#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m24 n GLU 3 N 0.00 0.85 -0.06 5.31 4.07 -1.26 -2.82 120.64 126.73 3m24 n GLU 3 Ca 0.00 -0.05 -0.02 0.00 -0.06 0.00 0.00 57.16 57.03 3m24 n GLU 3 Cb 0.00 -1.15 -0.15 0.00 -0.06 0.00 0.00 31.44 30.07 3m24 n GLU 3 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 3m24 n LEU 4 N 1.67 0.00 -4.51 4.31 4.77 -1.26 -4.84 117.00 117.14 3m24 n LEU 4 Ca 0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.57 3m24 n LEU 4 Cb 0.42 0.30 -0.07 0.00 -2.33 0.00 0.00 43.42 41.74 3m24 n LEU 4 CO 0.01 0.30 0.34 -0.63 -1.33 0.00 0.00 177.39 176.08 3m24 s ILE 5 N -2.82 4.87 0.69 -0.08 -1.09 -1.13 -5.06 121.20 116.58 3m24 s ILE 5 Ca -0.09 0.06 -0.08 0.00 -2.23 0.00 0.00 60.65 58.31 3m24 s ILE 5 Cb 0.08 -4.18 0.04 0.00 -1.58 0.00 0.00 42.46 36.83 3m24 s ILE 5 CO 0.81 -0.56 1.03 -0.54 -1.23 0.00 0.00 174.94 174.45 3m24 s LYS 6 N 2.71 2.48 0.54 2.79 1.02 -1.26 -4.97 119.74 123.04 3m24 s LYS 6 Ca 0.21 0.01 0.23 0.00 0.02 0.00 0.00 55.97 56.44 3m24 s LYS 6 Cb -0.15 -2.13 1.41 0.00 -0.52 0.00 0.00 37.83 36.45 3m24 s LYS 6 CO 0.18 -1.12 2.07 1.05 -0.92 0.00 0.00 175.35 176.61 3m24 h GLU 7 N -0.57 0.00 -4.26 1.68 -0.00 -1.97 -3.38 114.58 106.07 3m24 h GLU 7 Ca -0.45 0.00 -0.55 0.00 -0.00 0.00 0.00 59.36 58.36 3m24 h GLU 7 Cb 1.29 0.00 -0.37 0.00 -0.00 0.00 0.00 28.75 29.67 3m24 h GLU 7 CO 0.62 0.00 -0.80 -0.80 -0.00 0.00 0.00 179.01 178.03 3m24 s ASN 8 N -6.38 2.58 0.06 3.06 -0.87 -1.26 -4.16 114.94 107.96 3m24 s ASN 8 Ca -0.05 -0.51 0.07 0.00 -1.57 0.00 0.00 52.86 50.80 3m24 s ASN 8 Cb 0.18 -0.93 -0.03 0.00 -0.02 0.00 0.00 41.25 40.44 3m24 s ASN 8 CO 0.67 -0.14 -0.15 -0.04 -2.57 0.00 0.00 177.10 174.87 3m24 s MET 9 N 1.64 2.09 0.30 -0.60 -1.94 -0.75 -5.01 119.30 115.02 3m24 s MET 9 Ca 0.03 -0.99 0.07 0.00 -1.71 0.00 0.00 55.69 53.08 3m24 s MET 9 Cb -0.14 -2.23 -0.02 0.00 2.01 0.00 0.00 34.83 34.45 3m24 s MET 9 CO -0.08 0.53 0.35 -1.01 -0.01 0.00 0.00 175.02 174.80 3m24 s HIS 10 N -1.01 3.13 -0.10 -0.03 3.76 -1.26 -2.11 115.29 117.67 3m24 s HIS 10 Ca 0.16 -0.18 -0.14 0.00 -0.15 0.00 0.00 55.06 54.76 3m24 s HIS 10 Cb -0.11 -1.73 0.03 0.00 1.11 0.00 0.00 32.58 31.88 3m24 s HIS 10 CO 0.08 0.24 0.37 0.00 -0.85 0.00 0.00 174.74 174.58 3m24 s MET 11 N -4.02 0.53 -0.03 1.40 0.23 -0.54 -0.68 119.30 116.18 3m24 s MET 11 Ca 0.39 0.30 0.05 0.00 -1.03 0.00 0.00 55.69 55.41 3m24 s MET 11 Cb -0.08 0.25 -0.01 0.00 -1.53 0.00 0.00 34.83 33.46 3m24 s MET 11 CO 0.28 -0.10 -0.20 0.15 -2.03 0.00 0.00 175.02 173.12 3m24 s LYS 12 N -0.30 1.87 -0.02 3.16 1.02 0.11 -2.29 119.74 123.28 3m24 s LYS 12 Ca -0.04 -0.71 0.04 0.00 0.02 0.00 0.00 55.97 55.27 3m24 s LYS 12 Cb -0.03 -1.68 -0.01 0.00 -0.52 0.00 0.00 37.83 35.59 3m24 s LYS 12 CO 0.02 0.35 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.50 3m24 s LEU 13 N -0.20 1.95 -0.13 3.17 0.20 -0.38 -0.21 118.68 123.07 3m24 s LEU 13 Ca 0.01 -0.24 0.03 0.00 0.69 0.00 0.00 54.13 54.62 3m24 s LEU 13 Cb -0.10 -0.68 0.01 0.00 -0.43 0.00 0.00 46.19 44.98 3m24 s LEU 13 CO 0.01 0.14 -0.22 -0.31 -0.29 0.00 0.00 176.35 175.67 3m24 s TYR 14 N -0.13 2.65 -0.04 5.38 2.02 -0.05 -2.09 117.35 125.09 3m24 s TYR 14 Ca 0.02 -1.29 0.03 0.00 -0.37 0.00 0.00 57.07 55.46 3m24 s TYR 14 Cb -0.07 -1.79 0.01 0.00 -0.40 0.00 0.00 41.96 39.70 3m24 s TYR 14 CO 0.00 -0.57 -0.11 1.41 -1.57 0.00 0.00 175.55 174.71 3m24 s MET 15 N 0.72 1.30 0.03 -0.62 -2.45 0.31 -0.29 119.30 118.28 3m24 s MET 15 Ca -0.09 -0.38 -0.02 0.00 -1.25 0.00 0.00 55.69 53.95 3m24 s MET 15 Cb -0.16 -1.15 -0.02 0.00 1.25 0.00 0.00 34.83 34.75 3m24 s MET 15 CO 0.00 0.11 0.01 -1.83 1.05 0.00 0.00 175.02 174.36 3m24 s GLU 16 N 0.32 0.42 0.00 4.11 -1.05 -0.78 0.26 118.70 121.99 3m24 s GLU 16 Ca -0.07 -0.70 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 3m24 s GLU 16 Cb -0.11 0.16 0.00 0.00 -0.44 0.00 0.00 34.13 33.73 3m24 s GLU 16 CO 0.02 -0.08 0.00 0.41 0.95 0.00 0.00 175.26 176.55 3m24 n GLY 17 N 1.22 -0.64 2.87 -3.83 0.00 -0.60 -1.06 105.19 103.14 3m24 n GLY 17 Ca -0.22 -1.10 -0.16 0.00 0.00 0.00 0.00 46.02 44.54 3m24 n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m24 s THR 18 N -3.00 0.24 -0.19 2.61 2.01 -0.72 -0.59 115.64 116.00 3m24 s THR 18 Ca 0.00 -0.03 -0.01 0.00 0.31 0.00 0.00 61.69 61.96 3m24 s THR 18 Cb 0.00 -0.27 0.00 0.00 0.01 0.00 0.00 72.50 72.24 3m24 s THR 18 CO 0.00 0.12 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.24 3m24 s VAL 19 N 0.54 2.82 0.00 3.82 1.01 -0.69 0.59 120.40 128.48 3m24 s VAL 19 Ca -0.05 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3m24 s VAL 19 Cb -0.09 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.06 3m24 s VAL 19 CO -0.01 0.48 0.00 0.47 0.00 0.00 0.00 175.10 176.04 3m24 n ASP 20 N 4.53 0.00 -0.10 3.32 8.00 0.76 -1.14 116.55 131.93 3m24 n ASP 20 Ca -0.19 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.34 3m24 n ASP 20 Cb 0.51 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.66 3m24 n ASP 20 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3m24 n ASN 21 N 8.65 1.52 -4.49 -2.24 6.94 -1.26 -4.91 115.26 119.46 3m24 n ASN 21 Ca 0.00 -2.22 -0.41 0.00 -0.02 0.00 0.00 54.58 51.93 3m24 n ASN 21 Cb 0.00 -0.18 -0.11 0.00 -2.36 0.00 0.00 39.78 37.14 3m24 n ASN 21 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 3m24 s HIS 22 N -1.35 3.23 0.21 -2.53 2.46 -0.29 -5.07 115.29 111.95 3m24 s HIS 22 Ca 0.11 -0.40 -0.27 0.00 0.47 0.00 0.00 55.06 54.96 3m24 s HIS 22 Cb 0.10 -2.48 -0.09 0.00 -0.13 0.00 0.00 32.58 29.98 3m24 s HIS 22 CO 0.01 -0.45 0.86 -1.58 -2.47 0.00 0.00 174.74 171.11 3m24 s HIS 23 N 1.68 3.94 0.02 3.88 2.46 -1.26 -1.71 115.29 124.30 3m24 s HIS 23 Ca 0.05 1.77 -0.08 0.00 0.47 0.00 0.00 55.06 57.28 3m24 s HIS 23 Cb -0.18 -2.87 -0.00 0.00 -0.13 0.00 0.00 32.58 29.40 3m24 s HIS 23 CO 0.09 0.47 0.15 -0.59 -2.47 0.00 0.00 174.74 172.39 3m24 s PHE 24 N -1.19 0.07 -0.00 3.88 -0.12 0.24 -4.34 117.98 116.52 3m24 s PHE 24 Ca 0.39 -0.24 0.06 0.00 -0.05 0.00 0.00 56.93 57.09 3m24 s PHE 24 Cb -0.24 -0.06 -0.02 0.00 -0.63 0.00 0.00 43.02 42.07 3m24 s PHE 24 CO 0.29 -0.34 -0.19 0.15 -0.05 0.00 0.00 175.22 175.08 3m24 s LYS 25 N -1.92 1.47 0.03 1.99 1.02 -0.68 -1.56 119.74 120.09 3m24 s LYS 25 Ca -0.10 -0.71 0.03 0.00 0.02 0.00 0.00 55.97 55.20 3m24 s LYS 25 Cb -0.05 -1.45 -0.02 0.00 -0.52 0.00 0.00 37.83 35.80 3m24 s LYS 25 CO -0.01 0.39 -0.10 0.00 -0.92 0.00 0.00 175.35 174.72 3m24 s THR 27 N -0.80 1.28 -0.03 0.00 -4.23 -0.27 -0.53 115.64 111.06 3m24 s THR 27 Ca -0.02 -1.32 -0.06 0.00 -1.18 0.00 0.00 61.69 59.11 3m24 s THR 27 Cb -0.07 -1.19 0.01 0.00 1.34 0.00 0.00 72.50 72.59 3m24 s THR 27 CO 0.01 -0.14 0.14 -0.94 -0.54 0.00 0.00 174.62 173.14 3m24 s SER 28 N -1.69 -0.07 0.10 3.99 1.04 -0.89 0.61 113.70 116.81 3m24 s SER 28 Ca 0.01 0.06 0.10 0.00 0.48 0.00 0.00 55.95 56.61 3m24 s SER 28 Cb -0.10 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.24 3m24 s SER 28 CO 0.03 -0.19 -0.26 -1.83 0.98 0.00 0.00 173.24 171.96 3m24 s GLU 29 N -0.57 1.48 0.00 4.02 4.04 -0.96 -1.25 118.70 125.46 3m24 s GLU 29 Ca -0.07 -1.27 0.00 0.00 0.04 0.00 0.00 54.97 53.68 3m24 s GLU 29 Cb -0.04 -1.88 0.00 0.00 0.02 0.00 0.00 34.13 32.23 3m24 s GLU 29 CO 0.01 0.46 0.00 0.41 -1.84 0.00 0.00 175.26 174.29 3m24 n GLY 30 N 1.16 1.12 3.66 -3.83 0.00 -0.97 -1.32 105.19 105.01 3m24 n GLY 30 Ca -0.18 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 3m24 n GLY 30 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3m24 s GLU 31 N -1.81 1.56 0.05 1.61 1.03 -0.85 -1.47 118.70 118.82 3m24 s GLU 31 Ca 0.00 -0.85 -0.16 0.00 0.03 0.00 0.00 54.97 53.99 3m24 s GLU 31 Cb 0.00 0.58 0.05 0.00 -0.80 0.00 0.00 34.13 33.96 3m24 s GLU 31 CO 0.00 -0.70 0.73 0.41 -1.33 0.00 0.00 175.26 174.37 3m24 n GLY 32 N -0.41 0.62 3.15 -3.83 0.00 -0.90 -0.97 105.19 102.86 3m24 n GLY 32 Ca -0.08 -1.02 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 3m24 n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m24 s LYS 33 N -2.02 2.13 0.28 1.61 3.01 -0.41 -1.81 119.74 122.53 3m24 s LYS 33 Ca 0.17 -1.72 0.01 0.00 -1.01 0.00 0.00 55.97 53.41 3m24 s LYS 33 Cb -0.01 -3.58 0.54 0.00 -1.01 0.00 0.00 37.83 33.77 3m24 s LYS 33 CO 0.02 -1.02 1.83 -1.35 0.51 0.00 0.00 175.35 175.33 3m24 h PRO 34 N 8.10 0.91 0.00 -1.68 0.11 -1.79 0.59 132.00 138.25 3m24 h PRO 34 Ca -0.15 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3m24 h PRO 34 Cb 1.05 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.96 3m24 h PRO 34 CO 0.70 0.61 -0.35 0.66 -0.21 0.00 0.00 178.00 179.40 3m24 n TYR 35 N -4.65 0.73 0.54 0.65 4.02 -1.26 -3.23 117.16 113.95 3m24 n TYR 35 Ca 0.18 0.21 0.11 0.00 -0.01 0.00 0.00 57.90 58.40 3m24 n TYR 35 Cb 0.36 -0.78 0.04 0.00 -0.02 0.00 0.00 39.34 38.94 3m24 n TYR 35 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 3m24 n GLU 36 N -2.18 0.31 -1.80 -0.72 1.02 -0.43 -4.43 120.64 112.40 3m24 n GLU 36 Ca 0.04 0.01 -0.05 0.00 -0.02 0.00 0.00 57.16 57.15 3m24 n GLU 36 Cb 0.44 -1.62 -0.01 0.00 -0.02 0.00 0.00 31.44 30.23 3m24 n GLU 36 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m24 n GLY 37 N 1.35 0.34 3.45 0.62 0.00 0.07 -4.63 105.19 106.40 3m24 n GLY 37 Ca 0.02 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.00 3m24 n GLY 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m24 s THR 38 N -2.21 2.65 -0.28 2.61 -4.23 -1.15 -0.21 115.64 112.83 3m24 s THR 38 Ca 0.00 -1.55 -0.25 0.00 -1.18 0.00 0.00 61.69 58.71 3m24 s THR 38 Cb 0.00 -2.19 0.10 0.00 1.34 0.00 0.00 72.50 71.75 3m24 s THR 38 CO 0.00 0.12 0.92 0.00 -0.54 0.00 0.00 174.62 175.12 3m24 s GLN 39 N -2.04 0.62 -0.03 3.99 -2.07 -0.77 -1.29 119.66 118.08 3m24 s GLN 39 Ca 0.16 0.75 0.04 0.00 -1.82 0.00 0.00 55.36 54.49 3m24 s GLN 39 Cb -0.10 0.30 -0.03 0.00 -1.09 0.00 0.00 33.01 32.09 3m24 s GLN 39 CO 0.08 -0.08 -0.13 0.99 -1.32 0.00 0.00 175.29 174.83 3m24 s THR 40 N 0.31 3.15 -0.02 3.63 2.01 -0.14 -0.95 115.64 123.62 3m24 s THR 40 Ca 0.02 -0.78 0.01 0.00 0.31 0.00 0.00 61.69 61.24 3m24 s THR 40 Cb -0.05 -2.27 0.02 0.00 0.01 0.00 0.00 72.50 70.21 3m24 s THR 40 CO -0.04 0.53 -0.01 -0.32 -0.69 0.00 0.00 174.62 174.09 3m24 s MET 41 N -0.94 0.30 -0.18 4.92 0.00 0.23 -2.02 119.30 121.61 3m24 s MET 41 Ca 0.13 0.03 -0.01 0.00 0.00 0.00 0.00 55.69 55.84 3m24 s MET 41 Cb -0.11 -0.43 -0.00 0.00 0.00 0.00 0.00 34.83 34.29 3m24 s MET 41 CO 0.02 -0.09 -0.12 -0.98 0.00 0.00 0.00 175.02 173.85 3m24 s ARG 42 N 0.78 3.25 -0.06 4.11 1.70 -0.44 -0.33 118.95 127.95 3m24 s ARG 42 Ca -0.08 -0.71 0.04 0.00 -0.47 0.00 0.00 55.73 54.50 3m24 s ARG 42 Cb -0.11 -2.75 -0.02 0.00 -0.57 0.00 0.00 34.95 31.50 3m24 s ARG 42 CO -0.01 -0.08 -0.16 0.42 -1.08 0.00 0.00 175.30 174.39 3m24 s ILE 43 N 1.09 2.90 -0.14 4.99 1.01 0.11 -2.26 121.20 128.89 3m24 s ILE 43 Ca 0.00 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.89 3m24 s ILE 43 Cb -0.14 -2.13 -0.00 0.00 0.01 0.00 0.00 42.46 40.19 3m24 s ILE 43 CO -0.03 0.58 -0.17 -0.54 0.00 0.00 0.00 174.94 174.77 3m24 s LYS 44 N -0.49 3.19 -0.64 2.79 1.02 0.20 -2.15 119.74 123.67 3m24 s LYS 44 Ca 0.06 -0.78 -0.27 0.00 0.02 0.00 0.00 55.97 55.01 3m24 s LYS 44 Cb -0.12 -2.54 0.03 0.00 -0.52 0.00 0.00 37.83 34.69 3m24 s LYS 44 CO 0.02 0.09 1.17 0.08 -0.92 0.00 0.00 175.35 175.79 3m24 s VAL 45 N 0.62 3.99 -0.71 3.17 1.01 -0.49 -1.11 120.40 126.88 3m24 s VAL 45 Ca -0.10 0.54 0.23 0.00 0.00 0.00 0.00 61.98 62.65 3m24 s VAL 45 Cb -0.16 -4.77 -0.15 0.00 0.00 0.00 0.00 36.38 31.30 3m24 s VAL 45 CO 0.03 -1.50 0.99 1.33 0.00 0.00 0.00 175.10 175.94 3m24 n VAL 46 N 6.44 0.09 -3.75 2.92 0.24 -0.28 -4.75 118.33 119.23 3m24 n VAL 46 Ca 0.05 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.34 62.04 3m24 n VAL 46 Cb 0.48 0.41 -0.10 0.00 -1.47 0.00 0.00 33.84 33.16 3m24 n VAL 46 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3m24 s GLU 47 N -3.15 0.50 -0.34 7.34 2.12 -0.98 -4.92 118.70 119.26 3m24 s GLU 47 Ca 0.05 0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.64 3m24 s GLU 47 Cb 0.15 0.23 0.00 0.00 0.26 0.00 0.00 34.13 34.77 3m24 s GLU 47 CO 0.82 -0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.85 3m24 n GLY 48 N 2.36 0.57 3.86 -1.50 0.00 -1.26 -1.68 105.19 107.53 3m24 n GLY 48 Ca -0.16 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 3m24 n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3m24 s GLY 49 N -2.95 2.35 0.50 -0.02 0.00 -1.26 -3.86 107.32 102.08 3m24 s GLY 49 Ca 0.00 -0.15 -0.19 0.00 0.00 0.00 0.00 44.72 44.38 3m24 s GLY 49 CO 0.00 0.05 1.02 2.56 0.00 0.00 0.00 173.10 176.73 3m24 s PRO 50 N -2.62 3.80 0.17 2.90 0.04 -1.26 -5.12 135.00 132.90 3m24 s PRO 50 Ca 0.47 1.26 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 3m24 s PRO 50 Cb -0.12 -2.10 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 3m24 s PRO 50 CO 0.20 -0.42 1.03 -0.51 0.04 0.00 0.00 177.00 177.34 3m24 s LEU 51 N -3.67 4.52 0.00 -3.56 1.43 -1.25 -4.95 118.68 111.19 3m24 s LEU 51 Ca 0.65 1.98 0.27 0.00 -1.03 0.00 0.00 54.13 56.01 3m24 s LEU 51 Cb -0.14 -3.60 1.39 0.00 0.03 0.00 0.00 46.19 43.87 3m24 s LEU 51 CO 