1iq8 h LEU 239 Ca 0.12 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1iq8 h LEU 239 Cb 0.18 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 1iq8 h LEU 239 CO -0.25 0.04 0.32 0.00 -0.34 0.00 0.00 178.44 178.21 1iq8 h ALA 240 N 1.09 0.81 0.00 1.25 0.00 -0.43 -2.56 119.26 119.42 1iq8 h ALA 240 Ca 0.06 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1iq8 h ALA 240 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1iq8 h ALA 240 CO -0.07 0.35 -0.33 0.28 0.00 0.00 0.00 179.25 179.48 1iq8 h VAL 241 N 0.86 1.05 0.00 0.00 2.07 -0.66 -1.78 116.25 117.78 1iq8 h VAL 241 Ca 0.22 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.51 1iq8 h VAL 241 Cb 0.09 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1iq8 h VAL 241 CO -0.03 0.33 0.00 0.00 0.02 0.00 0.00 177.57 177.89 1iq8 n ALA 242 N -2.39 1.81 1.06 1.67 0.00 -0.38 -1.90 120.51 120.37 1iq8 n ALA 242 Ca -0.01 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.58 1iq8 n ALA 242 Cb 0.41 -1.37 0.19 0.00 0.00 0.00 0.00 19.45 18.67 1iq8 n ALA 242 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1iq8 n MET 243 N -2.04 2.21 -0.50 0.00 2.81 -0.71 -3.24 117.12 115.66 1iq8 n MET 243 Ca 0.03 -1.76 0.00 0.00 -1.81 0.00 0.00 57.70 54.16 1iq8 n MET 243 Cb 0.26 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.30 1iq8 n MET 243 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iq8 n GLY 244 N 1.32 1.17 3.73 3.03 0.00 -0.80 -4.87 105.19 108.77 1iq8 n GLY 244 Ca 0.15 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1iq8 n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iq8 s VAL 245 N -2.00 5.10 -0.04 1.61 1.01 -0.99 -4.56 120.40 120.53 1iq8 s VAL 245 Ca 0.00 1.15 0.15 0.00 0.00 0.00 0.00 61.98 63.28 1iq8 s VAL 245 Cb 0.00 -3.90 -0.22 0.00 0.00 0.00 0.00 36.38 32.26 1iq8 s VAL 245 CO 0.00 0.32 0.28 0.47 0.00 0.00 0.00 175.10 176.18 1iq8 n ASP 246 N 3.52 1.60 -4.13 3.32 8.00 0.19 -4.38 116.55 124.68 1iq8 n ASP 246 Ca -0.05 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.28 1iq8 n ASP 246 Cb 0.51 1.55 -0.12 0.00 -0.02 0.00 0.00 41.12 43.04 1iq8 n ASP 246 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1iq8 s LEU 247 N -4.19 2.26 0.08 0.64 1.43 -0.31 -1.50 118.68 117.10 1iq8 s LEU 247 Ca -0.06 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 52.46 1iq8 s LEU 247 Cb 0.09 -0.39 -0.04 0.00 0.03 0.00 0.00 46.19 45.87 1iq8 s LEU 247 CO 0.61 -0.11 -0.01 -0.36 0.23 0.00 0.00 176.35 176.71 1iq8 s PHE 248 N -1.27 0.68 -0.00 0.29 0.40 -0.49 -1.02 117.98 116.56 1iq8 s PHE 248 Ca -0.05 -1.10 -0.00 0.00 -0.60 0.00 0.00 56.93 55.18 1iq8 s PHE 248 Cb -0.10 -0.44 0.00 0.00 0.51 0.00 0.00 43.02 43.00 1iq8 s PHE 248 CO 0.02 -0.39 0.01 0.16 0.70 0.00 0.00 175.22 175.71 1iq8 s ASP 249 N -2.98 0.00 -0.08 1.36 1.47 -1.26 -0.17 116.67 115.02 1iq8 s ASP 249 Ca 0.13 0.01 0.01 0.00 1.18 0.00 0.00 52.55 53.88 1iq8 s ASP 249 Cb 0.08 0.00 0.02 0.00 -0.34 0.00 0.00 42.92 42.68 1iq8 s ASP 249 CO -0.06 -0.01 -0.09 -0.55 0.68 0.00 0.00 175.17 175.14 1iq8 s SER 250 N 0.10 1.83 -0.03 2.11 0.15 -0.57 -2.71 113.70 114.59 1iq8 s SER 250 Ca -0.01 -0.27 0.09 0.00 0.70 0.00 0.00 55.95 56.46 1iq8 s SER 250 Cb -0.01 -0.77 -0.14 0.00 -1.71 0.00 0.00 66.02 63.39 1iq8 s SER 250 CO -0.00 -0.05 0.17 0.00 1.20 0.00 0.00 173.24 174.56 1iq8 n ALA 251 N 4.38 2.24 -0.32 5.45 0.00 -1.26 -0.60 120.51 130.40 1iq8 n ALA 251 Ca -0.18 -0.28 0.01 0.00 0.00 0.00 0.00 53.44 52.99 1iq8 n ALA 251 Cb 0.51 -0.25 0.14 0.00 0.00 0.00 0.00 19.45 19.85 1iq8 n ALA 251 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1iq8 h SER 252 N 0.00 0.89 -1.01 0.00 0.02 -1.91 -1.35 113.55 110.20 1iq8 h SER 252 Ca -0.04 0.01 0.24 0.00 -0.84 0.00 0.00 61.79 61.16 1iq8 h SER 252 Cb 0.62 -0.18 -0.12 0.00 0.14 0.00 0.00 62.40 62.86 1iq8 h SER 252 CO 0.00 0.58 0.61 0.10 -1.14 0.00 0.00 176.83 176.98 1iq8 h TYR 253 N 1.03 0.97 0.10 3.45 -0.00 -1.82 0.44 116.97 121.16 1iq8 h TYR 253 Ca 0.38 0.03 -0.31 0.00 0.00 0.00 0.00 58.73 58.84 1iq8 h TYR 253 Cb 0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 36.73 36.57 1iq8 h TYR 253 CO -0.02 0.09 -1.63 0.00 -0.00 0.00 0.00 178.16 176.59 1iq8 h ALA 254 N 1.70 0.29 -0.75 0.10 0.00 -1.79 -3.23 119.26 115.58 1iq8 h ALA 254 Ca 0.63 -1.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1iq8 h ALA 254 Cb 1.22 0.61 -0.04 0.00 0.00 0.00 0.00 17.79 19.58 1iq8 h ALA 254 CO -0.44 1.00 0.37 -0.07 0.00 0.00 0.00 179.25 180.11 1iq8 h LEU 255 N -0.26 0.97 -0.44 0.00 3.38 -0.63 -1.91 115.31 116.41 1iq8 h LEU 255 Ca -0.36 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.45 1iq8 h LEU 255 Cb 1.81 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.29 1iq8 h LEU 255 CO 0.03 0.81 0.07 1.88 0.09 0.00 0.00 178.44 181.32 1iq8 h TYR 256 N 1.07 0.79 -1.01 1.13 0.99 -0.31 -2.99 116.97 116.64 1iq8 h TYR 256 Ca 0.26 -0.11 0.10 0.00 2.00 0.00 0.00 58.73 60.98 1iq8 h TYR 256 Cb 0.10 -0.21 -0.08 0.00 1.00 0.00 0.00 36.73 37.53 1iq8 h TYR 256 CO 0.01 0.75 0.64 0.00 -0.00 0.00 0.00 178.16 179.56 1iq8 h ALA 257 N 0.94 1.48 0.00 3.88 0.00 -1.45 0.18 119.26 124.28 1iq8 h ALA 257 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1iq8 h ALA 257 Cb 0.39 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1iq8 h ALA 257 CO 0.01 0.30 -0.11 0.87 0.00 0.00 0.00 179.25 180.33 1iq8 h LYS 258 N 1.06 0.00 -0.48 0.00 1.57 -1.22 -2.19 116.57 115.31 1iq8 h LYS 258 Ca 0.48 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 59.11 1iq8 h LYS 258 Cb 0.38 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.60 1iq8 h LYS 258 CO -0.23 0.11 0.10 -0.25 -0.57 0.00 0.00 179.45 178.60 1iq8 n ASP 259 N -3.45 3.80 -3.57 0.86 8.00 -0.07 -4.95 116.55 117.18 1iq8 n ASP 259 Ca -0.01 -3.33 -0.26 0.00 0.71 0.00 0.00 54.79 51.90 1iq8 n ASP 259 Cb 0.26 -0.65 0.04 0.00 -0.02 0.00 0.00 41.12 40.75 1iq8 n ASP 259 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1iq8 n ASP 260 N -0.60 -5.33 -4.69 -2.24 8.00 -0.82 -4.91 116.55 105.95 1iq8 n ASP 260 Ca 0.33 -0.56 -0.35 0.00 0.71 0.00 0.00 54.79 54.92 1iq8 n ASP 260 Cb 1.14 -4.27 -0.09 0.00 -0.02 0.00 0.00 41.12 37.88 1iq8 n ASP 260 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1iq8 s ARG 261 N -6.27 3.20 -0.21 -1.24 0.52 0.43 -1.21 118.95 114.17 1iq8 s ARG 261 Ca 0.53 -0.37 -0.03 0.00 -0.52 0.00 0.00 55.73 55.34 1iq8 s ARG 261 Cb -0.26 -2.90 -0.01 0.00 0.52 0.00 0.00 34.95 32.31 1iq8 s ARG 261 CO 0.66 0.63 -0.06 -0.47 0.02 0.00 0.00 175.30 176.08 1iq8 s TYR 262 N -0.67 2.93 0.38 -0.53 5.04 0.13 -3.82 117.35 120.81 1iq8 s TYR 262 Ca 0.11 -0.98 -0.18 0.00 -2.44 0.00 0.00 57.07 53.58 1iq8 s TYR 262 Cb -0.12 -2.07 -0.10 0.00 0.35 0.00 0.00 41.96 40.02 1iq8 s TYR 262 CO 0.02 -0.55 0.84 -1.64 -1.34 0.00 0.00 175.55 172.89 1iq8 s MET 263 N 1.38 4.11 0.04 4.97 -1.94 -1.26 -0.63 119.30 125.96 1iq8 s MET 263 Ca 0.05 0.89 -0.03 0.00 -1.71 0.00 0.00 55.69 54.89 1iq8 s MET 263 Cb -0.14 -2.31 -0.02 0.00 2.01 0.00 0.00 34.83 34.37 1iq8 s MET 263 CO -0.04 0.06 0.03 0.99 -0.01 0.00 0.00 175.02 176.05 1iq8 s THR 264 N -2.09 0.16 0.32 2.05 2.01 0.06 -4.89 115.64 113.26 1iq8 s THR 264 Ca 0.58 -1.29 0.38 0.00 0.31 0.00 0.00 61.69 61.67 1iq8 s THR 264 Cb -0.10 -0.96 0.40 0.00 0.01 0.00 0.00 72.50 71.85 1iq8 s THR 264 CO 0.16 -0.71 2.14 -0.65 -0.69 0.00 0.00 174.62 174.86 1iq8 h PRO 265 N 3.70 0.00 0.00 4.92 0.11 -1.93 -2.56 132.00 136.25 1iq8 h PRO 265 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1iq8 h PRO 265 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1iq8 h PRO 265 CO 0.53 0.00 -1.10 0.39 -0.21 0.00 0.00 178.00 177.62 1iq8 n GLU 266 N -3.00 0.15 0.00 1.05 4.71 -1.26 -3.84 120.64 118.44 1iq8 n GLU 266 Ca -0.01 -0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.11 1iq8 n GLU 266 Cb 0.18 -1.52 0.00 0.00 -1.01 0.00 0.00 31.44 29.09 1iq8 n GLU 266 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1iq8 n GLY 267 N 1.44 -0.55 2.98 0.62 0.00 -0.96 -4.70 105.19 104.01 1iq8 n GLY 267 Ca 0.03 -0.60 -0.17 0.00 0.00 0.00 0.00 46.02 45.28 1iq8 n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iq8 s THR 268 N -4.00 0.52 0.19 2.61 2.01 -1.26 -0.76 115.64 114.95 1iq8 s THR 268 Ca 0.00 -0.28 0.11 0.00 0.31 0.00 0.00 61.69 61.82 1iq8 s THR 268 Cb 0.00 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 1iq8 s THR 268 CO 0.00 0.15 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.32 1iq8 s LYS 269 N -0.15 1.45 -0.02 4.92 -0.14 0.20 -4.95 119.74 121.05 1iq8 s LYS 269 Ca 0.02 -1.50 -0.15 0.00 -1.36 0.00 0.00 55.97 52.99 1iq8 s LYS 269 Cb -0.03 -1.69 -0.06 0.00 -1.68 0.00 0.00 37.83 34.38 1iq8 s LYS 269 CO -0.00 0.36 0.40 1.03 -0.76 0.00 0.00 175.35 176.37 1iq8 s ARG 270 N -2.73 3.93 0.43 1.68 0.52 -1.26 0.20 118.95 121.71 1iq8 s ARG 270 Ca 0.19 0.38 0.11 0.00 -0.52 0.00 0.00 55.73 55.89 1iq8 s ARG 270 Cb -0.07 -3.24 0.97 0.00 0.52 0.00 0.00 34.95 33.14 1iq8 s ARG 270 CO 0.09 0.66 2.04 1.25 0.02 0.00 0.00 175.30 179.36 1iq8 h LEU 271 N 4.87 0.37 0.00 2.53 5.85 -1.52 -0.50 115.31 126.92 1iq8 h LEU 271 Ca -0.51 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1iq8 h LEU 271 Cb 1.22 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.16 1iq8 h LEU 271 CO 0.62 0.26 0.00 -0.90 -0.34 0.00 0.00 178.44 178.08 1iq8 n ASP 272 N -4.48 0.00 -0.65 1.25 5.75 -1.26 -2.67 116.55 114.49 1iq8 n ASP 272 Ca 0.05 0.46 0.06 0.00 -0.01 0.00 0.00 54.79 55.35 1iq8 n ASP 272 Cb 0.18 -0.48 0.16 0.00 -1.03 0.00 0.00 41.12 39.95 1iq8 n ASP 272 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1iq8 n GLU 273 N -1.48 2.88 -4.08 0.11 0.00 -0.21 -4.97 120.64 112.89 1iq8 n GLU 273 Ca 0.06 -2.16 -0.35 0.00 0.00 0.00 0.00 57.16 54.71 1iq8 n GLU 273 Cb 0.25 -1.35 -0.12 0.00 0.00 0.00 0.00 31.44 30.22 1iq8 n GLU 273 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1iq8 s LEU 274 N -1.30 3.40 -0.10 4.31 1.43 -1.09 -4.89 118.68 120.44 1iq8 s LEU 274 Ca 0.25 -0.13 0.17 0.00 -1.03 0.00 0.00 54.13 53.39 1iq8 s LEU 274 Cb 0.15 -1.86 -0.25 0.00 0.03 0.00 0.00 46.19 44.26 1iq8 s LEU 274 CO 0.14 0.09 0.22 0.47 0.23 0.00 0.00 176.35 177.50 1iq8 n ASP 275 N 4.06 0.79 -4.01 2.29 9.92 -1.26 -4.75 116.55 123.60 1iq8 n ASP 275 Ca -0.17 0.00 -0.10 0.00 -0.53 0.00 0.00 54.79 53.99 1iq8 n ASP 275 Cb 0.52 1.34 -0.11 0.00 -0.64 0.00 0.00 41.12 42.23 1iq8 n ASP 275 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1iq8 s TYR 276 N -2.81 0.37 -0.37 1.24 1.51 -1.26 -4.68 117.35 111.36 1iq8 s TYR 276 Ca -0.08 -0.56 -0.18 0.00 -1.01 0.00 0.00 57.07 55.25 1iq8 s TYR 276 Cb 0.08 -0.25 0.00 0.00 -0.11 0.00 0.00 41.96 41.68 1iq8 s TYR 276 CO 0.73 -0.18 0.49 -0.06 -1.11 0.00 0.00 175.55 175.43 1iq8 s PHE 277 N -1.59 3.17 -1.15 2.71 0.08 -1.26 -4.95 117.98 114.98 1iq8 s PHE 277 Ca -0.13 0.03 -0.08 0.00 0.12 0.00 0.00 56.93 56.87 1iq8 s PHE 277 Cb -0.09 -2.93 -0.09 0.00 -0.57 0.00 0.00 43.02 39.34 1iq8 s PHE 277 CO -0.01 -0.59 3.01 -0.35 -0.10 0.00 0.00 175.22 177.18 1iq8 n PRO 278 N 5.73 3.39 -3.45 0.24 -0.04 -1.26 -4.81 135.00 134.80 1iq8 n PRO 278 Ca -0.05 -2.14 -0.12 0.00 -0.04 0.00 0.00 63.50 61.14 1iq8 n PRO 278 Cb 0.49 -2.56 -0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1iq8 n PRO 278 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iq8 n SER 280 N -0.27 1.85 -4.53 0.00 7.64 -1.26 -4.52 113.62 112.52 1iq8 n SER 280 Ca -0.17 -2.15 -0.28 0.00 1.01 0.00 0.00 58.87 57.27 1iq8 n SER 280 Cb 0.64 -0.10 0.24 0.00 -1.01 0.00 0.00 64.21 63.98 1iq8 n SER 280 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1iq8 h PRO 282 N -2.47 0.00 0.00 0.00 0.11 -1.97 0.26 132.00 127.93 1iq8 h PRO 282 Ca -0.60 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.51 1iq8 h PRO 282 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1iq8 h PRO 282 CO 0.52 0.00 -0.35 0.28 -0.21 0.00 0.00 178.00 178.24 1iq8 h VAL 283 N 0.00 0.00 0.00 3.15 2.07 -1.93 -3.32 116.25 116.23 1iq8 h VAL 283 Ca 0.39 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1iq8 h VAL 283 Cb 1.99 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1iq8 h VAL 283 CO -0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 1iq8 h SER 285 N 0.00 0.00 0.00 0.00 0.87 -0.66 -3.37 113.55 110.39 1iq8 h SER 285 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1iq8 h SER 285 Cb 0.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1iq8 h SER 285 CO 0.00 0.66 -1.50 2.29 -0.53 0.00 0.00 176.83 177.75 1iq8 n LYS 286 N -3.13 0.69 -4.41 2.24 2.85 -0.63 -5.04 118.16 110.73 1iq8 n LYS 286 Ca -0.03 -0.11 -0.21 0.00 -1.05 0.00 0.00 58.31 56.91 1iq8 n LYS 286 Cb 0.83 -1.30 -0.10 0.00 -0.65 0.00 0.00 35.03 33.81 1iq8 n LYS 286 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1iq8 s TYR 287 N -2.86 1.88 0.32 5.58 1.51 -0.54 -5.11 117.35 118.13 1iq8 s TYR 287 Ca -0.04 -0.75 0.08 0.00 -1.01 0.00 0.00 57.07 55.36 1iq8 s TYR 287 Cb 0.09 -1.09 -0.04 0.00 -0.11 0.00 0.00 41.96 40.82 1iq8 s TYR 287 CO 0.57 0.22 0.16 -0.08 -1.11 0.00 0.00 175.55 175.31 1iq8 s THR 288 N -3.09 3.35 0.14 -0.71 -1.32 -1.26 -4.63 115.64 108.12 1iq8 s THR 288 Ca 0.29 -1.62 -0.24 0.00 -1.21 0.00 0.00 61.69 58.92 1iq8 s THR 288 Cb 0.04 -3.05 -0.01 0.00 -1.51 0.00 0.00 72.50 67.97 1iq8 s THR 288 CO 0.11 -0.22 1.64 -0.65 -2.21 0.00 0.00 174.62 173.29 1iq8 h PRO 289 N 1.52 -0.28 -0.61 7.08 0.11 -1.87 -1.55 132.00 136.39 1iq8 h PRO 289 Ca -0.44 0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.78 1iq8 h PRO 289 Cb 1.25 0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.39 1iq8 h PRO 289 CO 0.61 -0.19 0.41 -0.56 -0.21 0.00 0.00 178.00 178.07 1iq8 h GLN 290 N -0.29 0.42 0.00 1.05 -0.00 -1.90 0.26 115.11 114.65 1iq8 h GLN 290 Ca 0.10 -0.03 -0.08 0.00 -0.00 0.00 0.00 58.65 58.65 1iq8 h GLN 290 Cb 0.45 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.48 27.82 1iq8 h GLN 290 CO -0.31 0.28 -0.40 0.93 -0.00 0.00 0.00 178.83 179.33 1iq8 h GLU 291 N 0.44 0.00 -0.25 0.06 5.08 -1.72 -2.24 114.58 115.95 1iq8 h GLU 291 Ca 0.28 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.52 1iq8 h GLU 291 Cb 0.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1iq8 h GLU 291 CO -0.08 0.40 -0.33 1.25 -1.00 0.00 0.00 179.01 179.25 1iq8 h LEU 292 N 0.00 0.72 -0.65 1.33 7.12 0.36 -3.21 115.31 120.99 1iq8 h LEU 292 Ca -0.00 -0.50 -0.06 0.00 0.13 0.00 0.00 57.88 57.45 1iq8 h LEU 292 Cb 0.74 -0.21 -0.03 0.00 -0.53 0.00 0.00 40.66 40.64 1iq8 h LEU 292 CO 0.05 1.08 0.19 0.03 -0.13 0.00 0.00 178.44 179.66 1iq8 h ARG 293 N 0.39 1.02 -0.18 1.25 3.08 -1.10 -2.78 114.38 116.05 1iq8 h ARG 293 Ca 0.03 -0.23 0.05 0.00 0.07 0.00 0.00 59.98 59.91 1iq8 h ARG 293 Cb 0.91 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1iq8 h ARG 293 CO 0.08 0.90 0.20 0.93 -1.07 0.00 0.00 179.97 181.01 1iq8 h GLU 294 N 0.95 0.00 -7.25 0.04 3.07 -1.41 -3.44 114.58 106.53 1iq8 h GLU 294 Ca 0.21 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.57 1iq8 h GLU 294 Cb 0.31 0.00 0.08 0.00 -0.84 0.00 0.00 28.75 28.30 1iq8 h GLU 294 CO -0.00 0.00 0.37 -1.64 -1.40 0.00 0.00 179.01 176.34 1iq8 s MET 295 N -4.63 3.15 0.38 2.33 -1.94 -1.05 -5.01 119.30 112.53 1iq8 s MET 295 Ca -0.05 1.11 -0.27 0.00 -1.71 0.00 0.00 55.69 54.77 1iq8 s MET 295 Cb 0.15 -2.01 -0.09 0.00 2.01 0.00 0.00 34.83 34.89 1iq8 s MET 295 CO 0.55 -0.94 1.26 -2.14 -0.01 0.00 0.00 175.02 173.74 1iq8 s PRO 296 N -4.46 4.12 0.27 2.03 0.02 -1.26 -4.72 135.00 131.00 1iq8 s PRO 296 Ca 0.61 2.08 0.05 0.00 0.02 0.00 0.00 61.00 63.76 1iq8 s PRO 296 Cb -0.15 -2.84 0.75 0.00 0.02 0.00 0.00 34.50 32.28 1iq8 s PRO 296 CO 0.44 -0.34 1.33 1.17 -0.33 0.00 0.00 177.00 179.28 1iq8 n LYS 297 N 0.34 -0.06 -0.06 5.54 0.00 -1.26 -1.04 118.16 121.62 1iq8 n LYS 297 Ca 0.03 1.25 -0.11 0.00 0.00 0.00 0.00 58.31 59.48 1iq8 n LYS 297 Cb 0.44 -2.04 -0.04 0.00 0.00 0.00 0.00 35.03 33.38 1iq8 n LYS 297 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1iq8 h GLU 298 N 0.00 0.30 -0.40 1.64 4.81 -2.00 -0.65 114.58 118.28 1iq8 h GLU 298 Ca 0.56 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.66 1iq8 h GLU 298 Cb 1.24 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1iq8 h GLU 298 CO -0.77 0.37 -0.02 1.49 -0.73 0.00 0.00 179.01 179.34 1iq8 h GLU 299 N 0.17 0.72 -0.40 1.92 4.81 -1.45 -2.66 114.58 117.69 1iq8 h GLU 299 Ca 0.07 -0.24 0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1iq8 h GLU 299 Cb 0.18 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1iq8 h GLU 299 CO -0.01 0.82 0.13 -0.09 -0.73 0.00 0.00 179.01 179.14 1iq8 h ARG 300 N 0.55 0.28 -0.35 1.92 2.43 -1.10 -1.63 114.38 116.47 1iq8 h ARG 300 Ca 0.11 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1iq8 h ARG 300 Cb 0.51 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1iq8 h ARG 300 CO 0.02 0.18 0.23 1.15 -1.51 0.00 0.00 179.97 180.05 1iq8 h THR 301 N 0.29 1.10 -0.12 0.20 2.02 -1.06 -0.89 112.91 114.44 1iq8 h THR 301 Ca 0.19 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1iq8 h THR 301 Cb 0.18 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1iq8 h THR 301 CO -0.20 0.09 -0.07 0.03 0.37 0.00 0.00 175.52 175.74 1iq8 h ARG 302 N 0.48 -0.07 -0.74 6.66 2.47 -1.09 0.96 114.38 123.05 1iq8 h ARG 302 Ca 0.13 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.79 1iq8 h ARG 302 Cb -0.04 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.26 1iq8 h ARG 302 CO -0.03 -0.05 0.22 -0.07 0.56 0.00 0.00 179.97 180.61 1iq8 h LEU 303 N -0.07 1.08 -0.88 3.04 3.38 -1.14 -1.19 115.31 119.53 1iq8 h LEU 303 Ca 0.07 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1iq8 h LEU 303 Cb 0.18 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1iq8 h LEU 303 CO -0.16 1.01 0.00 -0.07 0.09 0.00 0.00 178.44 179.31 1iq8 h LEU 304 N 1.11 0.80 -0.33 1.67 3.38 -0.81 -0.88 115.31 120.24 1iq8 h LEU 304 Ca 0.24 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1iq8 h LEU 304 Cb 0.32 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1iq8 h LEU 304 CO -0.01 0.86 0.16 0.00 0.09 0.00 0.00 178.44 179.54 1iq8 h ALA 305 N 1.23 0.43 -0.54 1.53 0.00 -0.31 -0.23 119.26 121.37 1iq8 h ALA 305 Ca 0.15 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1iq8 h ALA 305 Cb 0.46 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1iq8 h ALA 305 CO 0.02 -0.00 0.27 -0.07 0.00 0.00 0.00 179.25 179.47 1iq8 h LEU 306 N 0.40 0.70 -0.09 0.00 3.38 -1.00 -0.52 115.31 118.17 1iq8 h LEU 306 Ca 0.11 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1iq8 h LEU 306 Cb 0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1iq8 h LEU 306 CO -0.01 0.62 -0.03 -0.74 0.09 0.00 0.00 178.44 178.37 1iq8 h HIS 307 N 0.72 -0.07 -0.97 1.13 2.76 -0.85 0.70 115.15 118.57 1iq8 h HIS 307 Ca 0.19 0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.45 1iq8 h HIS 307 Cb 0.10 0.04 -0.07 0.00 1.55 0.00 0.00 27.41 29.03 1iq8 h HIS 307 CO -0.01 -0.05 0.61 -0.91 -1.30 0.00 0.00 177.93 176.28 1iq8 h ASN 308 N -0.01 0.94 -0.34 3.26 2.35 -0.69 -0.38 115.58 120.71 1iq8 h ASN 308 Ca 0.05 0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1iq8 h ASN 308 Cb 0.08 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1iq8 h ASN 308 CO -0.10 0.56 -0.14 -0.07 -1.65 0.00 0.00 177.43 176.02 1iq8 h LEU 309 N 1.05 0.79 -0.53 1.61 3.38 -0.38 -1.64 115.31 119.58 1iq8 h LEU 309 Ca 0.45 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 1iq8 h LEU 309 Cb 0.31 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1iq8 h LEU 309 CO -0.22 0.94 -0.05 -0.50 0.09 0.00 0.00 178.44 178.71 1iq8 h TRP 310 N 0.71 1.08 -0.61 1.13 4.06 0.44 0.09 115.95 122.85 1iq8 h TRP 310 Ca 0.11 -0.20 -0.09 0.00 2.06 0.00 0.00 58.89 60.77 1iq8 h TRP 310 Cb 0.64 -0.27 -0.02 0.00 -1.00 0.00 0.00 29.16 28.50 1iq8 h TRP 310 CO 0.03 0.99 0.02 0.28 -3.56 0.00 0.00 178.44 176.21 1iq8 h VAL 311 N 0.85 1.26 -0.01 1.49 2.07 -1.00 0.54 116.25 121.44 1iq8 h VAL 311 Ca 0.15 -1.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 1iq8 h VAL 311 Cb 0.59 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1iq8 h VAL 311 CO 0.04 0.41 0.01 0.40 0.02 0.00 0.00 177.57 178.44 1iq8 h ILE 312 N 0.96 1.05 -0.91 4.57 2.04 -1.09 -0.04 117.51 124.09 1iq8 h ILE 312 Ca 0.18 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1iq8 h ILE 312 Cb 0.52 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.70 1iq8 h ILE 312 CO 0.03 0.04 0.54 0.50 0.00 0.00 0.00 178.15 179.26 1iq8 h LYS 313 N -0.05 1.23 -0.18 2.37 3.64 -0.74 -2.04 116.57 120.80 1iq8 h LYS 313 Ca 0.00 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1iq8 h LYS 313 Cb 0.06 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1iq8 h LYS 313 CO -0.00 0.87 -0.01 1.49 -2.27 0.00 0.00 179.45 179.52 1iq8 h GLU 314 N 1.25 0.34 -0.93 1.90 4.81 -0.64 -2.40 114.58 118.91 1iq8 h GLU 314 Ca 0.32 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1iq8 h GLU 314 Cb -0.04 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.26 1iq8 h GLU 314 CO -0.06 0.56 0.62 0.93 -0.73 0.00 0.00 179.01 180.33 1iq8 h GLU 315 N 0.07 1.21 -0.72 1.92 4.39 -0.76 0.82 114.58 121.51 1iq8 h GLU 315 Ca 0.05 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 1iq8 h GLU 315 Cb 0.42 -0.27 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1iq8 h GLU 315 CO 0.01 0.80 0.22 0.82 -1.16 0.00 0.00 179.01 179.70 1iq8 h ILE 316 N 1.25 1.26 -0.21 3.13 1.08 -1.31 0.74 117.51 123.45 1iq8 h ILE 316 Ca 0.35 -0.91 -0.11 0.00 -0.39 0.00 0.00 64.86 63.80 1iq8 h ILE 316 Cb -0.12 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 34.10 1iq8 h ILE 316 CO -0.08 0.35 -0.33 0.11 -0.69 0.00 0.00 178.15 177.51 1iq8 h LYS 317 N 1.06 0.43 -0.49 2.37 1.79 -0.83 -1.23 116.57 119.68 1iq8 h LYS 317 Ca 0.23 -0.19 -0.10 0.00 -2.18 0.00 0.00 60.65 58.41 1iq8 h LYS 317 Cb 0.31 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 1iq8 h LYS 317 CO -0.01 0.72 -0.10 -0.09 -1.08 0.00 0.00 179.45 178.89 1iq8 h ARG 318 N 0.37 0.93 -0.25 3.15 2.43 -0.25 0.63 114.38 121.38 1iq8 h ARG 318 Ca 0.04 -0.35 -0.03 0.00 -0.81 0.00 0.00 59.98 58.84 1iq8 h ARG 318 Cb 0.77 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 1iq8 h ARG 318 CO 0.06 1.00 0.05 0.28 -1.51 0.00 0.00 179.97 179.86 1iq8 h VAL 319 N 0.78 1.22 -0.62 0.20 2.07 -0.64 -1.40 116.25 117.86 1iq8 h VAL 319 Ca 0.12 -0.73 -0.09 0.00 0.82 0.00 0.00 66.70 66.83 1iq8 h VAL 319 Cb 0.65 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1iq8 h VAL 319 CO 0.05 0.23 0.04 0.11 0.02 0.00 0.00 177.57 178.02 1iq8 h LYS 320 N 0.23 1.06 -0.38 1.57 1.57 -1.10 -1.11 116.57 118.42 1iq8 h LYS 320 Ca 0.08 -0.31 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 1iq8 h LYS 320 Cb 0.30 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1iq8 h LYS 320 CO 0.00 1.01 0.01 0.37 -0.57 0.00 0.00 179.45 180.27 1iq8 h GLN 321 N 0.98 0.59 -0.42 3.15 5.75 -0.78 -1.00 115.11 123.37 1iq8 h GLN 321 Ca 0.18 -0.13 -0.15 0.00 -0.15 0.00 0.00 58.65 58.40 1iq8 h GLN 321 Cb 0.51 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.97 1iq8 h GLN 321 CO 0.02 0.61 -0.32 0.00 -2.65 0.00 0.00 178.83 176.49 1iq8 h ALA 322 N 1.45 0.63 -0.31 3.38 0.00 -0.76 -2.19 119.26 121.46 1iq8 h ALA 322 Ca 0.12 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1iq8 h ALA 322 Cb 0.35 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1iq8 h ALA 322 CO 0.01 0.68 0.20 0.82 0.00 0.00 0.00 179.25 180.96 1iq8 h ILE 323 N 0.80 1.09 -0.94 0.00 2.04 -0.78 0.12 117.51 119.83 1iq8 h ILE 323 Ca 0.08 -0.19 0.08 0.00 1.00 0.00 0.00 64.86 65.83 1iq8 h ILE 323 Cb 0.91 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.58 1iq8 h ILE 323 CO 0.08 0.09 0.61 0.50 0.00 0.00 0.00 178.15 179.43 1iq8 h LYS 324 N 0.41 0.99 -0.07 2.37 1.63 -1.02 -0.92 116.57 119.96 1iq8 h LYS 324 Ca 0.11 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1iq8 h LYS 324 Cb -0.02 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.38 1iq8 h LYS 324 CO -0.02 0.66 0.00 -0.85 -3.45 0.00 0.00 179.45 175.78 1iq8 n GLU 325 N -4.52 1.72 -2.75 1.90 0.28 -0.84 -4.93 120.64 111.50 1iq8 n GLU 325 Ca 0.15 -1.06 -0.10 0.00 -0.16 0.00 0.00 57.16 55.99 1iq8 n GLU 325 Cb 0.25 -1.45 0.02 0.00 1.43 0.00 0.00 31.44 31.70 1iq8 n GLU 325 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1iq8 n GLY 326 N 1.17 0.21 1.67 -1.84 