0.23 -0.12 1.94 -0.81 0.23 0.00 0.00 176.35 177.82 3m24 n PRO 52 N 2.35 0.42 -4.38 1.29 -0.04 -1.26 -4.84 135.00 128.54 3m24 n PRO 52 Ca 0.02 0.03 -0.22 0.00 -0.04 0.00 0.00 63.50 63.28 3m24 n PRO 52 Cb 0.47 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.32 3m24 n PRO 52 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3m24 s PHE 53 N -2.54 1.97 0.03 0.54 -0.12 -1.26 -4.63 117.98 111.97 3m24 s PHE 53 Ca 0.27 -0.44 -0.35 0.00 -0.05 0.00 0.00 56.93 56.35 3m24 s PHE 53 Cb 0.18 -0.94 -0.14 0.00 -0.63 0.00 0.00 43.02 41.49 3m24 s PHE 53 CO 0.41 0.44 1.62 0.00 -0.05 0.00 0.00 175.22 177.65 3m24 n ALA 54 N -0.02 0.52 0.16 1.99 0.00 0.06 -4.85 120.51 118.37 3m24 n ALA 54 Ca -0.10 0.41 0.14 0.00 0.00 0.00 0.00 53.44 53.89 3m24 n ALA 54 Cb 0.58 -2.31 0.71 0.00 0.00 0.00 0.00 19.45 18.42 3m24 n ALA 54 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3m24 h PHE 55 N 6.62 0.00 -1.20 0.00 3.57 -1.94 -2.70 116.94 121.29 3m24 h PHE 55 Ca -0.47 0.00 0.37 0.00 3.53 0.00 0.00 57.97 61.40 3m24 h PHE 55 Cb 1.28 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 39.91 3m24 h PHE 55 CO 0.70 0.00 0.77 -0.44 -2.23 0.00 0.00 178.31 177.11 3m24 h ASP 56 N 0.00 0.33 0.96 0.41 3.45 -1.97 0.13 116.42 119.72 3m24 h ASP 56 Ca 0.10 0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.69 3m24 h ASP 56 Cb 0.44 0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 3m24 h ASP 56 CO -0.00 -0.09 0.00 0.16 -1.57 0.00 0.00 179.24 177.74 3m24 h ILE 57 N 0.20 0.00 0.00 0.35 3.07 -1.86 -2.62 117.51 116.64 3m24 h ILE 57 Ca 0.74 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 66.76 3m24 h ILE 57 Cb 2.15 1.25 0.00 0.00 -0.27 0.00 0.00 36.82 39.95 3m24 h ILE 57 CO -0.39 0.00 -1.38 0.18 -1.05 0.00 0.00 178.15 175.51 3m24 n LEU 58 N -2.59 0.50 -0.22 0.16 4.77 0.41 -4.63 117.00 115.40 3m24 n LEU 58 Ca 0.02 0.15 0.02 0.00 -0.03 0.00 0.00 56.01 56.17 3m24 n LEU 58 Cb 0.29 -0.04 0.13 0.00 -2.33 0.00 0.00 43.42 41.46 3m24 n LEU 58 CO 0.24 -0.08 0.88 0.00 -1.33 0.00 0.00 177.39 177.10 3m24 h ALA 59 N 2.09 0.74 0.00 -1.18 0.00 -1.09 0.41 119.26 120.23 3m24 h ALA 59 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3m24 h ALA 59 Cb 0.96 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3m24 h ALA 59 CO 0.00 -0.36 0.00 0.25 0.00 0.00 0.00 179.25 179.14 3m24 n THR 60 N -5.21 0.02 0.19 0.00 -2.24 -1.26 -2.31 114.28 103.47 3m24 n THR 60 Ca 0.11 0.01 0.11 0.00 -2.27 0.00 0.00 64.05 62.00 3m24 n THR 60 Cb 0.38 -0.70 -0.12 0.00 -2.10 0.00 0.00 70.33 67.80 3m24 n THR 60 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3m24 n SER 61 N -1.01 0.31 0.00 3.42 7.64 0.13 -4.88 113.62 119.23 3m24 n SER 61 Ca 0.14 -0.09 0.04 0.00 1.01 0.00 0.00 58.87 59.97 3m24 n SER 61 Cb 0.07 1.51 0.22 0.00 -1.01 0.00 0.00 64.21 65.00 3m24 n SER 61 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3m24 n PHE 62 N -2.20 0.00 0.00 1.43 3.01 -0.98 -5.00 117.46 113.73 3m24 n PHE 62 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 3m24 n PHE 62 Cb 0.52 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 3m24 n PHE 62 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3m24 n SER 66 N -1.10 0.00 0.27 4.37 7.64 -1.26 -5.07 113.62 118.47 3m24 n SER 66 Ca 0.05 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.11 3m24 n SER 66 Cb 0.04 0.00 0.82 0.00 -1.01 0.00 0.00 64.21 64.06 3m24 n SER 66 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 3m24 h LYS 67 N 0.00 0.00 0.00 1.43 1.79 -2.01 -2.28 116.57 115.50 3m24 h LYS 67 Ca 0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 3m24 h LYS 67 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 3m24 h LYS 67 CO 0.00 0.00 -0.41 1.79 -1.08 0.00 0.00 179.45 179.75 3m24 h THR 68 N 0.00 1.02 -0.95 -0.16 1.35 -1.96 -3.26 112.91 108.95 3m24 h THR 68 Ca 0.00 -1.58 -0.52 0.00 -0.55 0.00 0.00 66.41 63.76 3m24 h THR 68 Cb 0.31 1.93 -0.15 0.00 -1.73 0.00 0.00 68.15 68.51 3m24 h THR 68 CO 0.00 0.40 0.82 0.49 -0.25 0.00 0.00 175.52 176.99 3m24 n PHE 69 N -3.64 1.66 -4.06 4.73 3.01 -0.86 -4.72 117.46 113.57 3m24 n PHE 69 Ca -0.01 -2.11 -0.31 0.00 1.01 0.00 0.00 57.45 56.03 3m24 n PHE 69 Cb 0.51 -1.53 -0.16 0.00 -0.01 0.00 0.00 39.48 38.29 3m24 n PHE 69 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3m24 s ILE 70 N -1.56 1.81 -0.61 4.37 1.01 -1.20 -4.30 121.20 120.72 3m24 s ILE 70 Ca 0.59 -0.83 -0.26 0.00 0.00 0.00 0.00 60.65 60.14 3m24 s ILE 70 Cb 0.33 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 3m24 s ILE 70 CO -0.17 0.45 1.94 0.21 0.00 0.00 0.00 174.94 177.37 3m24 s ASN 71 N 1.38 5.15 -0.77 3.58 3.84 -0.90 -4.75 114.94 122.46 3m24 s ASN 71 Ca 0.04 0.40 -0.24 0.00 0.21 0.00 0.00 52.86 53.26 3m24 s ASN 71 Cb -0.13 -2.53 0.06 0.00 -0.55 0.00 0.00 41.25 38.10 3m24 s ASN 71 CO -0.11 -2.47 1.18 -1.00 -2.79 0.00 0.00 177.10 171.91 3m24 s HIS 72 N 9.56 2.53 0.84 0.43 3.76 -1.26 -0.90 115.29 130.24 3m24 s HIS 72 Ca 0.71 -0.47 -0.12 0.00 -0.15 0.00 0.00 55.06 55.04 3m24 s HIS 72 Cb -0.13 -4.49 0.12 0.00 1.11 0.00 0.00 32.58 29.19 3m24 s HIS 72 CO 0.21 -1.85 1.19 0.95 -0.85 0.00 0.00 174.74 174.38 3m24 s THR 73 N 4.76 2.06 -1.94 1.30 -4.23 -1.03 -4.41 115.64 112.15 3m24 s THR 73 Ca 0.32 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 3m24 s THR 73 Cb -0.10 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.78 3m24 s THR 73 CO 0.07 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.15 3m24 n GLN 74 N -3.37 -1.60 -2.24 3.99 6.02 -1.26 -2.24 117.38 116.67 3m24 n GLN 74 Ca 0.11 1.09 -0.18 0.00 -0.01 0.00 0.00 57.00 58.01 3m24 n GLN 74 Cb 0.60 -5.64 -0.02 0.00 1.02 0.00 0.00 30.24 26.20 3m24 n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m24 n GLY 75 N -0.76 -0.11 3.67 1.08 0.00 -1.26 -4.97 105.19 102.85 3m24 n GLY 75 Ca -0.23 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3m24 n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m24 s ILE 76 N -2.88 3.81 0.17 -0.61 1.01 -0.95 -4.95 121.20 116.80 3m24 s ILE 76 Ca 0.00 1.10 -0.34 0.00 0.00 0.00 0.00 60.65 61.41 3m24 s ILE 76 Cb 0.00 -3.71 -0.14 0.00 0.01 0.00 0.00 42.46 38.63 3m24 s ILE 76 CO 0.00 -0.05 1.56 -2.65 0.00 0.00 0.00 174.94 173.80 3m24 n PRO 77 N 6.16 2.13 -3.22 2.79 -0.02 -1.26 -4.85 135.00 136.73 3m24 n PRO 77 Ca 0.14 0.77 -0.46 0.00 -2.02 0.00 0.00 63.50 61.93 3m24 n PRO 77 Cb 0.44 -2.53 -0.02 0.00 -0.02 0.00 0.00 33.50 31.37 3m24 n PRO 77 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3m24 s ASP 78 N 0.86 6.72 0.46 2.55 -1.08 -1.26 -4.52 116.67 120.40 3m24 s ASP 