0.00 -0.35 -3.91 105.19 102.14 1iq8 n GLY 326 Ca 0.18 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.83 1iq8 n GLY 326 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1iq8 n GLU 327 N -2.31 1.72 -0.17 1.61 -0.58 0.29 -4.66 120.64 116.53 1iq8 n GLU 327 Ca -0.03 -3.23 -0.09 0.00 -0.42 0.00 0.00 57.16 53.39 1iq8 n GLU 327 Cb 0.54 -1.37 0.01 0.00 -0.57 0.00 0.00 31.44 30.05 1iq8 n GLU 327 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1iq8 h LEU 328 N 1.65 0.72 -1.73 -4.62 6.46 -1.89 -2.61 115.31 113.28 1iq8 h LEU 328 Ca 0.00 -0.21 0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1iq8 h LEU 328 Cb 1.42 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 1iq8 h LEU 328 CO 0.25 0.74 0.20 -0.50 -0.62 0.00 0.00 178.44 178.51 1iq8 h TRP 329 N 0.66 0.34 -0.29 1.25 -0.00 -1.93 0.59 115.95 116.57 1iq8 h TRP 329 Ca 0.16 0.01 -0.08 0.00 -0.00 0.00 0.00 58.89 58.98 1iq8 h TRP 329 Cb 0.28 -0.12 -0.01 0.00 -0.00 0.00 0.00 29.16 29.32 1iq8 h TRP 329 CO 0.02 0.21 -0.13 -0.09 -0.00 0.00 0.00 178.44 178.45 1iq8 h ARG 330 N 0.37 0.60 -0.70 0.49 2.43 -1.85 -0.55 114.38 115.17 1iq8 h ARG 330 Ca 0.11 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 58.96 1iq8 h ARG 330 Cb 0.00 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 1iq8 h ARG 330 CO -0.02 0.83 0.21 1.25 -1.51 0.00 0.00 179.97 180.72 1iq8 h LEU 331 N 0.35 1.04 -0.58 3.80 5.85 -1.04 -0.98 115.31 123.75 1iq8 h LEU 331 Ca 0.07 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 1iq8 h LEU 331 Cb 0.64 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1iq8 h LEU 331 CO 0.04 0.98 0.34 0.58 -0.34 0.00 0.00 178.44 180.04 1iq8 h VAL 332 N 1.04 1.18 -0.85 1.05 2.07 -0.74 0.02 116.25 120.02 1iq8 h VAL 332 Ca 0.23 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1iq8 h VAL 332 Cb 0.32 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1iq8 h VAL 332 CO -0.00 0.19 0.41 -0.78 0.02 0.00 0.00 177.57 177.41 1iq8 h ASP 333 N 0.79 1.11 -0.38 0.57 1.82 -0.75 -0.01 116.42 119.57 1iq8 h ASP 333 Ca 0.21 -0.13 -0.06 0.00 -0.39 0.00 0.00 57.03 56.66 1iq8 h ASP 333 Cb 0.01 -0.29 -0.01 0.00 0.68 0.00 0.00 39.33 39.72 1iq8 h ASP 333 CO -0.04 0.93 0.02 -0.08 -1.61 0.00 0.00 179.24 178.47 1iq8 h GLU 334 N 1.21 0.65 0.00 0.28 4.81 -0.74 -3.11 114.58 117.69 1iq8 h GLU 334 Ca 0.29 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 1iq8 h GLU 334 Cb 0.11 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1iq8 h GLU 334 CO -0.04 0.74 -0.38 0.00 -0.73 0.00 0.00 179.01 178.60 1iq8 h ARG 335 N 0.48 0.00 0.00 1.92 2.47 -0.49 -2.89 114.38 115.86 1iq8 h ARG 335 Ca 0.11 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 1iq8 h ARG 335 Cb 0.43 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.75 1iq8 h ARG 335 CO 0.02 0.38 0.00 0.00 0.56 0.00 0.00 179.97 180.93 1iq8 h ALA 336 N 1.62 1.00 -0.02 0.04 0.00 -0.93 -0.90 119.26 120.07 1iq8 h ALA 336 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1iq8 h ALA 336 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1iq8 h ALA 336 CO 0.05 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.84 1iq8 n ARG 337 N -2.32 1.34 0.16 0.00 5.12 -1.09 -2.64 116.66 117.23 1iq8 n ARG 337 Ca -0.01 -0.49 0.02 0.00 -1.93 0.00 0.00 57.85 55.44 1iq8 n ARG 337 Cb 0.09 -1.47 0.26 0.00 -1.16 0.00 0.00 32.46 30.19 1iq8 n ARG 337 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1iq8 h SER 338 N 1.16 0.00 -3.95 0.55 0.02 -1.35 -3.46 113.55 106.52 1iq8 h SER 338 Ca 0.00 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1iq8 h SER 338 Cb 0.25 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 62.56 1iq8 h SER 338 CO 0.00 0.49 0.36 -2.28 -1.14 0.00 0.00 176.83 174.26 1iq8 s HIS 339 N -3.68 -0.54 0.28 3.45 5.65 -1.25 -4.89 115.29 114.31 1iq8 s HIS 339 Ca -0.01 1.17 0.03 0.00 0.25 0.00 0.00 55.06 56.49 1iq8 s HIS 339 Cb 0.12 0.38 0.64 0.00 -1.18 0.00 0.00 32.58 32.54 1iq8 s HIS 339 CO 0.73 -0.36 1.77 -1.35 -0.65 0.00 0.00 174.74 174.87 1iq8 h PRO 340 N 3.69 0.68 -0.28 2.88 0.11 -1.89 -0.08 132.00 137.11 1iq8 h PRO 340 Ca -0.25 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.72 1iq8 h PRO 340 Cb 1.16 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1iq8 h PRO 340 CO 0.20 0.45 -0.22 0.87 -0.21 0.00 0.00 178.00 179.10 1iq8 h LYS 341 N 0.70 0.53 -0.12 1.05 6.56 -1.93 0.59 116.57 123.96 1iq8 h LYS 341 Ca 0.53 -0.19 -0.23 0.00 -1.06 0.00 0.00 60.65 59.69 1iq8 h LYS 341 Cb 0.78 -0.04 0.01 0.00 -0.57 0.00 0.00 32.23 32.42 1iq8 h LYS 341 CO -0.38 0.72 -0.84 1.25 -2.06 0.00 0.00 179.45 178.14 1iq8 h LEU 342 N 0.47 0.94 -0.62 2.94 6.46 -1.44 -0.90 115.31 123.17 1iq8 h LEU 342 Ca 0.07 -0.65 0.01 0.00 -0.12 0.00 0.00 57.88 57.20 1iq8 h LEU 342 Cb 0.64 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 40.26 1iq8 h LEU 342 CO 0.05 1.45 0.41 0.22 -0.62 0.00 0.00 178.44 179.95 1iq8 h TYR 343 N 0.51 0.78 -0.12 1.25 3.20 -0.83 0.11 116.97 121.87 1iq8 h TYR 343 Ca -0.07 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.84 1iq8 h TYR 343 Cb 1.48 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.47 1iq8 h TYR 343 CO 0.09 0.49 0.00 1.03 -1.64 0.00 0.00 178.16 178.13 1iq8 h SER 344 N 0.84 -0.04 -0.20 -2.11 0.87 -0.71 -1.75 113.55 110.44 1iq8 h SER 344 Ca 0.23 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1iq8 h SER 344 Cb -0.09 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 1iq8 h SER 344 CO -0.05 -0.00 0.09 0.00 -0.53 0.00 0.00 176.83 176.34 1iq8 h ALA 345 N 1.10 1.69 -0.45 6.23 0.00 -0.55 -1.44 119.26 125.84 1iq8 h ALA 345 Ca 0.05 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1iq8 h ALA 345 Cb 0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1iq8 h ALA 345 CO -0.09 0.25 -0.13 -0.92 0.00 0.00 0.00 179.25 178.36 1iq8 h TYR 346 N 0.35 1.00 -0.21 0.00 3.20 -0.28 -0.37 116.97 120.67 1iq8 h TYR 346 Ca 0.09 -0.22 -0.11 0.00 3.14 0.00 0.00 58.73 61.63 1iq8 h TYR 346 Cb 0.09 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 1iq8 h TYR 346 CO 0.00 0.99 -0.35 0.87 -1.64 0.00 0.00 178.16 178.03 1iq8 h LYS 347 N 0.72 0.44 -0.39 1.82 1.57 -0.67 -2.61 116.57 117.45 1iq8 h LYS 347 Ca 0.11 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.58 1iq8 h LYS 347 Cb 0.68 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1iq8 h LYS 347 CO 0.05 0.73 -0.22 -0.09 -0.57 0.00 0.00 179.45 179.35 1iq8 h ARG 348 N 0.37 0.85 -0.73 3.15 9.65 -1.06 -3.01 114.38 123.60 1iq8 h ARG 348 Ca 0.04 -0.38 0.04 0.00 -1.10 0.00 0.00 59.98 58.58 1iq8 h ARG 348 Cb 0.79 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.30 1iq8 h ARG 348 CO 0.06 1.02 0.44 1.25 2.80 0.00 0.00 179.97 185.55 1iq8 h LEU 349 N 0.66 0.71 -2.14 3.80 5.85 -0.85 -1.42 115.31 121.92 1iq8 h LEU 349 Ca 0.08 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1iq8 h LEU 349 Cb 0.79 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 1iq8 h LEU 349 CO 0.06 0.48 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.56 1iq8 h LEU 350 N 0.85 0.00 -0.68 2.25 3.38 -1.35 -1.14 115.31 118.62 1iq8 h LEU 350 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1iq8 h LEU 350 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1iq8 h LEU 350 CO -0.13 0.01 0.00 -0.33 0.09 0.00 0.00 178.44 178.08 1iq8 h GLU 351 N 0.00 0.00 -1.95 1.13 5.08 -1.13 -3.21 114.58 114.50 1iq8 h GLU 351 Ca -0.00 0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 57.96 1iq8 h GLU 351 Cb 0.29 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.39 1iq8 h GLU 351 CO 0.00 0.00 0.20 0.72 -1.00 0.00 0.00 179.01 178.93 1iq8 n HIS 352 N -2.81 1.17 -0.22 4.33 8.25 -0.43 -4.68 115.22 120.83 1iq8 n HIS 352 Ca 0.03 -1.82 0.02 0.00 -0.26 0.00 0.00 57.72 55.69 1iq8 n HIS 352 Cb 0.38 -1.37 0.13 0.00 1.12 0.00 0.00 29.99 30.25 1iq8 n HIS 352 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1iq8 h TYR 353 N 2.80 0.40 -0.42 4.41 3.20 -1.76 -2.55 116.97 123.04 1iq8 h TYR 353 Ca 0.33 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.29 1iq8 h TYR 353 Cb 0.93 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 39.07 1iq8 h TYR 353 CO 1.45 0.06 0.11 1.15 -1.64 0.00 0.00 178.16 179.29 1iq8 h THR 354 N 0.39 0.81 0.26 1.81 2.02 -1.93 0.27 112.91 116.55 1iq8 h THR 354 Ca 0.35 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.42 1iq8 h THR 354 Cb 0.48 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1iq8 h THR 354 CO -0.36 0.05 -0.12 0.15 0.37 0.00 0.00 175.52 175.60 1iq8 h PHE 355 N 0.26 -0.32 -0.62 3.16 3.57 -1.91 -3.11 116.94 117.96 1iq8 h PHE 355 Ca 0.20 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 1iq8 h PHE 355 Cb 0.23 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1iq8 h PHE 355 CO -0.18 -0.03 0.38 -0.07 -2.23 0.00 0.00 178.31 176.17 1iq8 h LEU 356 N -0.60 0.62 -2.01 0.59 3.38 -1.25 -2.73 115.31 113.30 1iq8 h LEU 356 Ca -0.04 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1iq8 h LEU 356 Cb 0.44 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1iq8 h LEU 356 CO 0.06 0.43 0.02 -0.08 0.09 0.00 0.00 178.44 178.95 1iq8 h GLU 357 N 0.74 0.00 0.00 1.13 4.22 -0.51 -2.24 114.58 117.93 1iq8 h GLU 357 Ca 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.67 1iq8 h GLU 357 Cb 0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1iq8 h GLU 357 CO -0.11 0.00 -0.08 1.49 -2.18 0.00 0.00 179.01 178.13 1iq8 h GLU 358 N 0.00 0.00 -0.01 1.92 4.81 -1.41 -3.06 114.58 116.83 1iq8 h GLU 358 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1iq8 h GLU 358 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1iq8 h GLU 358 CO -0.00 0.08 -0.21 1.19 -0.73 0.00 0.00 179.01 179.34 1iq8 n PHE 359 N -3.86 0.00 -2.05 0.92 3.01 -0.88 -4.81 117.46 109.78 1iq8 n PHE 359 Ca -0.02 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.01 1iq8 n PHE 359 Cb 0.18 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.62 1iq8 n PHE 359 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1iq8 s GLU 360 N -1.32 4.05 0.73 -1.08 2.56 -0.98 -4.55 118.70 118.11 1iq8 s GLU 360 Ca 0.07 2.00 -0.16 0.00 0.00 0.00 0.00 54.97 56.88 1iq8 s GLU 360 Cb 0.07 -3.99 -0.02 0.00 2.00 0.00 0.00 34.13 32.18 1iq8 s GLU 360 CO 0.24 -0.99 0.65 -2.30 -0.56 0.00 0.00 175.26 172.29 1iq8 n PRO 361 N 7.28 0.33 0.22 4.30 -0.02 -1.26 -4.55 135.00 141.30 1iq8 n PRO 361 Ca 0.18 0.16 0.12 0.00 -2.02 0.00 0.00 63.50 61.93 1iq8 n PRO 361 Cb 0.44 -1.94 0.29 0.00 -0.02 0.00 0.00 33.50 32.27 1iq8 n PRO 361 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1iq8 h ILE 362 N -0.39 0.17 -3.08 4.25 6.09 -1.44 -3.46 117.51 119.65 1iq8 h ILE 362 Ca -0.46 -1.08 -0.10 0.00 -1.37 0.00 0.00 64.86 61.85 1iq8 h ILE 362 Cb 1.34 1.94 -0.18 0.00 0.47 0.00 0.00 36.82 40.39 1iq8 h ILE 362 CO 0.43 0.09 -0.21 0.28 -3.07 0.00 0.00 178.15 175.67 1iq8 s THR 363 N -3.31 0.06 0.08 2.19 -1.32 -1.26 -4.97 115.64 107.11 1iq8 s THR 363 Ca 0.05 -0.53 0.01 0.00 -1.21 0.00 0.00 61.69 60.01 1iq8 s THR 363 Cb 0.07 -0.81 -0.04 0.00 -1.51 0.00 0.00 72.50 70.20 1iq8 s THR 363 CO 0.65 -0.29 -0.06 -0.54 -2.21 0.00 0.00 174.62 172.17 1iq8 s LYS 364 N -1.98 0.76 0.13 7.08 1.02 -1.26 -5.03 119.74 120.45 1iq8 s LYS 364 Ca -0.09 -1.27 -0.01 0.00 0.02 0.00 0.00 55.97 54.62 1iq8 s LYS 364 Cb -0.03 -0.11 -0.12 0.00 -0.52 0.00 0.00 37.83 37.06 1iq8 s LYS 364 CO 0.01 -0.04 1.28 1.57 -0.92 0.00 0.00 175.35 177.25 1iq8 h LYS 365 N 3.11 0.27 -6.99 1.68 2.10 -1.92 -3.45 116.57 111.37 1iq8 h LYS 365 Ca -0.35 -0.34 -0.46 0.00 -2.00 0.00 0.00 60.65 57.49 1iq8 h LYS 365 Cb 1.16 0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1iq8 h LYS 365 CO 0.63 1.08 0.37 0.45 -2.00 0.00 0.00 179.45 179.98 1iq8 s SER 366 N -7.03 6.90 0.48 7.07 0.15 -1.25 -5.05 113.70 114.97 1iq8 s SER 366 Ca -0.04 1.86 -0.13 0.00 0.70 0.00 0.00 55.95 58.35 1iq8 s SER 366 Cb 0.09 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.77 1iq8 s SER 366 CO 0.86 -0.39 0.89 0.00 1.20 0.00 0.00 173.24 175.80 1iq8 s ALA 367 N -1.86 3.20 -0.29 5.45 0.00 -1.26 -5.01 121.76 122.00 1iq8 s ALA 367 Ca 0.59 -0.05 -0.29 0.00 0.00 0.00 0.00 51.96 52.21 1iq8 s ALA 367 Cb -0.16 -2.92 0.01 0.00 0.00 0.00 0.00 23.12 20.05 1iq8 s ALA 367 CO 0.21 -0.21 1.15 -1.17 0.00 0.00 0.00 175.76 175.73 1iq8 s LEU 368 N -4.16 3.96 -0.14 0.00 0.20 -1.26 -4.95 118.68 112.33 1iq8 s LEU 368 Ca 0.55 1.19 -0.02 0.00 0.69 0.00 0.00 54.13 56.53 1iq8 s LEU 368 Cb -0.10 -3.54 -0.02 0.00 -0.43 0.00 0.00 46.19 42.09 1iq8 s LEU 368 CO 0.35 -0.89 -0.07 -0.36 -0.29 0.00 0.00 176.35 175.09 1iq8 s PHE 369 N 3.76 2.95 -0.52 5.38 2.99 -1.26 -0.39 117.98 130.89 1iq8 s PHE 369 Ca 0.49 -0.41 -0.20 0.00 0.00 0.00 0.00 56.93 56.81 1iq8 s PHE 369 Cb -0.15 -1.91 0.05 0.00 0.00 0.00 0.00 43.02 41.02 1iq8 s PHE 369 CO 0.16 -0.08 0.72 0.21 -0.00 0.00 0.00 175.22 176.22 1iq8 s LYS 370 N 0.32 3.18 -0.07 0.44 2.20 -0.69 -4.84 119.74 120.28 1iq8 s LYS 370 Ca -0.06 -0.73 0.10 0.00 -0.36 0.00 0.00 55.97 54.92 1iq8 s LYS 370 Cb -0.15 -4.09 0.17 0.00 -1.51 0.00 0.00 37.83 32.25 1iq8 s LYS 370 CO 0.04 -1.30 1.10 0.44 -0.36 0.00 0.00 175.35 175.26 1iq8 n ILE 371 N 5.77 1.47 0.00 5.43 -6.64 -1.26 -4.67 119.36 119.46 1iq8 n ILE 371 Ca -0.04 -1.64 0.00 0.00 -1.77 0.00 0.00 62.75 59.30 1iq8 n ILE 371 Cb 0.46 0.12 0.00 0.00 -1.44 0.00 0.00 39.64 38.78 1iq8 n ILE 371 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 1iq8 n SER 372 N -0.91 0.00 0.12 7.28 3.41 -1.26 -4.97 113.62 117.29 1iq8 n SER 372 Ca 0.09 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.67 1iq8 n SER 372 Cb 0.47 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.54 1iq8 n SER 372 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1iq8 h ASN 373 N 0.00 0.07 -0.11 4.04 4.21 -2.02 -3.02 115.58 118.75 1iq8 h ASN 373 Ca 0.00 -0.04 -0.05 0.00 1.21 0.00 0.00 56.30 57.41 1iq8 h ASN 373 Cb 0.00 -0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 1iq8 h ASN 373 CO 0.00 0.71 -0.07 -0.33 -1.29 0.00 0.00 177.43 176.45 1iq8 h GLU 374 N 0.04 0.40 0.00 0.81 3.07 -2.00 -2.25 114.58 114.66 1iq8 h GLU 374 Ca -0.01 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 58.75 1iq8 h GLU 374 Cb 1.18 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.04 1iq8 h GLU 374 CO 0.09 0.49 -0.03 0.66 -1.40 0.00 0.00 179.01 178.82 1iq8 h SER 375 N 0.38 0.00 0.81 1.42 4.64 -1.90 0.28 113.55 119.18 1iq8 h SER 375 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1iq8 h SER 375 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1iq8 h SER 375 CO 0.02 0.03 0.00 0.18 -0.87 0.00 0.00 176.83 176.19 1iq8 n LEU 376 N -3.32 0.69 -0.83 5.97 4.77 -0.85 -2.42 117.00 121.02 1iq8 n LEU 376 Ca -0.02 0.66 0.07 0.00 -0.03 0.00 0.00 56.01 56.69 1iq8 n LEU 376 Cb 0.16 -0.55 0.21 0.00 -2.33 0.00 0.00 43.42 40.91 1iq8 n LEU 376 CO 0.25 -0.52 0.68 0.54 -1.33 0.00 0.00 177.39 177.00 1iq8 n ARG 377 N -2.25 2.97 -2.05 3.23 1.74 0.08 -4.61 116.66 115.79 1iq8 n ARG 377 Ca 0.02 -2.38 -0.38 0.00 -0.77 0.00 0.00 57.85 54.35 1iq8 n ARG 377 Cb 0.25 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.20 1iq8 n ARG 377 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1iq8 s TRP 378 N -1.60 2.61 0.24 -1.55 0.51 -1.02 -4.74 118.94 113.40 1iq8 s TRP 378 Ca 0.32 1.46 -0.15 0.00 -2.12 0.00 0.00 56.10 55.61 1iq8 s TRP 378 Cb 0.21 -3.57 0.28 0.00 -0.81 0.00 0.00 33.47 29.58 1iq8 s TRP 378 CO 0.15 -2.13 1.53 -2.30 -0.51 0.00 0.00 176.95 173.70 1iq8 n PRO 379 N -0.72 -0.20 0.13 4.98 -0.02 -1.26 -0.48 135.00 137.44 1iq8 n PRO 379 Ca 0.09 1.52 0.12 0.00 -2.02 0.00 0.00 63.50 63.21 1iq8 n PRO 379 Cb 0.47 -2.26 0.63 0.00 -0.02 0.00 0.00 33.50 32.32 1iq8 n PRO 379 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1iq8 h VAL 380 N 0.00 0.91 0.01 -1.45 2.07 -1.95 -0.21 116.25 115.62 1iq8 h VAL 380 Ca 0.37 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.81 1iq8 h VAL 380 Cb 0.62 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1iq8 h VAL 380 CO -0.99 0.01 -0.21 0.58 0.02 0.00 0.00 177.57 176.98 1iq8 h VAL 381 N 0.06 1.58 -0.44 2.57 2.07 -1.11 -2.19 116.25 118.80 1iq8 h VAL 381 Ca 0.11 -1.99 0.03 0.00 0.82 0.00 0.00 66.70 65.67 1iq8 h VAL 381 Cb 0.37 2.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.97 1iq8 h VAL 381 CO -0.01 0.54 0.25 0.03 0.02 0.00 0.00 177.57 178.40 1iq8 h ARG 382 N -0.58 0.48 0.61 1.57 2.47 -0.96 -1.41 114.38 116.56 1iq8 h ARG 382 Ca -0.03 -0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.63 1iq8 h ARG 382 Cb 1.00 -0.11 0.01 0.00 -1.65 0.00 0.00 29.97 29.22 1iq8 h ARG 382 CO 0.04 0.32 -0.29 -0.09 0.56 0.00 0.00 179.97 180.51 1iq8 h ARG 383 N 0.50 -0.78 -0.42 0.04 2.43 -1.12 -1.18 114.38 113.84 1iq8 h ARG 383 Ca 0.18 0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.47 1iq8 h ARG 383 Cb 0.04 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1iq8 h ARG 383 CO -0.10 -0.50 0.29 0.00 -1.51 0.00 0.00 179.97 178.15 1iq8 h ALA 384 N -0.50 2.02 -0.24 2.80 0.00 -1.34 0.06 119.26 122.06 1iq8 h ALA 384 Ca -0.08 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1iq8 h ALA 384 Cb 0.64 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1iq8 h ALA 384 CO 0.14 -0.10 -0.18 -0.22 0.00 0.00 0.00 179.25 178.88 1iq8 h LYS 385 N 0.29 0.54 -0.36 0.00 3.64 -1.04 -1.95 116.57 117.70 1iq8 h LYS 385 Ca 0.19 -0.27 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 1iq8 h LYS 385 Cb 0.37 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1iq8 h LYS 385 CO -0.04 0.84 -0.05 0.93 -2.27 0.00 0.00 179.45 178.86 1iq8 h GLU 386 N 0.25 0.66 0.00 1.90 5.08 -0.20 -3.05 114.58 119.22 1iq8 h GLU 386 Ca 0.04 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.13 1iq8 h GLU 386 Cb 0.72 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1iq8 h GLU 386 CO 0.05 0.80 -0.17 0.00 -1.00 0.00 0.00 179.01 178.69 1iq8 h ARG 387 N 0.46 0.00 0.08 2.33 3.08 -1.05 -3.22 114.38 116.07 1iq8 h ARG 387 Ca 0.09 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.89 1iq8 h ARG 387 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1iq8 h ARG 387 CO 0.03 0.17 -1.13 0.00 -1.07 0.00 0.00 179.97 177.97 1iq8 h ALA 388 N 1.83 0.21 -0.96 0.04 0.00 -1.25 -3.38 119.26 115.75 1iq8 h ALA 388 Ca -0.00 -0.83 0.17 0.00 0.00 0.00 0.00 54.91 54.25 1iq8 h ALA 388 Cb 0.65 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 18.25 1iq8 h ALA 388 CO 0.02 0.95 -0.30 1.63 0.00 0.00 0.00 179.25 181.55 1iq8 n LYS 389 N -3.58 -0.15 -0.14 0.00 5.02 -1.18 -0.26 118.16 117.88 1iq8 n LYS 389 Ca -0.07 1.48 -0.09 0.00 -2.02 0.00 0.00 58.31 57.62 1iq8 n LYS 389 Cb 0.96 -2.21 0.06 0.00 -0.02 0.00 0.00 35.03 33.82 1iq8 n LYS 389 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1iq8 h SER 390 N 0.00 0.91 -0.41 4.39 4.64 -1.80 -1.33 113.55 119.96 1iq8 h SER 390 Ca 0.40 -0.31 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 1iq8 h SER 390 Cb 0.64 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1iq8 h SER 390 CO -0.97 1.06 0.11 0.40 -0.87 0.00 0.00 176.83 176.56 1iq8 h ILE 391 N 0.81 1.23 -0.21 0.95 5.03 -0.81 -2.88 117.51 121.62 1iq8 h ILE 391 Ca 0.12 -0.76 -0.02 0.00 -0.12 0.00 0.00 64.86 64.08 1iq8 h ILE 391 Cb 0.68 0.95 -0.01 0.00 -3.03 0.00 0.00 36.82 35.42 1iq8 h ILE 391 CO 0.05 0.27 0.06 0.78 -0.68 0.00 0.00 178.15 178.63 1iq8 h ASN 392 N 0.52 0.31 0.00 1.72 2.35 -0.63 0.10 115.58 119.95 1iq8 h ASN 392 Ca 0.13 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1iq8 h ASN 392 Cb 0.30 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1iq8 h ASN 392 CO -0.00 0.44 0.00 1.21 -1.65 0.00 0.00 177.43 177.43 1iq8 n GLU 393 N -4.78 0.71 0.00 0.81 2.13 -0.51 -0.71 120.64 118.29 1iq8 n GLU 393 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1iq8 n GLU 393 Cb 0.16 -1.28 0.00 0.00 0.27 0.00 0.00 31.44 30.59 1iq8 n GLU 393 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1iq8 n ARG 394 N 0.00 0.00 0.01 5.31 0.63 -0.99 -4.85 116.66 116.77 1iq8 n ARG 394 Ca 0.00 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 57.04 1iq8 n ARG 394 Cb 0.14 -0.38 0.05 0.00 0.45 0.00 0.00 32.46 32.72 1iq8 n ARG 394 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1iq8 n PHE 395 N -2.17 0.08 -0.11 -0.14 3.01 0.33 -5.03 117.46 113.43 1iq8 n PHE 395 Ca 0.00 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1iq8 n PHE 395 Cb 0.12 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.37 1iq8 n PHE 395 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iq8 n GLY 396 N 1.46 3.11 4.02 1.37 0.00 0.11 -4.85 105.19 110.41 1iq8 n GLY 396 Ca 0.04 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1iq8 n GLY 396 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1iq8 n GLU 397 N 14.00 -2.49 -2.41 1.61 -0.58 -1.26 -4.29 120.64 125.21 1iq8 n GLU 397 Ca 0.00 0.32 -0.37 0.00 -0.42 0.00 0.00 57.16 56.70 1iq8 n GLU 397 Cb 0.00 -4.20 -0.03 0.00 -0.57 0.00 0.00 31.44 26.64 1iq8 n GLU 397 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1iq8 s LEU 398 N -7.05 4.08 0.21 -4.62 1.43 -1.26 0.04 118.68 111.51 1iq8 s LEU 398 Ca 0.06 2.16 0.03 0.00 -1.03 0.00 0.00 54.13 55.35 1iq8 s LEU 398 Cb -0.02 -4.21 -0.05 0.00 0.03 0.00 0.00 46.19 41.93 1iq8 s LEU 398 CO 0.92 -0.68 -0.01 0.54 0.23 0.00 0.00 176.35 177.34 1iq8 s VAL 399 N -1.61 0.98 0.22 -1.59 0.11 0.25 -4.83 120.40 113.93 1iq8 s VAL 399 Ca 0.60 -2.03 -0.26 0.00 -2.93 0.00 0.00 61.98 57.37 1iq8 s VAL 399 Cb -0.25 -2.25 -0.09 0.00 -1.53 0.00 0.00 36.38 32.27 1iq8 s VAL 399 CO 0.31 -0.40 0.83 -1.61 -3.33 0.00 0.00 175.10 170.90 1iq8 s GLU 400 N -3.86 4.58 -0.03 1.54 2.02 -1.26 -1.72 118.70 119.98 1iq8 s GLU 400 Ca 0.26 1.21 0.00 0.00 0.02 0.00 0.00 54.97 56.46 1iq8 s GLU 400 Cb 0.05 -3.13 0.03 0.00 0.10 0.00 0.00 34.13 31.18 1iq8 s GLU 400 CO 0.07 0.49 0.02 -1.58 0.02 0.00 0.00 175.26 174.27 1iq8 s HIS 401 N -1.29 0.18 0.25 1.61 2.46 0.25 -4.84 115.29 113.91 1iq8 s HIS 401 Ca 0.40 0.06 -0.03 0.00 0.47 0.00 0.00 55.06 55.96 1iq8 s HIS 401 Cb -0.22 -0.33 0.44 0.00 -0.13 0.00 0.00 32.58 32.34 1iq8 s HIS 401 CO 0.26 -0.11 1.79 -1.35 -2.47 0.00 0.00 174.74 172.86 1iq8 h PRO 402 N 7.29 0.71 0.00 2.88 0.11 -1.87 0.40 132.00 141.52 1iq8 h PRO 402 Ca -0.44 -0.04 -0.29 0.00 0.11 0.00 0.00 66.00 65.33 1iq8 h PRO 402 Cb 1.13 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.03 1iq8 h PRO 402 CO 0.47 0.47 -1.61 -0.89 -0.21 0.00 0.00 178.00 176.24 1iq8 n ILE 403 N -4.79 1.54 1.25 4.15 5.41 -1.26 -4.47 119.36 121.20 1iq8 n ILE 403 Ca 0.15 -0.14 0.13 0.00 1.00 0.00 0.00 62.75 63.89 1iq8 n ILE 403 Cb 0.33 -1.99 0.41 0.00 -0.71 0.00 0.00 39.64 37.68 1iq8 n ILE 403 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1iq8 n PHE 404 N -4.35 0.00 0.00 1.39 3.01 -1.24 -4.98 117.46 111.29 1iq8 n PHE 404 Ca -0.38 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.08 1iq8 n PHE 404 Cb 0.75 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 40.07 1iq8 n PHE 404 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iq8 n GLY 405 N 1.34 2.09 3.18 1.37 0.00 0.14 -4.76 105.19 108.56 1iq8 n GLY 405 Ca 0.12 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 1iq8 n GLY 405 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1iq8 s ARG 406 N 0.00 0.31 0.04 1.61 3.03 -1.25 0.88 118.95 123.57 1iq8 s ARG 406 Ca 0.00 0.71 -0.03 0.00 2.03 0.00 0.00 55.73 58.44 1iq8 s ARG 406 Cb 0.00 -0.04 -0.02 0.00 -1.03 0.00 0.00 34.95 33.86 1iq8 s ARG 406 CO 0.00 -0.17 0.04 0.54 -1.13 0.00 0.00 175.30 174.58 1iq8 s VAL 407 N 1.45 0.15 0.30 4.99 0.11 -0.70 -4.88 120.40 121.82 1iq8 s VAL 407 Ca -0.09 -1.21 -0.29 0.00 -2.93 0.00 0.00 61.98 57.46 1iq8 s VAL 407 Cb -0.09 -0.87 -0.11 0.00 -1.53 0.00 0.00 36.38 33.77 1iq8 s VAL 407 CO -0.11 -0.67 1.53 -0.55 -3.33 0.00 0.00 175.10 171.97 1iq8 s SER 408 N -2.13 6.44 0.64 3.54 0.15 -1.26 -0.58 113.70 120.49 1iq8 s SER 408 Ca -0.05 2.90 0.41 0.00 0.70 0.00 0.00 55.95 59.91 1iq8 s SER 408 Cb -0.01 -2.64 2.21 0.00 -1.71 0.00 0.00 66.02 63.86 1iq8 s SER 408 CO -0.05 -0.84 2.24 0.08 1.20 0.00 0.00 173.24 175.87 1iq8 h ARG 409 N 4.42 0.00 0.00 5.44 0.11 -0.57 0.30 114.38 124.07 1iq8 h ARG 409 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.60 1iq8 h ARG 409 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1iq8 h ARG 409 CO 0.75 0.00 0.00 0.66 0.10 0.00 0.00 179.97 181.48 1iq8 n TYR 