78 Ca 0.78 -2.50 0.26 0.00 -0.52 0.00 0.00 52.55 50.57 3m24 s ASP 78 Cb -0.68 -2.26 1.30 0.00 -1.46 0.00 0.00 42.92 39.82 3m24 s ASP 78 CO 0.39 -0.71 1.79 0.15 0.52 0.00 0.00 175.17 177.31 3m24 h PHE 79 N 8.08 0.37 0.07 -5.34 3.57 -1.91 0.37 116.94 122.15 3m24 h PHE 79 Ca 0.12 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.50 3m24 h PHE 79 Cb 1.04 -0.11 0.01 0.00 2.79 0.00 0.00 35.95 39.68 3m24 h PHE 79 CO 1.07 0.03 -0.59 0.74 -2.23 0.00 0.00 178.31 177.32 3m24 h PHE 80 N 0.22 0.28 -0.11 0.41 -1.00 -1.90 -3.17 116.94 111.65 3m24 h PHE 80 Ca 0.57 -0.20 -0.14 0.00 2.81 0.00 0.00 57.97 61.02 3m24 h PHE 80 Cb 1.81 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 41.34 3m24 h PHE 80 CO -0.00 1.23 -0.52 0.87 -1.61 0.00 0.00 178.31 178.28 3m24 h LYS 81 N -0.66 0.32 -0.07 1.51 1.57 -1.82 -2.87 116.57 114.55 3m24 h LYS 81 Ca -0.12 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.48 3m24 h LYS 81 Cb 1.38 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.70 3m24 h LYS 81 CO 0.05 0.76 0.05 1.96 -0.57 0.00 0.00 179.45 181.71 3m24 h GLN 82 N 0.25 0.05 0.00 3.15 4.20 -1.06 -3.14 115.11 118.55 3m24 h GLN 82 Ca 0.01 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3m24 h GLN 82 Cb 1.00 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.77 3m24 h GLN 82 CO 0.08 0.03 0.00 0.43 -0.67 0.00 0.00 178.83 178.71 3m24 n SER 83 N -4.52 0.00 -4.89 1.46 7.64 -1.08 -4.80 113.62 107.42 3m24 n SER 83 Ca -0.02 -0.01 -0.30 0.00 1.01 0.00 0.00 58.87 59.55 3m24 n SER 83 Cb 0.12 -0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 62.99 3m24 n SER 83 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3m24 s PHE 84 N -2.59 3.47 -0.19 1.43 0.40 -1.19 -0.51 117.98 118.80 3m24 s PHE 84 Ca 0.21 0.88 0.26 0.00 -0.60 0.00 0.00 56.93 57.68 3m24 s PHE 84 Cb 0.15 -2.30 0.71 0.00 0.51 0.00 0.00 43.02 42.09 3m24 s PHE 84 CO 0.35 0.02 1.74 -1.00 0.70 0.00 0.00 175.22 177.03 3m24 h PRO 85 N 1.51 0.00 -0.30 0.24 0.13 -1.92 -3.47 132.00 128.19 3m24 h PRO 85 Ca -0.47 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.70 3m24 h PRO 85 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 3m24 h PRO 85 CO 0.65 0.06 0.07 1.05 -0.23 0.00 0.00 178.00 179.60 3m24 h GLU 86 N 0.00 0.18 0.00 0.86 9.09 -1.85 -3.37 114.58 119.48 3m24 h GLU 86 Ca -0.00 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.40 3m24 h GLU 86 Cb 0.85 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.91 3m24 h GLU 86 CO 0.01 0.12 0.00 0.41 0.05 0.00 0.00 179.01 179.60 3m24 n GLY 87 N -1.21 -0.36 3.36 1.06 0.00 0.33 -4.74 105.19 103.64 3m24 n GLY 87 Ca -0.00 -2.21 -0.10 0.00 0.00 0.00 0.00 46.02 43.71 3m24 n GLY 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3m24 s PHE 88 N 0.00 -0.17 0.28 1.61 -0.71 -0.77 -1.23 117.98 116.99 3m24 s PHE 88 Ca 0.00 -0.15 0.10 0.00 -1.04 0.00 0.00 56.93 55.85 3m24 s PHE 88 Cb 0.00 0.29 -0.05 0.00 -1.21 0.00 0.00 43.02 42.05 3m24 s PHE 88 CO 0.00 -0.75 -0.08 0.95 -1.34 0.00 0.00 175.22 174.00 3m24 s THR 89 N -3.82 2.94 0.04 -4.49 -4.23 0.78 0.03 115.64 106.89 3m24 s THR 89 Ca 0.05 -2.12 -0.01 0.00 -1.18 0.00 0.00 61.69 58.43 3m24 s THR 89 Cb 0.01 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 3m24 s THR 89 CO -0.10 -0.36 -0.02 -1.66 -0.54 0.00 0.00 174.62 171.95 3m24 s TRP 90 N -2.43 0.39 -0.03 3.99 1.48 -0.84 -1.25 118.94 120.25 3m24 s TRP 90 Ca 0.31 -0.81 0.01 0.00 -1.06 0.00 0.00 56.10 54.56 3m24 s TRP 90 Cb -0.05 -0.29 0.01 0.00 -1.16 0.00 0.00 33.47 31.99 3m24 s TRP 90 CO 0.18 -0.31 -0.05 -1.83 -4.06 0.00 0.00 176.95 170.89 3m24 s GLU 91 N -2.85 0.63 0.02 3.25 -1.05 -0.56 -0.43 118.70 117.70 3m24 s GLU 91 Ca -0.03 -0.13 0.01 0.00 -0.15 0.00 0.00 54.97 54.67 3m24 s GLU 91 Cb 0.00 -0.65 -0.01 0.00 -0.44 0.00 0.00 34.13 33.03 3m24 s GLU 91 CO -0.06 0.00 -0.05 0.50 0.95 0.00 0.00 175.26 176.60 3m24 s ARG 92 N 0.48 0.38 -0.11 -4.83 3.52 0.11 -0.48 118.95 118.02 3m24 s ARG 92 Ca -0.06 -0.44 0.02 0.00 -0.13 0.00 0.00 55.73 55.12 3m24 s ARG 92 Cb -0.10 -0.23 0.01 0.00 -1.56 0.00 0.00 34.95 33.08 3m24 s ARG 92 CO -0.00 0.05 -0.17 0.54 -0.81 0.00 0.00 175.30 174.91 3m24 s VAL 93 N -0.78 1.63 -0.22 7.11 0.11 -0.15 -0.92 120.40 127.18 3m24 s VAL 93 Ca -0.06 -0.72 -0.06 0.00 -2.93 0.00 0.00 61.98 58.21 3m24 s VAL 93 Cb -0.06 -1.47 -0.03 0.00 -1.53 0.00 0.00 36.38 33.29 3m24 s VAL 93 CO -0.00 0.47 0.04 -0.89 -3.33 0.00 0.00 175.10 171.38 3m24 s THR 94 N 0.93 4.18 -0.27 5.04 2.01 0.02 -1.61 115.64 125.94 3m24 s THR 94 Ca -0.07 -0.23 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 3m24 s THR 94 Cb -0.15 -2.92 0.04 0.00 0.01 0.00 0.00 72.50 69.47 3m24 s THR 94 CO -0.01 0.39 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.37 3m24 s THR 95 N 1.23 2.88 0.19 -0.82 2.01 -0.47 -1.03 115.64 119.64 3m24 s THR 95 Ca 0.04 -1.17 -0.29 0.00 0.31 0.00 0.00 61.69 60.58 3m24 s THR 95 Cb -0.15 -2.54 -0.08 0.00 0.01 0.00 0.00 72.50 69.75 3m24 s THR 95 CO 0.02 0.09 0.90 -0.31 -0.69 0.00 0.00 174.62 174.63 3m24 s TYR 96 N 1.29 3.93 0.56 4.92 1.51 0.47 -0.88 117.35 129.15 3m24 s TYR 96 Ca -0.02 1.82 0.41 0.00 -1.01 0.00 0.00 57.07 58.27 3m24 s TYR 96 Cb -0.18 -2.94 2.19 0.00 -0.11 0.00 0.00 41.96 40.92 3m24 s TYR 96 CO -0.03 0.42 2.30 0.93 -1.11 0.00 0.00 175.55 178.05 3m24 h GLU 97 N 4.52 0.00 -0.63 -0.62 5.08 -1.46 -1.67 114.58 119.81 3m24 h GLU 97 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3m24 h GLU 97 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3m24 h GLU 97 CO 0.68 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.30 3m24 n ASP 98 N -3.15 3.81 0.00 1.42 5.75 -1.26 -4.96 116.55 118.15 3m24 n ASP 98 Ca -0.02 -2.26 0.00 0.00 -0.01 0.00 0.00 54.79 52.50 3m24 n ASP 98 Cb 0.12 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 39.72 3m24 n ASP 98 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3m24 n GLY 99 N 1.14 2.17 3.67 6.12 0.00 -0.63 -4.88 105.19 112.77 3m24 n GLY 99 Ca 0.21 -0.76 -0.44 0.00 0.00 0.00 0.00 46.02 45.03 3m24 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m24 n GLY 100 N 0.00 0.50 2.88 -0.02 0.00 -1.17 -4.75 105.19 102.62 3m24 n GLY 100 Ca 0.00 0.39 -0.24 0.00 0.00 0.00 0.00 46.02 46.17 3m24 n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m24 s VAL 101 N -0.67 0.75 -0.20 1.61 1.01 -0.45 -0.40 120.40 122.06 3m24 s VAL 101 Ca 0.61 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.44 3m24 s VAL 101 Cb -0.63 -0.80 0.04 0.00 0.00 0.00 0.00 36.38 35.00 3m24 s VAL 101 CO 0.57 0.31 -0.09 -0.22 0.00 0.00 0.00 175.10 