410 N -2.98 0.55 0.44 4.08 0.53 -1.26 -2.16 117.16 116.36 1iq8 n TYR 410 Ca -0.03 0.20 0.05 0.00 -1.02 0.00 0.00 57.90 57.10 1iq8 n TYR 410 Cb 0.12 -0.82 -0.00 0.00 -1.03 0.00 0.00 39.34 37.61 1iq8 n TYR 410 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 1iq8 n LEU 411 N -1.98 1.16 0.28 7.72 4.77 0.08 -4.58 117.00 124.44 1iq8 n LEU 411 Ca 0.04 -0.75 0.18 0.00 -0.03 0.00 0.00 56.01 55.45 1iq8 n LEU 411 Cb 0.27 0.00 0.95 0.00 -2.33 0.00 0.00 43.42 42.32 1iq8 n LEU 411 CO 0.21 0.24 1.15 0.77 -1.33 0.00 0.00 177.39 178.43 1iq8 h SER 412 N 1.04 0.00 0.01 -1.43 4.64 -1.21 -0.19 113.55 116.41 1iq8 h SER 412 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1iq8 h SER 412 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1iq8 h SER 412 CO 0.00 0.00 -0.05 0.18 -0.87 0.00 0.00 176.83 176.09 1iq8 n LEU 413 N -3.45 1.83 -4.62 5.97 4.77 -1.26 -3.20 117.00 117.03 1iq8 n LEU 413 Ca -0.01 -0.60 -0.31 0.00 -0.03 0.00 0.00 56.01 55.06 1iq8 n LEU 413 Cb 0.23 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.21 1iq8 n LEU 413 CO 0.23 0.31 -0.37 -0.89 -1.33 0.00 0.00 177.39 175.33 1iq8 s THR 414 N -2.07 3.72 0.42 -5.08 2.01 -0.08 -3.95 115.64 110.61 1iq8 s THR 414 Ca 0.33 -0.92 -0.27 0.00 0.31 0.00 0.00 61.69 61.15 1iq8 s THR 414 Cb 0.20 -2.69 -0.10 0.00 0.01 0.00 0.00 72.50 69.93 1iq8 s THR 414 CO 0.36 0.26 1.47 -0.47 -0.69 0.00 0.00 174.62 175.55 1iq8 s TYR 415 N -1.13 2.49 -0.55 4.92 5.04 0.36 -0.07 117.35 128.42 1iq8 s TYR 415 Ca 0.20 1.20 0.12 0.00 -2.44 0.00 0.00 57.07 56.15 1iq8 s TYR 415 Cb -0.11 -3.99 0.65 0.00 0.35 0.00 0.00 41.96 38.85 1iq8 s TYR 415 CO 0.12 -3.04 1.50 -0.35 -1.34 0.00 0.00 175.55 172.43 1iq8 n PRO 416 N 0.10 3.97 0.09 4.97 -0.04 -1.26 -4.91 135.00 137.92 1iq8 n PRO 416 Ca 0.03 -2.49 -0.10 0.00 -0.04 0.00 0.00 63.50 60.90 1iq8 n PRO 416 Cb 0.40 -2.06 -0.06 0.00 -0.04 0.00 0.00 33.50 31.74 1iq8 n PRO 416 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1iq8 h PHE 417 N 3.23 -0.28 0.00 0.54 -1.00 -0.76 -3.18 116.94 115.48 1iq8 h PHE 417 Ca 0.00 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1iq8 h PHE 417 Cb 1.61 0.09 0.00 0.00 3.61 0.00 0.00 35.95 41.26 1iq8 h PHE 417 CO 0.84 0.06 0.00 0.00 -1.61 0.00 0.00 178.31 177.60 1iq8 n ALA 418 N -2.63 -0.08 0.09 2.45 0.00 -0.93 -2.51 120.51 116.91 1iq8 n ALA 418 Ca -0.07 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.42 1iq8 n ALA 418 Cb 0.24 0.16 0.26 0.00 0.00 0.00 0.00 19.45 20.11 1iq8 n ALA 418 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1iq8 n GLN 419 N -1.29 0.06 -1.54 0.00 3.00 -1.26 -4.79 117.38 111.56 1iq8 n GLN 419 Ca 0.00 0.51 -0.42 0.00 -0.01 0.00 0.00 57.00 57.07 1iq8 n GLN 419 Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 30.24 28.39 1iq8 n GLN 419 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1iq8 n SER 420 N -1.82 0.33 -3.68 1.08 2.88 -1.05 -4.15 113.62 107.21 1iq8 n SER 420 Ca -0.01 1.02 -0.10 0.00 -1.33 0.00 0.00 58.87 58.46 1iq8 n SER 420 Cb 0.16 -1.23 -0.10 0.00 -0.75 0.00 0.00 64.21 62.29 1iq8 n SER 420 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1iq8 s GLU 421 N -1.71 0.50 0.00 -1.46 2.12 0.48 -4.51 118.70 114.12 1iq8 s GLU 421 Ca 0.62 0.89 0.00 0.00 0.36 0.00 0.00 54.97 56.84 1iq8 s GLU 421 Cb -0.62 0.05 0.00 0.00 0.26 0.00 0.00 34.13 33.82 1iq8 s GLU 421 CO 0.58 -0.15 0.00 0.00 -0.54 0.00 0.00 175.26 175.15 1iq8 n ALA 422 N 4.10 0.00 0.12 6.30 0.00 -1.26 -1.71 120.51 128.06 1iq8 n ALA 422 Ca -0.21 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.28 1iq8 n ALA 422 Cb 0.56 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.51 1iq8 n ALA 422 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1iq8 h GLU 423 N 0.00 0.28 -6.20 0.00 3.07 -1.98 -3.40 114.58 106.35 1iq8 h GLU 423 Ca 0.00 -0.03 -0.69 0.00 -0.50 0.00 0.00 59.36 58.15 1iq8 h GLU 423 Cb 0.00 -0.06 -0.26 0.00 -0.84 0.00 0.00 28.75 27.59 1iq8 h GLU 423 CO 0.00 0.23 -0.80 -0.51 -1.40 0.00 0.00 179.01 176.53 1iq8 s ASP 424 N -6.87 3.76 0.92 1.42 1.01 -1.26 -5.13 116.67 110.52 1iq8 s ASP 424 Ca -0.06 -0.29 -0.12 0.00 0.71 0.00 0.00 52.55 52.78 1iq8 s ASP 424 Cb 0.17 -0.87 0.14 0.00 1.01 0.00 0.00 42.92 43.37 1iq8 s ASP 424 CO 0.71 0.31 1.09 -1.81 0.21 0.00 0.00 175.17 175.68 1iq8 s ASP 425 N -0.50 3.31 -0.23 0.27 1.01 -1.26 -4.81 116.67 114.46 1iq8 s ASP 425 Ca 0.06 1.37 0.01 0.00 0.71 0.00 0.00 52.55 54.71 1iq8 s ASP 425 Cb -0.12 -2.04 0.04 0.00 1.01 0.00 0.00 42.92 41.81 1iq8 s ASP 425 CO 0.01 -2.72 -0.13 0.12 0.21 0.00 0.00 175.17 172.66 1iq8 s PHE 426 N -2.97 3.06 -0.29 4.23 5.36 -1.26 -4.83 117.98 121.28 1iq8 s PHE 426 Ca 0.64 -1.96 -0.29 0.00 -0.96 0.00 0.00 56.93 54.36 1iq8 s PHE 426 Cb -0.18 -1.95 0.01 0.00 -0.34 0.00 0.00 43.02 40.57 1iq8 s PHE 426 CO 0.57 -0.83 1.07 0.15 -1.46 0.00 0.00 175.22 174.72 1iq8 s LYS 427 N 1.21 4.12 0.08 10.12 1.02 -1.26 -5.02 119.74 130.01 1iq8 s LYS 427 Ca -0.03 1.16 -0.25 0.00 0.02 0.00 0.00 55.97 56.88 1iq8 s LYS 427 Cb -0.17 -3.71 -0.06 0.00 -0.52 0.00 0.00 37.83 33.37 1iq8 s LYS 427 CO -0.08 -0.82 0.76 0.42 -0.92 0.00 0.00 175.35 174.71 1iq8 s ILE 428 N 3.53 4.63 -0.33 2.17 1.01 -1.26 -5.02 121.20 125.93 1iq8 s ILE 428 Ca 0.45 1.64 -0.18 0.00 0.00 0.00 0.00 60.65 62.56 1iq8 s ILE 428 Cb -0.13 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.21 1iq8 s ILE 428 CO 0.13 0.41 0.50 -1.61 0.00 0.00 0.00 174.94 174.37 1iq8 s GLU 429 N -0.38 3.72 0.46 2.79 8.01 -1.26 -5.06 118.70 126.98 1iq8 s GLU 429 Ca 0.37 -0.08 -0.21 0.00 0.01 0.00 0.00 54.97 55.06 1iq8 s GLU 429 Cb -0.21 -3.77 -0.09 0.00 -4.31 0.00 0.00 34.13 25.75 1iq8 s GLU 429 CO 0.24 -0.57 1.05 0.15 0.01 0.00 0.00 175.26 176.13 1iq8 s LYS 430 N 2.35 3.90 0.75 1.61 1.02 -1.26 -4.78 119.74 123.33 1iq8 s LYS 430 Ca 0.19 1.42 -0.11 0.00 0.02 0.00 0.00 55.97 57.49 1iq8 s LYS 430 Cb -0.15 -2.24 0.04 0.00 -0.52 0.00 0.00 37.83 34.96 1iq8 s LYS 430 CO 0.12 -0.36 1.09 -2.14 -0.92 0.00 0.00 175.35 173.15 1iq8 s PRO 431 N -3.00 2.40 0.00 -1.68 0.02 -1.26 -5.08 135.00 126.41 1iq8 s PRO 431 Ca 0.64 1.19 0.00 0.00 0.02 0.00 0.00 61.00 62.85 1iq8 s PRO 431 Cb -0.19 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.42 1iq8 s PRO 431 CO 0.23 -1.54 0.00 0.25 -0.33 0.00 0.00 177.00 175.61 1iq8 n THR 432 N -3.31 0.00 0.03 0.99 -2.24 -1.26 -4.94 114.28 103.55 1iq8 n THR 432 Ca 0.09 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.83 1iq8 n THR 432 Cb 0.53 -0.66 -0.10 0.00 -2.10 0.00 0.00 70.33 68.00 1iq8 n THR 432 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1iq8 h LYS 433 N 0.00 0.00 -0.20 -0.78 1.57 -1.99 -3.22 116.57 111.94 1iq8 h LYS 433 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1iq8 h LYS 433 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1iq8 h LYS 433 CO 0.00 0.49 0.00 0.39 -0.57 0.00 0.00 179.45 179.76 1iq8 n GLU 434 N -3.05 2.08 -0.00 3.15 4.71 -1.26 -4.03 120.64 122.24 1iq8 n GLU 434 Ca -0.10 -1.62 0.03 0.00 -0.01 0.00 0.00 57.16 55.46 1iq8 n GLU 434 Cb 0.92 -1.46 -0.03 0.00 -1.01 0.00 0.00 31.44 29.86 1iq8 n GLU 434 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1iq8 n ASP 435 N 0.87 1.10 -0.25 1.62 8.00 -1.25 -4.59 116.55 122.04 1iq8 n ASP 435 Ca 0.17 -0.47 -0.06 0.00 0.71 0.00 0.00 54.79 55.14 1iq8 n ASP 435 Cb 0.47 1.06 -0.01 0.00 -0.02 0.00 0.00 41.12 42.63 1iq8 n ASP 435 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iq8 h ALA 436 N 0.69 -0.12 -0.01 2.24 0.00 -1.69 0.36 119.26 120.73 1iq8 h ALA 436 Ca 0.00 0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1iq8 h ALA 436 Cb 0.15 0.92 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1iq8 h ALA 436 CO 0.00 -0.73 -0.61 0.97 0.00 0.00 0.00 179.25 178.88 1iq8 h ILE 437 N -0.14 1.44 -0.63 0.00 6.09 -1.86 -3.07 117.51 119.33 1iq8 h ILE 437 Ca 0.24 -2.09 0.01 0.00 -1.37 0.00 0.00 64.86 61.65 1iq8 h ILE 437 Cb 0.56 2.12 -0.03 0.00 0.47 0.00 0.00 36.82 39.94 1iq8 h ILE 437 CO -0.76 0.60 0.42 0.50 -3.07 0.00 0.00 178.15 175.84 1iq8 h LYS 438 N 0.02 0.81 -0.07 2.19 1.63 -0.68 -1.84 116.57 118.63 1iq8 h LYS 438 Ca -0.01 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.67 1iq8 h LYS 438 Cb 1.09 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.53 1iq8 h LYS 438 CO 0.08 0.54 -0.26 1.88 -3.45 0.00 0.00 179.45 178.24 1iq8 h TYR 439 N 0.84 0.40 -0.92 1.91 -1.99 -0.71 -3.02 116.97 113.49 1iq8 h TYR 439 Ca 0.23 -0.17 0.11 0.00 2.00 0.00 0.00 58.73 60.91 1iq8 h TYR 439 Cb -0.07 -0.07 -0.08 0.00 2.00 0.00 0.00 36.73 38.51 1iq8 h TYR 439 CO -0.00 0.88 0.55 0.28 -0.00 0.00 0.00 178.16 179.87 1iq8 h VAL 440 N -0.18 0.91 -0.29 -2.88 2.07 -1.42 -1.16 116.25 113.30 1iq8 h VAL 440 Ca -0.01 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 1iq8 h VAL 440 Cb 0.89 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1iq8 h VAL 440 CO 0.05 0.16 -0.23 0.24 0.02 0.00 0.00 177.57 177.82 1iq8 h MET 441 N 0.89 0.56 -0.32 1.57 2.86 -1.37 -0.82 114.93 118.31 1iq8 h MET 441 Ca 0.45 -0.21 -0.17 0.00 -2.06 0.00 0.00 59.70 57.71 1iq8 h MET 441 Cb 0.43 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 1iq8 h MET 441 CO -0.26 0.75 -0.47 0.00 1.06 0.00 0.00 176.91 177.99 1iq8 h ALA 442 N 1.26 0.49 -0.29 6.32 0.00 -1.23 -2.09 119.26 123.71 1iq8 h ALA 442 Ca 0.07 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1iq8 h ALA 442 Cb 0.67 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1iq8 h ALA 442 CO 0.05 0.65 0.08 0.82 0.00 0.00 0.00 179.25 180.85 1iq8 h ILE 443 N 0.67 1.21 -0.61 0.00 2.04 -1.07 -0.76 117.51 118.99 1iq8 h ILE 443 Ca 0.03 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 1iq8 h ILE 443 Cb 1.07 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 1iq8 h ILE 443 CO 0.11 0.22 0.17 0.00 0.00 0.00 0.00 178.15 178.65 1iq8 h ALA 444 N 0.91 0.80 0.00 1.87 0.00 -1.15 2.15 119.26 123.84 1iq8 h ALA 444 Ca 0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1iq8 h ALA 444 Cb 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1iq8 h ALA 444 CO -0.00 0.49 -0.19 1.49 0.00 0.00 0.00 179.25 181.03 1iq8 h GLU 445 N 0.88 0.00 0.13 0.00 4.57 -1.29 0.28 114.58 119.15 1iq8 h GLU 445 Ca 0.19 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 58.08 1iq8 h GLU 445 Cb 0.32 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1iq8 h GLU 445 CO -0.00 0.19 -1.47 -0.92 -1.18 0.00 0.00 179.01 175.63 1iq8 h TYR 446 N 0.00 0.49 0.03 0.92 3.20 0.16 -2.96 116.97 118.81 1iq8 h TYR 446 Ca -0.00 -0.36 -0.00 0.00 3.14 0.00 0.00 58.73 61.51 1iq8 h TYR 446 Cb 0.53 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.78 1iq8 h TYR 446 CO 0.00 1.58 -0.01 0.37 -1.64 0.00 0.00 178.16 178.45 1iq8 h GLN 447 N -0.23 -0.04 -0.01 1.82 4.15 0.37 -3.37 115.11 117.80 1iq8 h GLN 447 Ca -0.31 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.11 1iq8 h GLN 447 Cb 1.82 0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.52 1iq8 h GLN 447 CO 0.08 0.62 -0.23 1.19 -1.93 0.00 0.00 178.83 178.56 1iq8 n PHE 448 N -4.71 0.00 0.00 3.99 0.99 0.98 -5.03 117.46 113.68 1iq8 n PHE 448 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.38 1iq8 n PHE 448 Cb 0.33 -0.05 0.00 0.00 -1.00 0.00 0.00 39.48 38.75 1iq8 n PHE 448 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1iq8 n GLY 449 N 1.33 -0.86 2.83 1.37 0.00 -1.12 -4.78 105.19 103.96 1iq8 n GLY 449 Ca 0.13 -1.65 -0.48 0.00 0.00 0.00 0.00 46.02 44.02 1iq8 n GLY 449 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1iq8 n GLU 450 N -0.85 0.00 0.00 1.61 4.07 -1.25 -1.57 120.64 122.65 1iq8 n GLU 450 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1iq8 n GLU 450 Cb 0.00 -1.20 0.00 0.00 -0.06 0.00 0.00 31.44 30.18 1iq8 n GLU 450 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1iq8 n GLY 451 N 1.48 3.08 0.40 8.31 0.00 -1.26 -4.89 105.19 112.30 1iq8 n GLY 451 Ca 0.17 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.41 1iq8 n GLY 451 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iq8 h ALA 452 N 0.00 2.30 -0.15 4.61 0.00 -1.57 -1.06 119.26 123.39 1iq8 h ALA 452 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1iq8 h ALA 452 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1iq8 h ALA 452 CO 0.00 -0.72 -0.02 0.66 0.00 0.00 0.00 179.25 179.17 1iq8 h SER 453 N 0.00 0.20 0.00 0.00 4.64 -1.82 -1.88 113.55 114.69 1iq8 h SER 453 Ca 0.24 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1iq8 h SER 453 Cb 1.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1iq8 h SER 453 CO -0.00 0.26 0.11 0.03 -0.87 0.00 0.00 176.83 176.36 1iq8 h ARG 454 N 0.21 0.00 -0.00 4.77 3.08 -1.58 0.78 114.38 121.64 1iq8 h ARG 454 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1iq8 h ARG 454 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1iq8 h ARG 454 CO 0.01 0.00 -0.26 0.00 -1.07 0.00 0.00 179.97 178.64 1iq8 n ALA 455 N -1.74 3.03 -3.23 0.04 0.00 -0.71 -4.32 120.51 113.58 1iq8 n ALA 455 Ca -0.01 -0.29 -0.25 0.00 0.00 0.00 0.00 53.44 52.89 1iq8 n ALA 455 Cb 0.14 -1.25 -0.08 0.00 0.00 0.00 0.00 19.45 18.27 1iq8 n ALA 455 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1iq8 n PHE 456 N -1.23 -0.40 -0.02 0.00 3.01 0.27 -4.92 117.46 114.18 1iq8 n PHE 456 Ca 0.09 -3.53 -0.03 0.00 1.01 0.00 0.00 57.45 54.99 1iq8 n PHE 456 Cb 0.32 -0.25 -0.01 0.00 -0.01 0.00 0.00 39.48 39.53 1iq8 n PHE 456 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1iq8 n ASP 457 N 1.63 1.07 -0.87 4.37 8.00 -1.23 -4.63 116.55 124.89 1iq8 n ASP 457 Ca 0.23 0.17 -0.00 0.00 0.71 0.00 0.00 54.79 55.89 1iq8 n ASP 457 Cb 0.52 -0.48 0.01 0.00 -0.02 0.00 0.00 41.12 41.15 1iq8 n ASP 457 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1iq8 n ASP 458 N -3.54 2.36 -4.94 -2.24 5.75 -1.26 -4.88 116.55 107.80 1iq8 n ASP 458 Ca -0.05 -2.05 -0.24 0.00 -0.01 0.00 0.00 54.79 52.43 1iq8 n ASP 458 Cb 0.20 -0.51 -0.01 0.00 -1.03 0.00 0.00 41.12 39.77 1iq8 n ASP 458 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1iq8 s ALA 459 N -0.47 3.68 -0.03 2.12 0.00 -1.26 -4.81 121.76 121.00 1iq8 s ALA 459 Ca 0.02 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.14 1iq8 s ALA 459 Cb 0.02 -2.14 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 1iq8 s ALA 459 CO 0.00 -0.07 -0.17 0.15 0.00 0.00 0.00 175.76 175.67 1iq8 s LYS 460 N -4.37 2.35 -0.16 0.00 1.02 0.36 -4.88 119.74 114.06 1iq8 s LYS 460 Ca 0.41 -0.79 0.01 0.00 0.02 0.00 0.00 55.97 55.62 1iq8 s LYS 460 Cb -0.10 -2.27 0.02 0.00 -0.52 0.00 0.00 37.83 34.96 1iq8 s LYS 460 CO 0.37 0.60 -0.18 0.08 -0.92 0.00 0.00 175.35 175.29 1iq8 s VAL 461 N -0.74 1.89 -0.07 3.17 1.01 -1.26 -1.36 120.40 123.04 1iq8 s VAL 461 Ca 0.12 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 1iq8 s VAL 461 Cb -0.10 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1iq8 s VAL 461 CO 0.01 0.51 0.37 -1.83 0.00 0.00 0.00 175.10 174.16 1iq8 s GLU 462 N 1.23 4.03 -0.11 2.72 -1.05 -1.19 -4.81 118.70 119.53 1iq8 s GLU 462 Ca 0.02 0.29 -0.18 0.00 -0.15 0.00 0.00 54.97 54.95 1iq8 s GLU 462 Cb -0.14 -3.30 -0.04 0.00 -0.44 0.00 0.00 34.13 30.21 1iq8 s GLU 462 CO -0.10 0.50 0.46 -0.51 0.95 0.00 0.00 175.26 176.56 1iq8 s LEU 463 N -0.40 4.29 0.00 1.83 1.43 -1.26 -0.93 118.68 123.64 1iq8 s LEU 463 Ca 0.21 0.81 -0.11 0.00 -1.03 0.00 0.00 54.13 54.02 1iq8 s LEU 463 Cb -0.15 -2.67 0.17 0.00 0.03 0.00 0.00 46.19 43.57 1iq8 s LEU 463 CO 0.10 0.04 0.39 -1.54 0.23 0.00 0.00 176.35 175.56 1iq8 n SER 464 N 3.49 -2.93 -0.32 2.29 3.41 0.03 -4.78 113.62 114.80 1iq8 n SER 464 Ca -0.08 -0.39 0.20 0.00 -0.26 0.00 0.00 58.87 58.34 1iq8 n SER 464 Cb 0.52 -0.46 0.41 0.00 -0.26 0.00 0.00 64.21 64.42 1iq8 n SER 464 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1iq8 h LYS 465 N 0.00 0.20 0.00 4.33 2.10 -1.98 -3.37 116.57 117.85 1iq8 h LYS 465 Ca -0.18 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.46 1iq8 h LYS 465 Cb 0.60 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 1iq8 h LYS 465 CO 0.11 0.13 0.00 0.25 -2.00 0.00 0.00 179.45 177.94 1iq8 n THR 466 N -5.19 0.00 -2.07 0.07 -2.24 -1.26 -4.99 114.28 98.60 1iq8 n THR 466 Ca 0.28 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.06 1iq8 n THR 466 Cb 0.90 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 69.24 1iq8 n THR 466 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iq8 n GLY 467 N 5.00 3.71 3.75 3.38 0.00 -1.26 -4.94 105.19 114.83 1iq8 n GLY 467 Ca 0.00 -1.35 -0.36 0.00 0.00 0.00 0.00 46.02 44.31 1iq8 n GLY 467 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1iq8 s MET 468 N -2.37 4.15 0.33 1.61 -1.94 -1.26 -4.00 119.30 115.81 1iq8 s MET 468 Ca 0.38 0.01 -0.29 0.00 -1.71 0.00 0.00 55.69 54.08 1iq8 s MET 468 Cb 0.38 -3.39 -0.11 0.00 2.01 0.00 0.00 34.83 33.72 1iq8 s MET 468 CO -0.08 0.33 1.47 -2.14 -0.01 0.00 0.00 175.02 174.59 1iq8 s PRO 469 N 0.22 4.18 0.00 2.03 0.02 -1.26 -0.79 135.00 139.40 1iq8 s PRO 469 Ca 0.15 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.64 1iq8 s PRO 469 Cb -0.13 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1iq8 s PRO 469 CO 0.03 -0.48 0.00 0.54 -0.33 0.00 0.00 177.00 176.76 1iq8 n ARG 470 N 1.23 0.00 -2.11 5.54 5.12 -0.11 -4.53 116.66 121.81 1iq8 n ARG 470 Ca 0.03 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.53 1iq8 n ARG 470 Cb 0.39 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.67 1iq8 n ARG 470 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1iq8 s GLN 471 N 2.36 4.25 -0.13 5.56 0.74 -1.26 -1.30 119.66 129.87 1iq8 s GLN 471 Ca 0.00 2.11 -0.08 0.00 0.05 0.00 0.00 55.36 57.44 1iq8 s GLN 471 Cb 0.00 -3.58 -0.04 0.00 1.10 0.00 0.00 33.01 30.49 1iq8 s GLN 471 CO 0.00 -0.64 0.14 0.08 -0.55 0.00 0.00 175.29 174.32 1iq8 s VAL 472 N 2.48 5.49 0.16 1.34 1.01 0.30 -3.15 120.40 128.04 1iq8 s VAL 472 Ca 0.68 0.21 -0.03 0.00 0.00 0.00 0.00 61.98 62.84 1iq8 s VAL 472 Cb -0.35 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1iq8 s VAL 472 CO 0.29 0.59 0.14 -0.54 0.00 0.00 0.00 175.10 175.57 1iq8 s LYS 473 N -0.78 1.08 -0.16 2.72 1.02 -0.47 -0.85 119.74 122.30 1iq8 s LYS 473 Ca 0.14 -1.44 -0.04 0.00 0.02 0.00 0.00 55.97 54.65 1iq8 s LYS 473 Cb -0.12 0.29 0.08 0.00 -0.52 0.00 0.00 37.83 37.56 1iq8 s LYS 473 CO 0.03 -0.35 0.25 0.08 -0.92 0.00 0.00 175.35 174.45 1iq8 s VAL 474 N -4.07 -0.40 -1.42 3.17 1.01 -0.12 -0.49 120.40 118.10 1iq8 s VAL 474 Ca 0.27 0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 1iq8 s VAL 474 Cb 0.06 -0.55 0.07 0.00 0.00 0.00 0.00 36.38 35.95 1iq8 s VAL 474 CO 0.05 -0.02 0.66 0.59 0.00 0.00 0.00 175.10 176.38 1iq8 n ASN 475 N 5.34 -4.48 0.00 3.32 3.02 -1.26 -1.17 115.26 120.03 1iq8 n ASN 475 Ca -0.06 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 1iq8 n ASN 475 Cb 0.50 -3.64 0.00 0.00 -0.61 0.00 0.00 39.78 36.03 1iq8 n ASN 475 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1iq8 n GLY 476 N -1.39 0.55 3.29 7.41 0.00 -1.26 -5.05 105.19 108.73 1iq8 n GLY 476 Ca -0.01 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1iq8 n GLY 476 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iq8 s LYS 477 N -0.97 2.97 -0.51 1.61 -2.85 -0.32 -5.08 119.74 114.59 1iq8 s LYS 477 Ca 0.00 -0.82 -0.28 0.00 -1.00 0.00 0.00 55.97 53.86 1iq8 s LYS 477 Cb 0.00 -2.36 0.01 0.00 -2.06 0.00 0.00 37.83 33.43 1iq8 s LYS 477 CO 0.00 0.27 1.40 0.50 0.10 0.00 0.00 175.35 177.63 1iq8 s ARG 478 N 0.13 3.40 -0.14 1.78 3.00 -1.26 -0.94 118.95 124.93 1iq8 s ARG 478 Ca -0.11 0.62 -0.24 0.00 -1.00 0.00 0.00 55.73 55.00 1iq8 s ARG 478 Cb -0.16 -4.08 -0.22 0.00 0.00 0.00 0.00 34.95 30.49 1iq8 s ARG 478 CO 0.06 -1.80 0.61 -0.07 0.00 0.00 0.00 175.30 174.11 1iq8 h LEU 479 N 12.74 0.00 -8.00 -0.88 3.38 -1.34 -3.35 115.31 117.86 1iq8 h LEU 479 Ca -0.27 -0.82 -0.03 0.00 0.09 0.00 0.00 57.88 56.86 1iq8 h LEU 479 Cb 1.10 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.85 1iq8 h LEU 479 CO 1.15 0.96 0.27 0.00 0.09 0.00 0.00 178.44 180.91 1iq8 s ALA 480 N -2.28 -0.70 -0.16 1.53 0.00 -1.20 -0.56 121.76 118.39 1iq8 s ALA 480 Ca -0.17 -0.79 -0.05 0.00 0.00 0.00 0.00 51.96 50.95 1iq8 s ALA 480 Cb -0.02 0.67 0.08 0.00 0.00 0.00 0.00 23.12 23.85 1iq8 s ALA 480 CO 0.58 -0.98 0.30 0.99 0.00 0.00 0.00 175.76 176.65 1iq8 s THR 481 N -2.20 -0.47 -0.03 0.00 2.01 -0.86 0.11 115.64 114.20 1iq8 s THR 481 Ca 0.16 0.17 -0.30 0.00 0.31 0.00 0.00 61.69 62.03 1iq8 s THR 481 Cb -0.05 -0.55 -0.06 0.00 0.01 0.00 0.00 72.50 71.85 1iq8 s THR 481 CO 0.12 0.04 1.60 -0.69 -0.69 0.00 0.00 174.62 175.00 1iq8 s VAL 482 N 2.46 3.54 0.83 3.82 1.01 -0.42 -1.52 120.40 130.12 1iq8 s VAL 482 Ca 0.03 0.76 -0.11 0.00 0.00 0.00 0.00 61.98 62.66 1iq8 s VAL 482 Cb -0.13 -3.49 0.09 0.00 0.00 0.00 0.00 36.38 32.85 1iq8 s VAL 482 CO -0.11 -0.05 1.10 -0.13 0.00 0.00 0.00 175.10 175.92 1iq8 s ARG 483 N 3.54 1.81 0.11 2.72 0.52 0.49 -4.62 118.95 123.51 1iq8 s ARG 483 Ca 0.71 1.19 0.21 0.00 -0.52 0.00 0.00 55.73 57.32 1iq8 s ARG 483 Cb -0.34 -1.84 -0.11 0.00 0.52 0.00 0.00 34.95 33.17 1iq8 s ARG 483 CO 0.29 -1.96 0.83 0.00 0.02 0.00 0.00 175.30 174.48 1iq8 n ALA 484 N -3.74 2.43 0.46 2.13 0.00 -1.26 -3.06 120.51 117.47 1iq8 n ALA 484 Ca 0.09 -0.40 0.12 0.00 0.00 0.00 0.00 53.44 53.25 1iq8 n ALA 484 Cb 0.53 -0.96 0.11 0.00 0.00 0.00 0.00 19.45 19.13 1iq8 n ALA 484 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1iq8 h ASP 485 N 0.00 0.00 0.00 0.00 -0.00 -1.97 -3.41 116.42 111.04 1iq8 h ASP 485 Ca -0.05 -0.19 0.00 0.00 -0.00 0.00 0.00 57.03 56.78 1iq8 h ASP 485 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.49 1iq8 h ASP 485 CO 0.01 0.10 0.00 -0.90 -0.00 0.00 0.00 179.24 178.45 1iq8 n ASP 486 N -2.22 0.00 -0.87 4.15 3.85 -1.26 -4.97 116.55 115.22 1iq8 n ASP 486 Ca 0.02 -0.22 -0.09 0.00 -0.71 0.00 0.00 54.79 53.79 1iq8 n ASP 486 Cb 0.46 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.21 1iq8 n ASP 486 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1iq8 n GLY 487 N 0.00 0.54 3.78 6.12 0.00 -1.17 -0.49 105.19 113.97 1iq8 n GLY 487 Ca 0.00 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.24 1iq8 n GLY 487 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iq8 s LEU 488 N -2.36 3.58 -0.07 0.99 1.43 -1.26 -4.57 118.68 116.41 1iq8 s LEU 488 Ca 0.00 -0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 52.44 1iq8 s LEU 488 Cb 0.00 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 1iq8 s LEU 488 CO 0.00 -0.11 0.65 -0.76 0.23 0.00 0.00 176.35 176.36 1iq8 s LEU 489 N -3.83 4.32 -0.43 1.79 1.43 -1.26 -0.38 118.68 120.32 1iq8 s LEU 489 Ca 0.34 1.11 -0.14 0.00 -1.03 0.00 0.00 54.13 54.41 1iq8 s LEU 489 Cb -0.07 -2.99 0.04 0.00 0.03 0.00 0.00 46.19 43.21 1iq8 s LEU 489 CO 0.24 -0.08 0.32 -0.89 0.23 0.00 0.00 176.35 176.17 1iq8 s THR 490 N 0.68 5.10 0.41 5.49 2.01 -0.57 -4.87 115.64 123.89 1iq8 s THR 490 Ca 0.35 -0.89 -0.26 0.00 0.31 0.00 0.00 61.69 61.20 1iq8 s THR 490 Cb -0.17 -3.94 -0.08 0.00 0.01 0.00 0.00 72.50 68.32 1iq8 s THR 490 CO 0.16 -0.42 1.29 -0.76 -0.69 0.00 0.00 174.62 174.21 1iq8 s LEU 491 N 1.63 4.19 0.05 4.42 1.43 -1.26 -2.03 118.68 127.12 1iq8 s LEU 491 Ca 0.04 2.63 -0.01 0.00 -1.03 0.00 0.00 54.13 55.76 1iq8 s LEU 491 Cb -0.21 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.03 1iq8 s LEU 491 CO 0.08 -0.87 0.22 -0.83 0.23 0.00 0.00 176.35 175.18 1iq8 s GLY 492 N -0.79 2.19 0.59 -3.19 0.00 0.28 -4.92 107.32 101.48 1iq8 s GLY 492 Ca 0.58 -0.79 0.30 0.00 0.00 0.00 0.00 44.72 44.81 1iq8 s GLY 492 CO 0.48 -0.75 1.69 1.19 0.00 0.00 0.00 173.10 175.71 1iq8 h ILE 493 N 2.24 0.24 0.20 0.90 -0.00 -1.84 0.71 117.51 119.97 1iq8 h ILE 493 Ca -0.46 0.00 -0.32 0.00 -0.00 0.00 0.00 64.86 64.08 1iq8 h ILE 493 Cb 1.17 0.38 0.02 0.00 -0.00 0.00 0.00 36.82 38.39 1iq8 h ILE 493 CO 0.74 0.00 -1.42 -0.08 -0.00 0.00 0.00 178.15 177.40 1iq8 h GLU 494 N 0.00 0.43 -0.14 2.19 4.57 -1.83 -2.79 114.58 117.00 1iq8 h GLU 494 Ca 0.38 -0.74 -0.12 0.00 -1.18 0.00 0.00 59.36 57.70 1iq8 h GLU 494 Cb 1.98 0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 30.83 1iq8 h GLU 494 CO -0.00 1.35 -0.44 0.78 -1.18 0.00 0.00 179.01 179.52 1iq8 h GLY 495 N 0.74 0.37 0.99 1.92 0.00 0.56 -2.78 103.07 104.87 1iq8 h GLY 495 Ca -0.22 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 1iq8 h GLY 495 CO 0.24 0.33 0.22 0.00 0.00 0.00 0.00 176.54 177.34 1iq8 h ALA 496 N 1.26 