175.66 3m24 s LEU 102 N 1.52 2.20 0.08 3.92 0.20 -0.20 -0.38 118.68 126.01 3m24 s LEU 102 Ca -0.00 -0.88 -0.05 0.00 0.69 0.00 0.00 54.13 53.89 3m24 s LEU 102 Cb -0.13 -1.18 -0.05 0.00 -0.43 0.00 0.00 46.19 44.40 3m24 s LEU 102 CO -0.04 -0.16 0.33 0.42 -0.29 0.00 0.00 176.35 176.60 3m24 s THR 103 N 1.43 5.22 -0.03 3.68 -4.23 -0.37 -0.80 115.64 120.54 3m24 s THR 103 Ca -0.01 0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 60.55 3m24 s THR 103 Cb -0.16 -3.61 0.01 0.00 1.34 0.00 0.00 72.50 70.08 3m24 s THR 103 CO -0.08 0.19 0.09 0.00 -0.54 0.00 0.00 174.62 174.28 3m24 s ALA 104 N -1.49 -0.23 -0.03 3.99 0.00 -0.09 -1.54 121.76 122.37 3m24 s ALA 104 Ca 0.35 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.59 3m24 s ALA 104 Cb -0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 3m24 s ALA 104 CO 0.21 -0.05 -0.12 0.99 0.00 0.00 0.00 175.76 176.79 3m24 s THR 105 N 0.00 1.04 0.03 0.00 2.01 -0.55 0.05 115.64 118.22 3m24 s THR 105 Ca -0.00 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.49 3m24 s THR 105 Cb -0.01 -0.91 -0.02 0.00 0.01 0.00 0.00 72.50 71.58 3m24 s THR 105 CO 0.00 0.31 -0.05 -1.58 -0.69 0.00 0.00 174.62 172.61 3m24 s GLN 106 N 0.05 0.39 -0.08 4.92 -0.44 0.42 -0.34 119.66 124.59 3m24 s GLN 106 Ca -0.02 -0.60 0.03 0.00 -2.50 0.00 0.00 55.36 52.27 3m24 s GLN 106 Cb -0.09 -0.11 0.01 0.00 -1.64 0.00 0.00 33.01 31.18 3m24 s GLN 106 CO 0.01 0.01 -0.17 0.34 0.50 0.00 0.00 175.29 175.98 3m24 s ASP 107 N -1.31 2.34 -0.17 6.67 -1.08 -0.22 -1.98 116.67 120.93 3m24 s ASP 107 Ca -0.11 -0.41 -0.01 0.00 -0.52 0.00 0.00 52.55 51.50 3m24 s ASP 107 Cb -0.09 -1.08 -0.00 0.00 -1.46 0.00 0.00 42.92 40.29 3m24 s ASP 107 CO -0.00 0.08 -0.13 -0.89 0.52 0.00 0.00 175.17 174.75 3m24 s THR 108 N 0.58 2.88 0.33 1.71 2.01 0.10 -1.50 115.64 121.75 3m24 s THR 108 Ca -0.15 -0.69 0.06 0.00 0.31 0.00 0.00 61.69 61.21 3m24 s THR 108 Cb -0.17 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 3m24 s THR 108 CO 0.05 0.50 0.31 -0.94 -0.69 0.00 0.00 174.62 173.85 3m24 s SER 109 N 0.89 1.54 -0.40 3.53 1.04 -0.73 -1.84 113.70 117.73 3m24 s SER 109 Ca -0.03 -1.72 0.01 0.00 0.48 0.00 0.00 55.95 54.70 3m24 s SER 109 Cb -0.15 0.57 0.14 0.00 0.10 0.00 0.00 66.02 66.69 3m24 s SER 109 CO -0.01 -1.10 0.25 -0.22 0.98 0.00 0.00 173.24 173.15 3m24 s LEU 110 N -3.35 1.74 -0.32 2.42 2.96 -1.26 -1.00 118.68 119.86 3m24 s LEU 110 Ca 0.39 -2.52 -0.19 0.00 -0.22 0.00 0.00 54.13 51.59 3m24 s LEU 110 Cb 0.02 -0.65 -0.01 0.00 0.50 0.00 0.00 46.19 46.05 3m24 s LEU 110 CO 0.26 -0.27 0.56 -1.10 -1.32 0.00 0.00 176.35 174.49 3m24 s GLN 111 N 0.59 3.81 -0.04 1.98 -0.21 -1.11 -4.68 119.66 120.00 3m24 s GLN 111 Ca 0.20 0.10 -0.03 0.00 0.02 0.00 0.00 55.36 55.65 3m24 s GLN 111 Cb -0.19 -3.75 0.01 0.00 1.00 0.00 0.00 33.01 30.08 3m24 s GLN 111 CO -0.03 -0.57 0.06 -0.40 -2.12 0.00 0.00 175.29 172.23 3m24 n ASP 112 N 5.78 -0.84 0.00 5.90 3.85 -1.26 -2.82 116.55 127.16 3m24 n ASP 112 Ca -0.03 0.01 0.00 0.00 -0.71 0.00 0.00 54.79 54.06 3m24 n ASP 112 Cb 0.49 -0.23 0.00 0.00 -1.35 0.00 0.00 41.12 40.03 3m24 n ASP 112 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3m24 n GLY 113 N 0.23 1.69 3.86 6.12 0.00 -1.26 -4.98 105.19 110.84 3m24 n GLY 113 Ca -0.01 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 3m24 n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m24 s LEU 115 N -1.07 4.30 -0.17 0.00 1.43 0.14 -2.76 118.68 120.55 3m24 s LEU 115 Ca 0.20 1.61 -0.02 0.00 -1.03 0.00 0.00 54.13 54.88 3m24 s LEU 115 Cb -0.14 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 3m24 s LEU 115 CO 0.09 -0.38 -0.07 -0.63 0.23 0.00 0.00 176.35 175.59 3m24 s ILE 116 N 1.59 3.37 -0.10 -0.59 1.09 -0.17 0.08 121.20 126.46 3m24 s ILE 116 Ca 0.50 -0.53 0.01 0.00 -1.10 0.00 0.00 60.65 59.54 3m24 s ILE 116 Cb -0.20 -2.48 -0.02 0.00 -1.06 0.00 0.00 42.46 38.71 3m24 s ILE 116 CO 0.22 0.48 -0.14 -0.31 -0.10 0.00 0.00 174.94 175.09 3m24 s TYR 117 N 0.79 2.76 -0.23 3.97 2.02 0.71 -1.77 117.35 125.60 3m24 s TYR 117 Ca -0.03 -0.52 0.01 0.00 -0.37 0.00 0.00 57.07 56.17 3m24 s TYR 117 Cb -0.15 -1.77 0.05 0.00 -0.40 0.00 0.00 41.96 39.70 3m24 s TYR 117 CO 0.01 -0.10 -0.09 1.21 -1.57 0.00 0.00 175.55 175.02 3m24 s ASN 118 N 0.01 3.87 -0.14 2.29 3.84 -0.56 -0.87 114.94 123.37 3m24 s ASN 118 Ca -0.04 -1.14 0.01 0.00 0.21 0.00 0.00 52.86 51.90 3m24 s ASN 118 Cb -0.14 -1.30 -0.00 0.00 -0.55 0.00 0.00 41.25 39.25 3m24 s ASN 118 CO 0.04 -0.19 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.30 3m24 s VAL 119 N 1.31 2.54 -0.20 -5.21 1.01 0.60 -1.06 120.40 119.39 3m24 s VAL 119 Ca -0.05 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.06 3m24 s VAL 119 Cb -0.18 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 3m24 s VAL 119 CO -0.07 0.53 -0.04 -0.54 0.00 0.00 0.00 175.10 174.99 3m24 s LYS 120 N 0.61 3.47 -0.10 2.72 3.01 0.54 -1.86 119.74 128.13 3m24 s LYS 120 Ca -0.10 -0.59 -0.01 0.00 -1.01 0.00 0.00 55.97 54.26 3m24 s LYS 120 Cb -0.16 -2.98 -0.03 0.00 -1.01 0.00 0.00 37.83 33.65 3m24 s LYS 120 CO 0.03 -0.06 -0.07 0.42 0.51 0.00 0.00 175.35 176.18 3m24 s ILE 121 N 1.13 3.63 -0.22 2.17 -1.09 -0.23 -1.48 121.20 125.11 3m24 s ILE 121 Ca 0.02 -0.48 -0.04 0.00 -2.23 0.00 0.00 60.65 57.91 3m24 s ILE 121 Cb -0.15 -2.52 0.09 0.00 -1.58 0.00 0.00 42.46 38.30 3m24 s ILE 121 CO -0.00 0.56 0.15 -0.60 -1.23 0.00 0.00 174.94 173.81 3m24 s ARG 122 N -0.29 0.15 -0.07 2.79 3.52 -0.59 -1.75 118.95 122.71 3m24 s ARG 122 Ca 0.04 -0.14 0.01 0.00 -0.13 0.00 0.00 55.73 55.51 3m24 s ARG 122 Cb -0.13 -1.40 -0.03 0.00 -1.56 0.00 0.00 34.95 31.83 3m24 s ARG 122 CO 0.02 -0.79 -0.09 0.20 -0.81 0.00 0.00 175.30 173.83 3m24 s GLY 123 N 2.19 1.65 0.07 8.12 0.00 0.20 -1.24 107.32 118.30 3m24 s GLY 123 Ca 0.06 -0.91 0.01 0.00 0.00 0.00 0.00 44.72 43.88 3m24 s GLY 123 CO -0.19 -0.62 -0.06 -1.34 0.00 0.00 0.00 173.10 170.89 3m24 s VAL 124 N -0.64 0.48 -1.43 1.40 -7.23 0.48 -0.17 120.40 113.29 3m24 s VAL 124 Ca 0.10 -1.60 -0.05 0.00 -1.81 0.00 0.00 61.98 58.62 3m24 s VAL 124 Cb -0.11 -1.24 0.01 0.00 0.56 0.00 0.00 36.38 35.59 3m24 s VAL 124 CO 0.02 -0.75 0.62 0.59 -0.31 0.00 0.00 175.10 175.26 3m24 n ASN 125 N 0.52 -5.86 -4.58 4.85 5.03 -1.26 -1.34 115.26 112.62 3m24 n ASN 125 Ca -0.16 -0.29 -0.43 0.00 0.87 0.00 0.00 54.58 54.57 3m24 n ASN 125 Cb 0.59 -4.66 -0.04 0.00 -1.02 0.00 0.00 39.78 34.64 3m24 n ASN 125 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3m24 s PHE 126 N -3.15 3.05 0.44 3.10 0.08 -1.26 -3.05 117.98 117.18 3m24 s PHE 126 Ca 