0.74 -0.52 3.60 0.00 -0.91 -1.17 119.26 122.26 1iq8 h ALA 496 Ca 0.02 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.81 1iq8 h ALA 496 Cb 0.89 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1iq8 h ALA 496 CO 0.07 0.37 0.26 0.87 0.00 0.00 0.00 179.25 180.82 1iq8 h LYS 497 N 0.79 0.49 -0.32 0.00 1.57 -1.22 0.32 116.57 118.21 1iq8 h LYS 497 Ca 0.19 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.81 1iq8 h LYS 497 Cb 0.22 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1iq8 h LYS 497 CO -0.01 0.33 -0.34 0.00 -0.57 0.00 0.00 179.45 178.86 1iq8 h ARG 498 N 0.51 0.70 -0.59 3.15 3.08 -1.33 -2.71 114.38 117.19 1iq8 h ARG 498 Ca 0.23 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.88 1iq8 h ARG 498 Cb 0.15 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1iq8 h ARG 498 CO -0.17 0.93 0.10 -0.07 -1.07 0.00 0.00 179.97 179.69 1iq8 h LEU 499 N 0.59 0.94 -0.64 3.04 4.07 -0.65 0.11 115.31 122.76 1iq8 h LEU 499 Ca 0.06 -0.26 0.09 0.00 0.08 0.00 0.00 57.88 57.85 1iq8 h LEU 499 Cb 0.85 -0.25 -0.07 0.00 1.08 0.00 0.00 40.66 42.28 1iq8 h LEU 499 CO 0.07 0.96 0.29 -0.74 -1.08 0.00 0.00 178.44 177.95 1iq8 h HIS 500 N 0.88 0.52 0.00 1.13 2.76 -0.12 0.24 115.15 120.56 1iq8 h HIS 500 Ca 0.18 0.03 -0.20 0.00 -2.20 0.00 0.00 60.37 58.18 1iq8 h HIS 500 Cb 0.42 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 29.21 1iq8 h HIS 500 CO 0.03 0.18 -1.03 0.07 -1.30 0.00 0.00 177.93 175.89 1iq8 h ARG 501 N 0.52 0.00 -0.04 5.26 0.11 -1.26 -3.34 114.38 115.62 1iq8 h ARG 501 Ca 0.32 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 60.14 1iq8 h ARG 501 Cb 0.34 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.44 1iq8 h ARG 501 CO -0.27 0.82 -0.97 0.28 0.10 0.00 0.00 179.97 179.93 1iq8 h VAL 502 N 0.00 1.28 -3.15 0.08 2.07 -0.26 -3.44 116.25 112.83 1iq8 h VAL 502 Ca -0.05 -2.17 -0.61 0.00 0.82 0.00 0.00 66.70 64.68 1iq8 h VAL 502 Cb 1.73 2.26 -0.11 0.00 -1.52 0.00 0.00 31.29 33.65 1iq8 h VAL 502 CO 0.11 0.68 -0.49 -0.76 0.02 0.00 0.00 177.57 177.12 1iq8 s LEU 503 N -8.19 4.22 0.33 2.57 1.43 0.80 -4.97 118.68 114.88 1iq8 s LEU 503 Ca -0.10 0.27 -0.28 0.00 -1.03 0.00 0.00 54.13 52.99 1iq8 s LEU 503 Cb 0.07 -2.08 -0.10 0.00 0.03 0.00 0.00 46.19 44.12 1iq8 s LEU 503 CO 0.92 0.23 1.25 -2.84 0.23 0.00 0.00 176.35 176.13 1iq8 s PRO 504 N 0.08 4.37 0.45 1.29 0.02 -1.26 -4.72 135.00 135.23 1iq8 s PRO 504 Ca 0.09 2.10 -0.24 0.00 0.02 0.00 0.00 61.00 62.97 1iq8 s PRO 504 Cb -0.11 -3.05 -0.09 0.00 0.02 0.00 0.00 34.50 31.27 1iq8 s PRO 504 CO -0.01 -0.13 1.08 0.98 -0.33 0.00 0.00 177.00 178.60 1iq8 n TYR 505 N 0.79 1.41 -0.24 6.54 9.36 -1.26 -1.44 117.16 132.31 1iq8 n TYR 505 Ca 0.00 0.52 0.08 0.00 3.32 0.00 0.00 57.90 61.82 1iq8 n TYR 505 Cb 0.43 -2.26 0.30 0.00 -0.63 0.00 0.00 39.34 37.18 1iq8 n TYR 505 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1iq8 n PRO 506 N -0.11 3.33 -1.63 2.98 -0.04 -1.26 -5.12 135.00 133.15 1iq8 n PRO 506 Ca 0.09 -2.37 -0.56 0.00 -0.04 0.00 0.00 63.50 60.62 1iq8 n PRO 506 Cb 0.41 -1.81 -0.07 0.00 -0.04 0.00 0.00 33.50 31.98 1iq8 n PRO 506 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1iq8 n ARG 507 N 0.87 1.14 -0.85 0.54 1.74 -0.52 -0.92 116.66 118.65 1iq8 n ARG 507 Ca 0.21 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.69 1iq8 n ARG 507 Cb 0.78 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 1iq8 n ARG 507 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1iq8 n MET 508 N 6.17 -0.05 -3.15 5.56 2.81 -1.26 -4.90 117.12 122.30 1iq8 n MET 508 Ca 0.31 0.01 -0.36 0.00 -1.81 0.00 0.00 57.70 55.85 1iq8 n MET 508 Cb 0.15 -3.18 -0.06 0.00 -0.71 0.00 0.00 33.22 29.42 1iq8 n MET 508 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1iq8 s ARG 509 N -0.35 4.21 -0.19 0.03 3.00 -0.10 0.33 118.95 125.88 1iq8 s ARG 509 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 55.73 56.54 1iq8 s ARG 509 Cb 0.00 -2.91 0.05 0.00 0.00 0.00 0.00 34.95 32.08 1iq8 s ARG 509 CO 0.00 0.42 -0.07 0.14 0.00 0.00 0.00 175.30 175.79 1iq8 s VAL 510 N -1.49 1.36 -0.26 3.52 -7.23 -0.88 -1.37 120.40 114.04 1iq8 s VAL 510 Ca 0.41 -0.86 -0.16 0.00 -1.81 0.00 0.00 61.98 59.56 1iq8 s VAL 510 Cb -0.17 -1.52 -0.03 0.00 0.56 0.00 0.00 36.38 35.22 1iq8 s VAL 510 CO 0.21 0.10 0.45 -0.69 -0.31 0.00 0.00 175.10 174.86 1iq8 s VAL 511 N 1.51 5.12 0.50 1.32 1.01 0.19 -1.31 120.40 128.75 1iq8 s VAL 511 Ca -0.01 0.74 0.08 0.00 0.00 0.00 0.00 61.98 62.79 1iq8 s VAL 511 Cb -0.16 -3.77 0.03 0.00 0.00 0.00 0.00 36.38 32.48 1iq8 s VAL 511 CO -0.08 0.12 0.54 0.68 0.00 0.00 0.00 175.10 176.37 1iq8 s VAL 512 N 2.16 2.25 1.10 2.92 -7.23 -0.80 0.10 120.40 120.90 1iq8 s VAL 512 Ca 0.18 -1.23 -0.13 0.00 -1.81 0.00 0.00 61.98 58.99 1iq8 s VAL 512 Cb -0.16 -2.49 0.25 0.00 0.56 0.00 0.00 36.38 34.55 1iq8 s VAL 512 CO 0.09 0.00 1.06 0.20 -0.31 0.00 0.00 175.10 176.14 1iq8 s ASN 513 N -4.37 1.61 0.22 4.85 0.01 0.18 -4.47 114.94 112.96 1iq8 s ASN 513 Ca 0.49 1.29 0.15 0.00 -0.71 0.00 0.00 52.86 54.09 1iq8 s ASN 513 Cb -0.05 -2.01 0.00 0.00 0.41 0.00 0.00 41.25 39.60 1iq8 s ASN 513 CO 0.30 -3.78 1.27 0.11 -1.51 0.00 0.00 177.10 173.49 1iq8 h LYS 514 N -2.33 0.00 0.00 -0.60 6.56 -2.00 -1.23 116.57 116.97 1iq8 h LYS 514 Ca -0.59 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.00 1iq8 h LYS 514 Cb 1.34 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.00 1iq8 h LYS 514 CO 0.54 0.44 0.00 1.49 -2.06 0.00 0.00 179.45 179.86 1iq8 h GLU 515 N 0.00 0.00 0.00 3.15 4.81 -1.96 -3.20 114.58 117.38 1iq8 h GLU 515 Ca -0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1iq8 h GLU 515 Cb 1.43 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.81 1iq8 h GLU 515 CO 0.06 0.00 -1.15 0.00 -0.73 0.00 0.00 179.01 177.19 1iq8 n ALA 516 N -1.84 2.87 -0.17 2.92 0.00 -1.15 -4.64 120.51 118.50 1iq8 n ALA 516 Ca 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 53.44 53.17 1iq8 n ALA 516 Cb 0.41 -0.41 0.08 0.00 0.00 0.00 0.00 19.45 19.52 1iq8 n ALA 516 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1iq8 h GLU 517 N 0.00 0.15 0.24 0.00 4.81 -1.21 -1.18 114.58 117.38 1iq8 h GLU 517 Ca 0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1iq8 h GLU 517 Cb 0.44 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 1iq8 h GLU 517 CO 0.00 0.10 -0.14 -1.35 -0.73 0.00 0.00 179.01 176.89 1iq8 h PRO 518 N 0.15 -0.35 -0.85 0.92 0.11 -1.82 -2.08 132.00 128.08 1iq8 h PRO 518 Ca 0.27 0.02 0.12 0.00 0.11 0.00 0.00 66.00 66.52 1iq8 h PRO 518 Cb 0.41 0.08 -0.06 0.00 0.11 0.00 0.00 31.00 31.54 1iq8 h PRO 518 CO -0.42 -0.23 0.55 0.74 -0.21 0.00 0.00 178.00 178.42 1iq8 h PHE 519 N -0.37 0.82 -0.03 0.65 -1.00 -1.76 -1.82 116.94 113.45 1iq8 h PHE 519 Ca -0.02 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1iq8 h PHE 519 Cb 0.30 -0.26 -0.00 0.00 3.61 0.00 0.00 35.95 39.60 1iq8 h PHE 519 CO -0.08 0.35 0.01 0.00 -1.61 0.00 0.00 178.31 176.98 1iq8 h ALA 520 N 1.59 0.04 -0.97 2.45 0.00 -0.90 -1.15 119.26 120.32 1iq8 h ALA 520 Ca 0.41 -0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.39 1iq8 h ALA 520 Cb 0.56 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.25 1iq8 h ALA 520 CO -0.17 -0.37 0.61 0.00 0.00 0.00 0.00 179.25 179.32 1iq8 h ARG 521 N -0.14 0.72 0.00 0.00 3.08 -0.64 0.32 114.38 117.72 1iq8 h ARG 521 Ca 0.01 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 1iq8 h ARG 521 Cb 0.19 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1iq8 h ARG 521 CO -0.00 0.48 -0.34 0.87 -1.07 0.00 0.00 179.97 179.90 1iq8 h LYS 522 N 0.74 0.00 0.00 0.04 6.56 -1.33 0.24 116.57 122.82 1iq8 h LYS 522 Ca 0.53 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.12 1iq8 h LYS 522 Cb 0.84 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.50 1iq8 h LYS 522 CO -0.30 0.34 0.00 0.41 -2.06 0.00 0.00 179.45 177.84 1iq8 n GLY 523 N 0.02 1.50 3.79 3.86 0.00 0.11 -4.33 105.19 110.15 1iq8 n GLY 523 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1iq8 n GLY 523 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iq8 s LYS 524 N -0.07 4.47 0.58 1.61 -0.14 -0.46 -4.70 119.74 121.03 1iq8 s LYS 524 Ca 0.00 1.21 -0.19 0.00 -1.36 0.00 0.00 55.97 55.63 1iq8 s LYS 524 Cb 0.00 -2.73 -0.06 0.00 -1.68 0.00 0.00 37.83 33.36 1iq8 s LYS 524 CO 0.00 0.26 0.97 -0.25 -0.76 0.00 0.00 175.35 175.57 1iq8 n ASP 525 N 0.43 0.83 -4.65 2.83 8.00 -1.26 -4.41 116.55 118.31 1iq8 n ASP 525 Ca 0.02 0.83 -0.38 0.00 0.71 0.00 0.00 54.79 55.97 1iq8 n ASP 525 Cb 0.51 -1.38 -0.08 0.00 -0.02 0.00 0.00 41.12 40.14 1iq8 n ASP 525 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1iq8 s VAL 526 N -1.49 5.23 0.02 2.53 1.01 -0.81 -4.93 120.40 121.96 1iq8 s VAL 526 Ca 0.74 0.55 -0.13 0.00 0.00 0.00 0.00 61.98 63.14 1iq8 s VAL 526 Cb -0.43 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 1iq8 s VAL 526 CO 0.49 0.25 0.40 -0.36 0.00 0.00 0.00 175.10 175.87 1iq8 s PHE 527 N 1.45 3.69 0.25 5.22 0.40 -1.26 -0.17 117.98 127.56 1iq8 s PHE 527 Ca 0.15 0.92 -0.07 0.00 -0.60 0.00 0.00 56.93 57.33 1iq8 s PHE 527 Cb -0.15 -2.24 0.43 0.00 0.51 0.00 0.00 43.02 41.57 1iq8 s PHE 527 CO 0.08 0.62 1.62 0.00 0.70 0.00 0.00 175.22 178.23 1iq8 h ALA 528 N 4.46 0.74 0.00 5.36 0.00 -1.52 -1.38 119.26 126.92 1iq8 h ALA 528 Ca -0.51 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1iq8 h ALA 528 Cb 1.21 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1iq8 h ALA 528 CO 0.62 -0.43 0.00 0.36 0.00 0.00 0.00 179.25 179.80 1iq8 n LYS 529 N -5.41 0.08 0.00 0.00 2.85 -1.24 -0.99 118.16 113.45 1iq8 n LYS 529 Ca 0.14 0.12 0.05 0.00 -1.05 0.00 0.00 58.31 57.56 1iq8 n LYS 529 Cb 0.48 -1.50 -0.00 0.00 -0.65 0.00 0.00 35.03 33.35 1iq8 n LYS 529 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1iq8 n PHE 530 N -1.13 0.00 -3.04 5.58 3.01 -0.52 -4.93 117.46 116.44 1iq8 n PHE 530 Ca 0.02 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.07 1iq8 n PHE 530 Cb 0.02 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.43 1iq8 n PHE 530 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1iq8 s VAL 531 N -1.44 4.94 -0.12 -4.37 1.01 -0.16 0.48 120.40 120.73 1iq8 s VAL 531 Ca 0.09 1.29 0.19 0.00 0.00 0.00 0.00 61.98 63.55 1iq8 s VAL 531 Cb 0.09 -4.00 -0.25 0.00 0.00 0.00 0.00 36.38 32.22 1iq8 s VAL 531 CO 0.28 0.01 0.41 2.30 0.00 0.00 0.00 175.10 178.10 1iq8 n ILE 532 N 5.09 0.86 -3.57 2.22 -5.35 0.11 -4.67 119.36 114.05 1iq8 n ILE 532 Ca 0.01 -0.69 -0.15 0.00 -0.27 0.00 0.00 62.75 61.66 1iq8 n ILE 532 Cb 0.49 -0.37 -0.06 0.00 -1.74 0.00 0.00 39.64 37.96 1iq8 n ILE 532 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1iq8 s PHE 533 N -2.96 -0.45 -0.14 4.28 5.36 -1.13 -4.95 117.98 117.98 1iq8 s PHE 533 Ca -0.07 0.58 -0.24 0.00 -0.96 0.00 0.00 56.93 56.23 1iq8 s PHE 533 Cb 0.09 0.34 0.06 0.00 -0.34 0.00 0.00 43.02 43.18 1iq8 s PHE 533 CO 0.85 -0.63 0.61 0.00 -1.46 0.00 0.00 175.22 174.60 1iq8 s ALA 534 N -2.17 -1.55 -0.01 11.12 0.00 -1.26 0.57 121.76 128.46 1iq8 s ALA 534 Ca -0.07 1.44 -0.36 0.00 0.00 0.00 0.00 51.96 52.98 1iq8 s ALA 534 Cb -0.01 -0.53 -0.14 0.00 0.00 0.00 0.00 23.12 22.44 1iq8 s ALA 534 CO 0.01 -0.32 1.65 -3.47 0.00 0.00 0.00 175.76 173.63 1iq8 n ASP 535 N 1.90 2.78 0.26 0.00 2.03 -0.47 -4.66 116.55 118.39 1iq8 n ASP 535 Ca -0.17 1.05 0.11 0.00 0.52 0.00 0.00 54.79 56.31 1iq8 n ASP 535 Cb 0.56 -1.31 0.71 0.00 -0.72 0.00 0.00 41.12 40.36 1iq8 n ASP 535 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1iq8 h PRO 536 N 6.90 0.00 0.00 -0.67 0.11 -1.91 -2.33 132.00 134.10 1iq8 h PRO 536 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1iq8 h PRO 536 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1iq8 h PRO 536 CO 0.90 0.11 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 1iq8 n GLY 537 N -0.87 -1.21 3.75 -0.55 0.00 -1.26 -4.49 105.19 100.55 1iq8 n GLY 537 Ca -0.02 0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1iq8 n GLY 537 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iq8 s ILE 538 N -3.34 2.74 0.21 -0.61 1.01 -0.87 -4.94 121.20 115.40 1iq8 s ILE 538 Ca 0.03 0.63 0.11 0.00 0.00 0.00 0.00 60.65 61.43 1iq8 s ILE 538 