0.31 0.54 -0.23 0.00 0.12 0.00 0.00 56.93 57.67 3m24 s PHE 126 Cb -0.14 -3.63 -0.08 0.00 -0.57 0.00 0.00 43.02 38.61 3m24 s PHE 126 CO 0.38 -0.87 1.14 0.95 -0.10 0.00 0.00 175.22 176.72 3m24 s THR 127 N 3.38 3.23 0.31 0.64 -4.23 -1.26 -4.94 115.64 112.77 3m24 s THR 127 Ca 0.34 0.94 0.28 0.00 -1.18 0.00 0.00 61.69 62.07 3m24 s THR 127 Cb -0.12 -3.49 0.29 0.00 1.34 0.00 0.00 72.50 70.52 3m24 s THR 127 CO 0.20 0.01 2.00 0.28 -0.54 0.00 0.00 174.62 176.56 3m24 h SER 128 N 2.23 0.00 -0.10 3.99 0.02 -1.96 -2.40 113.55 115.33 3m24 h SER 128 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3m24 h SER 128 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 3m24 h SER 128 CO 0.61 0.14 0.00 0.59 -1.14 0.00 0.00 176.83 177.03 3m24 n ASN 129 N -3.48 2.90 -4.84 3.07 5.03 -1.26 -4.27 115.26 112.41 3m24 n ASN 129 Ca -0.01 -1.94 -0.31 0.00 0.87 0.00 0.00 54.58 53.19 3m24 n ASN 129 Cb 0.30 -0.05 0.04 0.00 -1.02 0.00 0.00 39.78 39.05 3m24 n ASN 129 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3m24 s GLY 130 N -1.90 1.66 0.54 7.41 0.00 -0.90 -4.86 107.32 109.27 3m24 s GLY 130 Ca 0.31 -0.00 0.20 0.00 0.00 0.00 0.00 44.72 45.23 3m24 s GLY 130 CO 0.31 0.30 2.18 -0.56 0.00 0.00 0.00 173.10 175.33 3m24 h PRO 131 N -0.63 0.00 -0.03 2.90 0.13 -1.93 -1.00 132.00 131.44 3m24 h PRO 131 Ca -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.68 3m24 h PRO 131 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 3m24 h PRO 131 CO 0.59 0.01 -0.01 0.28 -0.23 0.00 0.00 178.00 178.63 3m24 h VAL 132 N 0.00 1.32 0.00 1.56 2.07 -1.93 0.61 116.25 119.89 3m24 h VAL 132 Ca -0.00 -0.99 -0.12 0.00 0.82 0.00 0.00 66.70 66.41 3m24 h VAL 132 Cb 0.02 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 3m24 h VAL 132 CO 0.00 0.26 -0.59 0.24 0.02 0.00 0.00 177.57 177.51 3m24 h MET 133 N -0.32 0.00 -0.00 1.57 2.86 -1.68 0.28 114.93 117.64 3m24 h MET 133 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3m24 h MET 133 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 3m24 h MET 133 CO 0.00 0.59 -0.01 1.04 1.06 0.00 0.00 176.91 179.59 3m24 n GLN 134 N -3.46 1.05 -3.72 1.72 1.13 -0.41 -4.61 117.38 109.09 3m24 n GLN 134 Ca 0.00 -0.21 -0.25 0.00 -1.94 0.00 0.00 57.00 54.60 3m24 n GLN 134 Cb 0.68 -1.50 0.05 0.00 0.11 0.00 0.00 30.24 29.59 3m24 n GLN 134 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3m24 n LYS 135 N -0.79 -6.36 -1.33 -1.09 4.76 -0.93 -4.92 118.16 107.49 3m24 n LYS 135 Ca 0.21 0.71 -0.28 0.00 -2.87 0.00 0.00 58.31 56.08 3m24 n LYS 135 Cb 0.18 -5.61 0.11 0.00 -1.84 0.00 0.00 35.03 27.87 3m24 n LYS 135 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3m24 n LYS 136 N -4.66 2.60 -4.14 1.97 5.02 0.16 -4.97 118.16 114.15 3m24 n LYS 136 Ca -0.07 -3.31 -0.23 0.00 -2.02 0.00 0.00 58.31 52.68 3m24 n LYS 136 Cb 0.58 -2.21 -0.05 0.00 -0.02 0.00 0.00 35.03 33.33 3m24 n LYS 136 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3m24 s THR 137 N -4.26 4.28 -0.13 -0.18 -4.23 -1.26 -2.35 115.64 107.51 3m24 s THR 137 Ca 0.59 -1.42 0.23 0.00 -1.18 0.00 0.00 61.69 59.92 3m24 s THR 137 Cb 0.48 -3.28 0.46 0.00 1.34 0.00 0.00 72.50 71.51 3m24 s THR 137 CO 0.03 -0.30 1.15 0.18 -0.54 0.00 0.00 174.62 175.14 3m24 n LEU 138 N -0.94 1.44 0.00 4.79 4.77 0.66 -4.85 117.00 122.88 3m24 n LEU 138 Ca -0.08 -2.60 0.00 0.00 -0.03 0.00 0.00 56.01 53.30 3m24 n LEU 138 Cb 0.57 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 3m24 n LEU 138 CO 0.42 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 177.91 3m24 n GLY 139 N -0.07 -0.19 3.85 -0.72 0.00 -1.26 -4.69 105.19 102.10 3m24 n GLY 139 Ca 0.08 -1.74 -0.37 0.00 0.00 0.00 0.00 46.02 43.99 3m24 n GLY 139 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3m24 s TRP 140 N -2.24 3.68 0.78 1.61 0.52 -1.26 -0.74 118.94 121.29 3m24 s TRP 140 Ca 0.00 0.87 -0.12 0.00 0.02 0.00 0.00 56.10 56.88 3m24 s TRP 140 Cb 0.00 -2.20 0.07 0.00 -1.15 0.00 0.00 33.47 30.19 3m24 s TRP 140 CO 0.00 0.65 1.12 -1.21 0.02 0.00 0.00 176.95 177.53 3m24 s GLU 141 N -1.19 2.04 0.56 4.98 0.41 -0.40 -4.76 118.70 120.34 3m24 s GLU 141 Ca 0.23 1.35 -0.21 0.00 -0.41 0.00 0.00 54.97 55.94 3m24 s GLU 141 Cb -0.15 -1.86 -0.05 0.00 -1.78 0.00 0.00 34.13 30.29 3m24 s GLU 141 CO 0.12 -1.83 1.24 0.00 -0.49 0.00 0.00 175.26 174.30 3m24 n ALA 142 N -3.43 1.11 -2.76 5.21 0.00 -1.26 -4.68 120.51 114.70 3m24 n ALA 142 Ca 0.10 0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.54 3m24 n ALA 142 Cb 0.52 -2.27 -0.07 0.00 0.00 0.00 0.00 19.45 17.63 3m24 n ALA 142 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3m24 s PHE 143 N -1.34 0.63 -0.09 0.00 -0.12 -1.00 -4.87 117.98 111.19 3m24 s PHE 143 Ca 0.73 -0.95 0.02 0.00 -0.05 0.00 0.00 56.93 56.68 3m24 s PHE 143 Cb -0.43 -0.11 0.02 0.00 -0.63 0.00 0.00 43.02 41.87 3m24 s PHE 143 CO 0.49 -0.82 -0.13 0.99 -0.05 0.00 0.00 175.22 175.70 3m24 s THR 144 N -4.05 1.24 -0.04 -4.49 2.01 -1.26 -1.00 115.64 108.05 3m24 s THR 144 Ca 0.27 -0.51 -0.21 0.00 0.31 0.00 0.00 61.69 61.55 3m24 s THR 144 Cb 0.03 -1.15 -0.05 0.00 0.01 0.00 0.00 72.50 71.34 3m24 s THR 144 CO 0.08 0.39 0.60 -0.70 -0.69 0.00 0.00 174.62 174.29 3m24 s GLU 145 N 0.91 4.34 -0.14 4.92 2.12 -0.49 -4.68 118.70 125.68 3m24 s GLU 145 Ca -0.09 0.72 -0.16 0.00 0.36 0.00 0.00 54.97 55.80 3m24 s GLU 145 Cb -0.15 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 3m24 s GLU 145 CO 0.01 0.27 0.37 0.99 -0.54 0.00 0.00 175.26 176.36 3m24 s THR 146 N 0.14 5.25 -0.01 -1.70 2.01 0.28 -1.06 115.64 120.55 3m24 s THR 146 Ca 0.32 0.72 0.07 0.00 0.31 0.00 0.00 61.69 63.11 3m24 s THR 146 Cb -0.18 -3.71 -0.02 0.00 0.01 0.00 0.00 72.50 68.60 3m24 s THR 146 CO 0.16 0.36 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.46 3m24 s LEU 147 N 0.53 2.20 -0.00 4.42 1.43 0.29 -1.06 118.68 126.49 3m24 s LEU 147 Ca 0.21 -0.44 -0.18 0.00 -1.03 0.00 0.00 54.13 52.69 3m24 s LEU 147 Cb -0.14 -1.38 0.03 0.00 0.03 0.00 0.00 46.19 44.74 3m24 s LEU 147 CO 0.07 0.31 0.39 -0.72 0.23 0.00 0.00 176.35 176.64 3m24 s TYR 148 N -0.67 -0.28 0.20 0.29 1.13 -0.77 -1.25 117.35 116.01 3m24 s TYR 148 Ca 0.11 0.38 -0.30 0.00 -1.41 0.00 0.00 57.07 55.85 3m24 s TYR 148 Cb -0.10 0.18 -0.09 0.00 -1.10 0.00 0.00 41.96 40.85 3m24 s TYR 148 CO -0.00 -0.48 1.32 -1.25 -2.51 0.00 0.00 175.55 172.63 3m24 s PRO 149 N -1.64 4.38 0.21 -3.49 0.04 -1.26 -0.80 135.00 132.44 3m24 s PRO 149 Ca -0.11 2.06 -0.23 0.00 0.04 0.00 0.00 61.00 62.76 3m24 s PRO 149 Cb -0.03 -3.20 0.04 0.00 0.04 0.00 0.00 34.50 31.36 3m24 s PRO 149 CO 0.03 -0.27 