Cb 0.09 -3.40 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 1iq8 s ILE 538 CO 0.36 0.11 -0.23 -0.13 0.00 0.00 0.00 174.94 175.05 1iq8 s ARG 539 N -0.48 1.55 0.21 2.79 1.81 -1.26 -2.16 118.95 121.41 1iq8 s ARG 539 Ca 0.58 -1.59 -0.32 0.00 -1.72 0.00 0.00 55.73 52.68 1iq8 s ARG 539 Cb -0.41 -1.81 -0.15 0.00 -0.45 0.00 0.00 34.95 32.13 1iq8 s ARG 539 CO 0.44 0.38 1.25 -2.30 -0.68 0.00 0.00 175.30 174.38 1iq8 n PRO 540 N 0.04 1.52 -1.00 3.54 -0.02 -1.25 -1.87 135.00 135.96 1iq8 n PRO 540 Ca -0.11 0.54 -0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1iq8 n PRO 540 Cb 0.57 -2.09 -0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1iq8 n PRO 540 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1iq8 n TYR 541 N 1.56 0.00 -1.60 6.00 0.53 0.16 -1.20 117.16 122.61 1iq8 n TYR 541 Ca 0.13 0.00 -0.30 0.00 -1.02 0.00 0.00 57.90 56.71 1iq8 n TYR 541 Cb 0.28 -0.25 0.08 0.00 -1.03 0.00 0.00 39.34 38.41 1iq8 n TYR 541 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 1iq8 s ASP 542 N -2.02 4.78 0.02 7.72 1.01 -0.78 -4.66 116.67 122.74 1iq8 s ASP 542 Ca 0.00 1.34 -0.24 0.00 0.71 0.00 0.00 52.55 54.36 1iq8 s ASP 542 Cb 0.00 -2.11 -0.05 0.00 1.01 0.00 0.00 42.92 41.77 1iq8 s ASP 542 CO 0.00 -1.79 0.72 -1.61 0.21 0.00 0.00 175.17 172.70 1iq8 s GLU 543 N -5.16 4.45 0.10 8.23 0.41 -1.26 -1.13 118.70 124.34 1iq8 s GLU 543 Ca 0.60 0.97 0.06 0.00 -0.41 0.00 0.00 54.97 56.19 1iq8 s GLU 543 Cb -0.14 -3.37 -0.03 0.00 -1.78 0.00 0.00 34.13 28.81 1iq8 s GLU 543 CO 0.54 0.28 -0.16 0.08 -0.49 0.00 0.00 175.26 175.51 1iq8 s VAL 544 N 0.02 1.35 -0.45 2.63 1.01 0.93 -4.91 120.40 120.97 1iq8 s VAL 544 Ca 0.37 -1.53 -0.13 0.00 0.00 0.00 0.00 61.98 60.69 1iq8 s VAL 544 Cb -0.20 -1.37 0.08 0.00 0.00 0.00 0.00 36.38 34.90 1iq8 s VAL 544 CO 0.21 -0.26 0.34 -0.76 0.00 0.00 0.00 175.10 174.63 1iq8 s LEU 545 N -2.06 5.47 0.02 3.92 1.43 0.15 -1.88 118.68 125.72 1iq8 s LEU 545 Ca 0.04 -1.45 -0.30 0.00 -1.03 0.00 0.00 54.13 51.39 1iq8 s LEU 545 Cb -0.08 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.99 1iq8 s LEU 545 CO 0.03 -0.62 1.30 -0.69 0.23 0.00 0.00 176.35 176.60 1iq8 s VAL 546 N 1.54 3.87 0.08 -1.59 1.01 -0.37 -2.07 120.40 122.87 1iq8 s VAL 546 Ca 0.04 1.28 -0.05 0.00 0.00 0.00 0.00 61.98 63.25 1iq8 s VAL 546 Cb -0.24 -3.82 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 1iq8 s VAL 546 CO 0.04 0.04 0.10 0.54 0.00 0.00 0.00 175.10 175.82 1iq8 s VAL 547 N 1.82 0.17 0.53 2.92 0.11 -0.43 0.11 120.40 125.63 1iq8 s VAL 547 Ca 0.61 -1.49 0.04 0.00 -2.93 0.00 0.00 61.98 58.21 1iq8 s VAL 547 Cb -0.30 -1.48 0.10 0.00 -1.53 0.00 0.00 36.38 33.17 1iq8 s VAL 547 CO 0.27 -0.76 0.73 -0.46 -3.33 0.00 0.00 175.10 171.54 1iq8 n ASN 548 N -0.00 1.41 0.32 3.54 0.23 -1.09 -1.91 115.26 117.75 1iq8 n ASN 548 Ca -0.14 -2.09 0.20 0.00 -0.53 0.00 0.00 54.58 52.02 1iq8 n ASN 548 Cb 0.62 -0.43 1.05 0.00 -2.08 0.00 0.00 39.78 38.94 1iq8 n ASN 548 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1iq8 h GLU 549 N 0.00 0.00 -0.46 -3.83 5.08 -1.93 -0.10 114.58 113.34 1iq8 h GLU 549 Ca -0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1iq8 h GLU 549 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1iq8 h GLU 549 CO 0.30 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.40 1iq8 n ASN 550 N -3.23 2.69 -2.95 1.42 3.02 -1.26 -4.92 115.26 110.03 1iq8 n ASN 550 Ca -0.02 -1.96 -0.19 0.00 -0.03 0.00 0.00 54.58 52.37 1iq8 n ASN 550 Cb 0.17 -0.31 0.06 0.00 -0.61 0.00 0.00 39.78 39.10 1iq8 n ASN 550 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1iq8 n ASP 551 N 0.97 -5.56 -4.64 6.41 4.64 -0.05 -5.00 116.55 113.32 1iq8 n ASP 551 Ca 0.17 -0.41 -0.38 0.00 -1.38 0.00 0.00 54.79 52.79 1iq8 n ASP 551 Cb 0.44 -4.20 -0.09 0.00 -1.04 0.00 0.00 41.12 36.23 1iq8 n ASP 551 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1iq8 s GLU 552 N -5.99 4.09 0.09 -0.67 2.02 -1.26 -4.88 118.70 112.10 1iq8 s GLU 552 Ca 0.45 0.02 -0.32 0.00 0.02 0.00 0.00 54.97 55.14 1iq8 s GLU 552 Cb -0.20 -3.58 -0.11 0.00 0.10 0.00 0.00 34.13 30.34 1iq8 s GLU 552 CO 0.55 -0.10 1.83 -0.11 0.02 0.00 0.00 175.26 177.45 1iq8 n LEU 553 N 4.73 3.85 -0.05 1.80 7.94 -1.26 -2.66 117.00 131.36 1iq8 n LEU 553 Ca -0.10 0.99 -0.02 0.00 -1.11 0.00 0.00 56.01 55.77 1iq8 n LEU 553 Cb 0.51 -1.50 -0.11 0.00 0.53 0.00 0.00 43.42 42.85 1iq8 n LEU 553 CO 0.38 0.09 -0.84 0.18 -1.11 0.00 0.00 177.39 176.08 1iq8 n LEU 554 N 5.71 0.00 0.00 -1.96 4.77 0.12 -4.83 117.00 120.80 1iq8 n LEU 554 Ca 0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1iq8 n LEU 554 Cb 0.35 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1iq8 n LEU 554 CO 0.67 0.22 0.00 0.00 -1.33 0.00 0.00 177.39 176.95 1iq8 n ALA 555 N -2.32 0.00 -2.38 -1.18 0.00 -1.09 -1.20 120.51 112.34 1iq8 n ALA 555 Ca -0.15 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.15 1iq8 n ALA 555 Cb 0.74 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.09 1iq8 n ALA 555 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1iq8 s THR 556 N -2.32 0.98 0.00 0.00 2.01 -0.61 -1.23 115.64 114.46 1iq8 s THR 556 Ca 0.00 -1.80 0.00 0.00 0.31 0.00 0.00 61.69 60.20 1iq8 s THR 556 Cb 0.00 -1.54 0.00 0.00 0.01 0.00 0.00 72.50 70.97 1iq8 s THR 556 CO 0.00 -0.65 0.00 0.61 -0.69 0.00 0.00 174.62 173.89 1iq8 n GLY 557 N 0.27 0.75 3.21 4.40 0.00 -0.79 -1.21 105.19 111.82 1iq8 n GLY 557 Ca -0.14 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 1iq8 n GLY 557 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1iq8 s GLN 558 N -1.22 2.41 0.44 1.61 0.74 -0.41 -0.05 119.66 123.19 1iq8 s GLN 558 Ca 0.00 -0.80 -0.22 0.00 0.05 0.00 0.00 55.36 54.39 1iq8 s GLN 558 Cb 0.00 -1.99 -0.09 0.00 1.10 0.00 0.00 33.01 32.02 1iq8 s GLN 558 CO 0.00 0.28 1.01 0.00 -0.55 0.00 0.00 175.29 176.04 1iq8 s ALA 559 N 0.04 2.99 -0.19 1.58 0.00 -0.28 0.56 121.76 126.47 1iq8 s ALA 559 Ca -0.08 0.58 0.12 0.00 0.00 0.00 0.00 51.96 52.58 1iq8 s ALA 559 Cb -0.14 -3.23 -0.17 0.00 0.00 0.00 0.00 23.12 19.58 1iq8 s ALA 559 CO 0.04 -0.14 0.34 1.28 0.00 0.00 0.00 175.76 177.29 1iq8 n LEU 560 N -0.53 0.18 -4.38 0.00 4.77 -0.28 0.36 117.00 117.12 1iq8 n LEU 560 Ca 0.07 -0.16 -0.19 0.00 -0.03 0.00 0.00 56.01 55.70 1iq8 n LEU 560 Cb 0.52 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 1iq8 n LEU 560 CO 0.41 0.04 -0.30 -0.76 -1.33 0.00 0.00 177.39 175.45 1iq8 s LEU 561 N -3.44 2.12 0.63 2.23 1.43 -1.25 -4.66 118.68 115.74 1iq8 s LEU 561 Ca -0.02 -1.30 -0.11 0.00 -1.03 0.00 0.00 54.13 51.67 1iq8 s LEU 561 Cb 0.08 -0.29 -0.03 0.00 0.03 0.00 0.00 46.19 45.98 1iq8 s LEU 561 CO 0.50 -0.57 1.03 -0.94 0.23 0.00 0.00 176.35 176.60 1iq8 s SER 562 N -3.38 6.08 0.19 2.29 1.04 -1.26 -3.89 113.70 114.78 1iq8 s SER 562 Ca 0.33 1.34 -0.12 0.00 0.48 0.00 0.00 55.95 57.98 1iq8 s SER 562 Cb 0.07 -2.36 0.22 0.00 0.10 0.00 0.00 66.02 64.06 1iq8 s SER 562 CO 0.12 -0.95 1.70 1.23 0.98 0.00 0.00 173.24 176.33 1iq8 h GLY 563 N -0.36 0.62 0.68 7.32 0.00 -1.56 -1.10 103.07 108.67 1iq8 h GLY 563 Ca -0.44 0.01 0.05 0.00 0.00 0.00 0.00 47.33 46.94 1iq8 h GLY 563 CO 0.62 -0.11 0.23 -0.09 0.00 0.00 0.00 176.54 177.20 1iq8 h ARG 564 N 0.20 0.44 -0.72 4.80 2.43 -1.82 -2.52 114.38 117.20 1iq8 h ARG 564 Ca 0.27 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.35 1iq8 h ARG 564 Cb 0.39 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1iq8 h ARG 564 CO -0.38 0.29 0.20 0.93 -1.51 0.00 0.00 179.97 179.50 1iq8 h GLU 565 N 0.46 1.13 -0.85 0.20 5.08 -1.72 -2.80 114.58 116.07 1iq8 h GLU 565 Ca 0.22 -0.26 0.15 0.00 -1.00 0.00 0.00 59.36 58.48 1iq8 h GLU 565 Cb 0.16 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 1iq8 h GLU 565 CO -0.18 0.98 0.55 0.52 -1.00 0.00 0.00 179.01 179.89 1iq8 h MET 566 N 1.08 0.56 0.15 2.33 2.86 -0.79 -0.95 114.93 120.17 1iq8 h MET 566 Ca 0.23 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 1iq8 h MET 566 Cb 0.34 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.87 1iq8 h MET 566 CO -0.00 0.37 -0.07 0.82 1.06 0.00 0.00 176.91 179.09 1iq8 h ILE 567 N 0.58 0.98 0.00 -1.22 2.04 -1.37 -3.35 117.51 115.17 1iq8 h ILE 567 Ca 0.43 -0.98 -0.14 0.00 1.00 0.00 0.00 64.86 65.17 1iq8 h ILE 567 Cb 0.80 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.40 1iq8 h ILE 567 CO -0.18 0.21 -0.65 -0.37 0.00 0.00 0.00 178.15 177.17 1iq8 h VAL 568 N -0.71 1.36 -3.82 1.67 -1.51 -1.45 -3.45 116.25 108.34 1iq8 h VAL 568 Ca -0.02 -2.32 -0.52 0.00 -1.23 0.00 0.00 66.70 62.62 1iq8 h VAL 568 Cb 0.51 2.29 0.05 0.00 -2.13 0.00 0.00 31.29 32.00 1iq8 h VAL 568 CO 0.03 0.64 0.58 -0.36 -1.23 0.00 0.00 177.57 177.24 1iq8 s PHE 569 N -3.35 3.25 -0.23 5.19 0.40 -0.39 -4.85 117.98 118.00 1iq8 s PHE 569 Ca -0.00 1.50 0.02 0.00 -0.60 0.00 0.00 56.93 57.85 1iq8 s PHE 569 Cb 0.11 -3.54 0.05 0.00 0.51 0.00 0.00 43.02 40.16 1iq8 s PHE 569 CO 0.76 -1.40 0.93 1.04 0.70 0.00 0.00 175.22 177.24 1iq8 n GLN 570 N 1.07 2.01 -4.10 0.44 1.13 -1.26 -3.63 117.38 113.05 1iq8 n GLN 570 Ca 0.00 -1.36 -0.14 0.00 -1.94 0.00 0.00 57.00 53.56 1iq8 n GLN 570 Cb 0.43 -1.06 -0.12 0.00 0.11 0.00 0.00 30.24 29.60 1iq8 n GLN 570 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1iq8 s TYR 571 N -0.79 0.68 0.00 1.08 1.51 -1.26 -4.36 117.35 114.21 1iq8 s TYR 571 Ca 0.04 -0.41 0.00 0.00 -1.01 0.00 0.00 57.07 55.69 1iq8 s TYR 571 Cb 0.02 -0.41 0.00 0.00 -0.11 0.00 0.00 41.96 41.46 1iq8 s TYR 571 CO 0.03 -0.06 0.00 0.41 -1.11 0.00 0.00 175.55 174.83 1iq8 n GLY 572 N 1.77 -1.24 3.78 0.71 0.00 -1.26 -4.71 105.19 104.24 1iq8 n GLY 572 Ca -0.21 -1.61 -0.37 0.00 0.00 0.00 0.00 46.02 43.84 1iq8 n GLY 572 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iq8 s ARG 573 N -2.09 4.56 -0.17 1.61 0.52 -1.26 -1.46 118.95 120.66 1iq8 s ARG 573 Ca 0.00 1.31 0.01 0.00 -0.52 0.00 0.00 55.73 56.53 1iq8 s ARG 573 Cb 0.00 -2.76 -0.11 0.00 0.52 0.00 0.00 34.95 32.60 1iq8 s ARG 573 CO 0.00 0.26 -0.15 0.00 0.02 0.00 0.00 175.30 175.43 1iq8 n ALA 574 N 0.49 1.64 -2.97 2.13 0.00 0.76 -4.66 120.51 117.88 1iq8 n ALA 574 Ca 0.02 -0.72 -0.23 0.00 0.00 0.00 0.00 53.44 52.52 1iq8 n ALA 574 Cb 0.50 0.11 -0.16 0.00 0.00 0.00 0.00 19.45 19.91 1iq8 n ALA 574 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iq8 s VAL 575 N -2.34 1.04 -0.68 0.00 1.01 -0.63 -1.13 120.40 117.68 1iq8 s VAL 575 Ca -0.23 -0.50 -0.17 0.00 0.00 0.00 0.00 61.98 61.09 1iq8 s VAL 575 Cb 0.06 -0.91 0.15 0.00 0.00 0.00 0.00 36.38 35.68 1iq8 s VAL 575 CO 0.39 0.31 0.70 -0.75 0.00 0.00 0.00 175.10 175.75 1iq8 s LYS 576 N 0.12 3.24 0.07 2.72 2.20 0.19 -1.93 119.74 126.36 1iq8 s LYS 576 Ca -0.03 -1.82 -0.31 0.00 -0.36 0.00 0.00 55.97 53.45 1iq8 s LYS 576 Cb -0.10 -4.39 -0.09 0.00 -1.51 0.00 0.00 37.83 31.75 1iq8 s LYS 576 CO 0.01 -1.42 1.78 0.08 -0.36 0.00 0.00 175.35 175.44 1iq8 s VAL 577 N 1.61 2.90 -0.08 4.02 1.01 -1.26 -1.29 120.40 127.31 1iq8 s VAL 577 Ca 0.13 0.25 -0.16 0.00 0.00 0.00 0.00 61.98 62.19 1iq8 s VAL 577 Cb -0.20 -3.16 -0.29 0.00 0.00 0.00 0.00 36.38 32.73 1iq8 s VAL 577 CO -0.01 -0.01 0.66 0.03 0.00 0.00 0.00 175.10 175.78 1iq8 h ARG 578 N 9.02 0.29 -1.75 2.72 3.08 -1.47 -3.45 114.38 122.82 1iq8 h ARG 578 Ca -0.45 -0.50 0.02 0.00 0.07 0.00 0.00 59.98 59.12 1iq8 h ARG 578 Cb 1.21 0.19 -0.23 0.00 0.08 0.00 0.00 29.97 31.22 1iq8 h ARG 578 CO 0.94 1.24 0.35 0.21 -1.07 0.00 0.00 179.97 181.64 1iq8 s LYS 579 N -2.49 0.69 0.50 0.04 2.20 -1.15 -5.04 119.74 114.50 1iq8 s LYS 579 Ca -0.18 0.57 0.01 0.00 -0.36 0.00 0.00 55.97 56.01 1iq8 s LYS 579 Cb 0.04 0.33 0.02 0.00 -1.51 0.00 0.00 37.83 36.70 1iq8 s LYS 579 CO 0.80 -0.13 0.73 0.20 -0.36 0.00 0.00 175.35 176.59 1iq8 s GLY 580 N -0.19 1.70 0.34 5.54 0.00 -1.26 -1.58 107.32 111.88 1iq8 s GLY 580 Ca -0.01 -1.19 0.26 0.00 0.00 0.00 0.00 44.72 43.78 1iq8 s GLY 580 CO -0.01 -0.96 1.75 -2.08 0.00 0.00 0.00 173.10 171.80 1iq8 h VAL 581 N 0.22 0.00 -0.01 1.40 2.07 -1.01 -3.46 116.25 115.45 1iq8 h VAL 581 Ca -0.44 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1iq8 h VAL 581 Cb 1.28 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 1iq8 h VAL 581 CO 0.55 0.00 0.00 1.21 0.02 0.00 0.00 177.57 179.35