0.77 0.00 0.04 0.00 0.00 177.00 177.57 3m24 s ALA 150 N 0.16 -1.43 0.00 8.56 0.00 -0.37 -4.86 121.76 123.81 3m24 s ALA 150 Ca 0.57 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.56 3m24 s ALA 150 Cb -0.37 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.53 3m24 s ALA 150 CO 0.38 -0.97 0.00 -0.25 0.00 0.00 0.00 175.76 174.92 3m24 n ASP 151 N -0.43 0.00 -0.01 0.00 10.43 -1.26 -0.77 116.55 124.51 3m24 n ASP 151 Ca -0.07 0.00 0.08 0.00 2.57 0.00 0.00 54.79 57.37 3m24 n ASP 151 Cb 0.61 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 43.44 3m24 n ASP 151 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3m24 n GLY 152 N 0.00 -0.73 0.00 0.44 0.00 -1.26 -5.05 105.19 98.58 3m24 n GLY 152 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 3m24 n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m24 n GLY 153 N 1.52 4.21 3.49 -0.02 0.00 0.05 -4.92 105.19 109.52 3m24 n GLY 153 Ca -0.02 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 3m24 n GLY 153 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m24 s LEU 154 N 0.00 2.75 -0.03 0.99 1.43 -0.57 -1.24 118.68 122.01 3m24 s LEU 154 Ca 0.00 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 52.77 3m24 s LEU 154 Cb 0.00 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 3m24 s LEU 154 CO 0.00 0.25 -0.15 -1.61 0.23 0.00 0.00 176.35 175.07 3m24 s GLU 155 N -1.51 2.42 -0.04 1.70 0.41 0.02 0.48 118.70 122.18 3m24 s GLU 155 Ca 0.16 -0.75 0.05 0.00 -0.41 0.00 0.00 54.97 54.01 3m24 s GLU 155 Cb -0.11 -2.34 -0.02 0.00 -1.78 0.00 0.00 34.13 29.88 3m24 s GLU 155 CO 0.06 0.61 -0.17 0.20 -0.49 0.00 0.00 175.26 175.48 3m24 s GLY 156 N -0.84 1.48 0.02 -1.39 0.00 0.01 -1.84 107.32 104.76 3m24 s GLY 156 Ca 0.12 -1.01 0.01 0.00 0.00 0.00 0.00 44.72 43.84 3m24 s GLY 156 CO 0.01 -0.80 -0.05 0.50 0.00 0.00 0.00 173.10 172.76 3m24 s ARG 157 N -0.71 0.38 0.00 2.90 1.81 -0.22 -1.11 118.95 122.00 3m24 s ARG 157 Ca 0.11 -0.50 0.00 0.00 -1.72 0.00 0.00 55.73 53.62 3m24 s ARG 157 Cb -0.10 -0.18 0.00 0.00 -0.45 0.00 0.00 34.95 34.21 3m24 s ARG 157 CO 0.00 0.03 0.00 0.27 -0.68 0.00 0.00 175.30 174.92 3m24 n ASN 158 N 2.03 0.00 -4.90 0.23 6.94 -1.08 -0.55 115.26 117.93 3m24 n ASN 158 Ca -0.19 0.00 -0.28 0.00 -0.02 0.00 0.00 54.58 54.08 3m24 n ASN 158 Cb 0.56 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.97 3m24 n ASN 158 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3m24 s ASP 159 N 0.00 6.35 0.01 0.53 1.01 -1.26 -0.49 116.67 122.81 3m24 s ASP 159 Ca 0.00 0.99 -0.00 0.00 0.71 0.00 0.00 52.55 54.25 3m24 s ASP 159 Cb 0.00 -2.27 -0.01 0.00 1.01 0.00 0.00 42.92 41.65 3m24 s ASP 159 CO 0.00 -0.51 -0.01 -0.04 0.21 0.00 0.00 175.17 174.82 3m24 s MET 160 N -4.42 0.21 -0.20 8.23 -1.94 0.03 -4.72 119.30 116.48 3m24 s MET 160 Ca 0.49 -0.37 -0.03 0.00 -1.71 0.00 0.00 55.69 54.07 3m24 s MET 160 Cb -0.10 0.08 -0.00 0.00 2.01 0.00 0.00 34.83 36.81 3m24 s MET 160 CO 0.40 -0.03 -0.08 0.00 -0.01 0.00 0.00 175.02 175.29 3m24 s ALA 161 N -0.91 2.70 -0.22 3.03 0.00 -1.26 -1.64 121.76 123.45 3m24 s ALA 161 Ca -0.10 -1.16 -0.11 0.00 0.00 0.00 0.00 51.96 50.59 3m24 s ALA 161 Cb -0.06 -1.55 -0.05 0.00 0.00 0.00 0.00 23.12 21.45 3m24 s ALA 161 CO -0.01 -0.36 0.19 -1.17 0.00 0.00 0.00 175.76 174.41 3m24 s LEU 162 N 1.35 4.15 0.12 0.00 2.96 0.11 -1.28 118.68 126.09 3m24 s LEU 162 Ca 0.04 0.20 -0.30 0.00 -0.22 0.00 0.00 54.13 53.86 3m24 s LEU 162 Cb -0.14 -2.16 -0.07 0.00 0.50 0.00 0.00 46.19 44.32 3m24 s LEU 162 CO -0.05 0.07 1.12 -0.54 -1.32 0.00 0.00 176.35 175.64 3m24 s LYS 163 N 0.91 4.54 0.03 1.98 1.02 0.08 -0.75 119.74 127.55 3m24 s LYS 163 Ca 0.09 1.71 0.05 0.00 0.02 0.00 0.00 55.97 57.85 3m24 s LYS 163 Cb -0.13 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.83 3m24 s LYS 163 CO 0.04 -0.05 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.79 3m24 s LEU 164 N 0.21 2.89 0.31 3.17 1.43 0.22 -0.24 118.68 126.66 3m24 s LEU 164 Ca 0.53 -0.29 -0.30 0.00 -1.03 0.00 0.00 54.13 53.03 3m24 s LEU 164 Cb -0.29 -1.67 -0.12 0.00 0.03 0.00 0.00 46.19 44.14 3m24 s LEU 164 CO 0.32 0.26 1.56 1.33 0.23 0.00 0.00 176.35 180.06 3m24 n VAL 165 N 1.51 1.21 0.00 -1.59 0.24 -0.99 -1.07 118.33 117.64 3m24 n VAL 165 Ca -0.16 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 3m24 n VAL 165 Cb 0.52 -1.93 0.00 0.00 -1.47 0.00 0.00 33.84 30.97 3m24 n VAL 165 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3m24 n GLY 166 N 1.83 1.66 0.00 7.63 0.00 -1.26 -4.62 105.19 110.43 3m24 n GLY 166 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3m24 n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m24 n GLY 167 N -1.60 1.09 2.79 -0.02 0.00 -0.23 -5.08 105.19 102.14 3m24 n GLY 167 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3m24 n GLY 167 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3m24 n SER 168 N 0.00 0.30 -4.05 1.61 3.41 -1.23 -4.78 113.62 108.87 3m24 n SER 168 Ca 0.00 -1.46 -0.16 0.00 -0.26 0.00 0.00 58.87 56.98 3m24 n SER 168 Cb 0.00 -0.67 -0.13 0.00 -0.26 0.00 0.00 64.21 63.15 3m24 n SER 168 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3m24 s HIS 169 N -2.87 0.78 -0.19 7.33 0.09 -1.26 -0.61 115.29 118.57 3m24 s HIS 169 Ca 0.53 -0.31 -0.05 0.00 -0.00 0.00 0.00 55.06 55.23 3m24 s HIS 169 Cb -0.02 -0.48 -0.02 0.00 -0.00 0.00 0.00 32.58 32.06 3m24 s HIS 169 CO 0.37 -0.02 -0.01 -1.17 -0.00 0.00 0.00 174.74 173.91 3m24 s LEU 170 N -0.91 3.26 -0.04 0.89 2.96 0.07 -4.92 118.68 119.99 3m24 s LEU 170 Ca -0.02 -0.19 -0.15 0.00 -0.22 0.00 0.00 54.13 53.55 3m24 s LEU 170 Cb -0.06 -1.82 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 3m24 s LEU 170 CO 0.00 0.09 0.41 -0.63 -1.32 0.00 0.00 176.35 174.90 3m24 s ILE 171 N 0.87 5.08 0.09 6.68 -1.09 -1.26 -0.71 121.20 130.85 3m24 s ILE 171 Ca 0.01 0.84 0.09 0.00 -2.23 0.00 0.00 60.65 59.36 3m24 s ILE 171 Cb -0.14 -3.73 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 3m24 s ILE 171 CO 0.02 0.51 -0.23 0.00 -1.23 0.00 0.00 174.94 174.01 3m24 s ALA 172 N -0.60 1.97 -0.12 9.38 0.00 -0.65 -1.20 121.76 130.54 3m24 s ALA 172 Ca 0.24 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.93 3m24 s ALA 172 Cb -0.16 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 3m24 s ALA 172 CO 0.12 0.43 -0.07 1.21 0.00 0.00 0.00 175.76 177.45 3m24 s ASN 173 N -1.69 4.56 -0.12 0.00 3.04 -0.06 -0.79 114.94 119.88 3m24 s ASN 173 Ca 0.09 -0.14 0.01 0.00 0.04 0.00 0.00 52.86 52.86 3m24 s ASN 173 Cb -0.10 -1.54 -0.01 0.00 -1.54 0.00 0.00 41.25 38.06 3m24 s ASN 173 CO 0.04 0.23 -0.15 -0.63 -3.04 0.00 0.00 177.10 173.55 3m24 s ILE 174 N -0.02 2.88 -0.19 -5.21 1.09 0.35 -1.36 121.20 118.74 3m24 s ILE 174 Ca -0.00 -0.73 0.01 0.00 -1.10 0.00 0.00 60.65 58.83 3m24 s ILE 174 Cb -0.14 -2.19 0.03 0.00 -1.06 0.00 0.00 42.46 39.11 3m24 s ILE 174 CO 0.03 0.54 -0.13 -0.54 -0.10 0.00 0.00 174.94 174.73 3m24 s LYS 175 N 0.23 2.32 0.09 2.79 1.02 -0.63 -2.65 119.74 122.90 3m24 s LYS 175 Ca -0.10 -0.82 0.10 0.00 0.02 0.00 0.00 55.97 55.17 3m24 s LYS 175 Cb -0.16 -2.41 -0.03 0.00 -0.52 0.00 0.00 37.83 34.71 3m24 s LYS 175 CO 0.06 -0.35 -0.25 0.99 -0.92 0.00 0.00 175.35 174.88 3m24 s THR 176 N 1.37 2.06 -0.11 2.17 2.01 -0.27 -0.98 115.64 121.88 3m24 s THR 176 Ca 0.01 -1.53 0.03 0.00 0.31 0.00 0.00 61.69 60.51 3m24 s THR 176 Cb -0.15 -1.80 0.01 0.00 0.01 0.00 0.00 72.50 70.56 3m24 s THR 176 CO -0.10 0.17 -0.22 -0.89 -0.69 0.00 0.00 174.62 172.90 3m24 s THR 177 N -0.96 1.95 -0.17 -0.82 2.01 0.37 -0.80 115.64 117.22 3m24 s THR 177 Ca 0.11 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.14 3m24 s THR 177 Cb -0.10 -1.71 -0.02 0.00 0.01 0.00 0.00 72.50 70.68 3m24 s THR 177 CO 0.04 0.53 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.13 3m24 s TYR 178 N 0.59 2.96 -0.09 4.92 2.02 0.18 -1.50 117.35 126.42 3m24 s TYR 178 Ca -0.13 -0.53 0.02 0.00 -0.37 0.00 0.00 57.07 56.05 3m24 s TYR 178 Cb -0.17 -1.97 0.01 0.00 -0.40 0.00 0.00 41.96 39.43 3m24 s TYR 178 CO 0.04 -0.21 -0.14 1.03 -1.57 0.00 0.00 175.55 174.70 3m24 s ARG 179 N 0.66 2.03 0.13 -0.62 0.52 -0.38 -1.50 118.95 119.79 3m24 s ARG 179 Ca -0.03 -0.51 -0.25 0.00 -0.52 0.00 0.00 55.73 54.42 3m24 s ARG 179 Cb -0.15 -1.70 -0.07 0.00 0.52 0.00 0.00 34.95 33.55 3m24 s ARG 179 CO 0.02 -0.02 0.75 0.45 0.02 0.00 0.00 175.30 176.53 3m24 s SER 180 N 0.84 7.32 -0.13 0.23 0.15 -1.26 -0.15 113.70 120.70 3m24 s SER 180 Ca -0.10 1.57 0.04 0.00 0.70 0.00 0.00 55.95 58.15 3m24 s SER 180 Cb -0.15 -2.48 0.29 0.00 -1.71 0.00 0.00 66.02 61.97 3m24 s SER 180 CO 0.01 0.18 1.16 0.29 1.20 0.00 0.00 173.24 176.07 3m24 n LYS 181 N 1.86 2.06 -4.94 5.44 5.02 -0.36 -4.80 118.16 122.43 3m24 n LYS 181 Ca -0.05 -1.21 -0.28 0.00 -2.02 0.00 0.00 58.31 54.75 3m24 n LYS 181 Cb 0.49 -1.65 -0.16 0.00 -0.02 0.00 0.00 35.03 33.69 3m24 n LYS 181 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3m24 s LYS 182 N -1.51 2.23 0.20 1.97 2.20 -1.26 -4.71 119.74 118.85 3m24 s LYS 182 Ca 0.22 -0.68 -0.31 0.00 -0.36 0.00 0.00 55.97 54.84 3m24 s LYS 182 Cb 0.17 -1.81 -0.16 0.00 -1.51 0.00 0.00 37.83 34.52 3m24 s LYS 182 CO 0.05 0.19 0.97 -2.30 -0.36 0.00 0.00 175.35 173.90 3m24 n PRO 183 N 3.39 0.86 -0.31 4.03 -0.02 -1.26 -4.84 135.00 136.83 3m24 n PRO 183 Ca -0.19 0.30 0.17 0.00 -2.02 0.00 0.00 63.50 61.75 3m24 n PRO 183 Cb 0.52 -1.65 0.36 0.00 -0.02 0.00 0.00 33.50 32.71 3m24 n PRO 183 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m24 h ALA 184 N 2.43 1.55 -0.53 3.55 0.00 -1.94 -0.54 119.26 123.78 3m24 h ALA 184 Ca -0.39 0.20 -0.50 0.00 0.00 0.00 0.00 54.91 54.22 3m24 h ALA 184 Cb 1.37 0.22 -0.18 0.00 0.00 0.00 0.00 17.79 19.20 3m24 h ALA 184 CO 0.64 -0.46 0.38 1.17 0.00 0.00 0.00 179.25 180.98 3m24 n LYS 185 N -5.12 2.40 0.00 0.00 0.00 -1.26 -3.06 118.16 111.12 3m24 n LYS 185 Ca 0.25 -2.33 0.00 0.00 0.00 0.00 0.00 58.31 56.23 3m24 n LYS 185 Cb 0.77 -2.14 0.00 0.00 0.00 0.00 0.00 35.03 33.66 3m24 n LYS 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3m24 n ASN 186 N 0.89 0.00 -4.31 3.14 4.13 -0.21 -5.11 115.26 113.79 3m24 n ASN 186 Ca 0.49 -1.00 -0.30 0.00 1.68 0.00 0.00 54.58 55.45 3m24 n ASN 186 Cb 0.55 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.64 3m24 n ASN 186 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3m24 s LEU 187 N 0.00 2.12 -0.38 3.41 1.43 -1.17 -5.02 118.68 119.06 3m24 s LEU 187 Ca 0.00 -0.53 -0.21 0.00 -1.03 0.00 0.00 54.13 52.36 3m24 s LEU 187 Cb 0.00 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.97 3m24 s LEU 187 CO 0.00 0.27 0.68 -1.59 0.23 0.00 0.00 176.35 175.94 3m24 s LYS 188 N -0.96 3.60 0.09 1.70 -2.85 -1.26 -5.04 119.74 115.01 3m24 s LYS 188 Ca 0.10 0.01 -0.30 0.00 -1.00 0.00 0.00 55.97 54.79 3m24 s LYS 188 Cb -0.10 -3.85 -0.06 0.00 -2.06 0.00 0.00 37.83 31.77 3m24 s LYS 188 CO 0.01 -0.84 1.09 -1.64 0.10 0.00 0.00 175.35 174.07 3m24 s MET 189 N 2.86 4.55 0.76 1.78 -1.94 -1.26 -4.70 119.30 121.35 3m24 s MET 189 Ca 0.26 1.63 -0.11 0.00 -1.71 0.00 0.00 55.69 55.76 3m24 s MET 189 Cb -0.14 -3.35 0.05 0.00 2.01 0.00 0.00 34.83 33.39 3m24 s MET 189 CO 0.17 -0.04 1.09 -1.25 -0.01 0.00 0.00 175.02 174.97 3m24 s PRO 190 N 0.46 2.41 0.00 2.03 0.04 -1.26 -4.91 135.00 133.76 3m24 s PRO 190 Ca 0.53 0.71 0.00 0.00 0.04 0.00 0.00 61.00 62.27 3m24 s PRO 190 Cb -0.27 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.32 3m24 s PRO 190 CO 0.31 -1.41 0.00 0.41 0.04 0.00 0.00 177.00 176.35 3m24 n GLY 191 N -2.17 0.52 3.71 0.56 0.00 -1.26 -4.58 105.19 101.97 3m24 n GLY 191 Ca 0.07 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 3m24 n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m24 s VAL 192 N 0.70 3.29 0.32 1.61 1.01 -1.26 -4.56 120.40 121.50 3m24 s VAL 192 Ca 0.00 0.90 -0.12 0.00 0.00 0.00 0.00 61.98 62.76 3m24 s VAL 192 Cb 0.00 -3.58 0.02 0.00 0.00 0.00 0.00 36.38 32.82 3m24 s VAL 192 CO 0.00 0.06 0.60 -0.72 0.00 0.00 0.00 175.10 175.04 3m24 s TYR 193 N 1.32 0.42 0.02 5.22 -0.85 -0.38 -4.94 117.35 118.16 3m24 s TYR 193 Ca 0.65 -0.85 0.05 0.00 -0.52 0.00 0.00 57.07 56.40 3m24 s TYR 193 Cb -0.37 0.37 -0.02 0.00 0.38 0.00 0.00 41.96 42.33 3m24 s TYR 193 CO 0.30 -1.24 -0.15 0.71 -1.52 0.00 0.00 175.55 173.65 3m24 s TYR 194 N -3.21 1.29 -0.20 -3.49 2.02 -0.52 -0.54 117.35 112.69 3m24 s TYR 194 Ca 0.21 -0.31 0.01 0.00 -0.37 0.00 0.00 57.07 56.60 3m24 s TYR 194 Cb -0.03 -0.79 0.04 0.00 -0.40 0.00 0.00 41.96 40.79 3m24 s TYR 194 CO 0.13 0.02 -0.09 0.08 -1.57 0.00 0.00 175.55 174.12 3m24 s VAL 195 N -0.67 1.57 0.09 0.71 1.01 -0.23 -0.60 120.40 122.29 3m24 s VAL 195 Ca 0.03 -1.00 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 3m24 s VAL 195 Cb -0.07 -1.68 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 3m24 s VAL 195 CO 0.01 0.13 1.00 -1.81 0.00 0.00 0.00 175.10 174.42 3m24 s ASP 196 N 1.42 7.42 0.03 3.32 1.01 -0.15 -1.40 116.67 128.32 3m24 s ASP 196 Ca -0.02 1.81 0.06 0.00 0.71 0.00 0.00 52.55 55.11 3m24 s ASP 196 Cb -0.16 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.16 3m24 s ASP 196 CO -0.08 -0.15 -0.16 -0.31 0.21 0.00 0.00 175.17 174.68 3m24 s TYR 197 N 0.28 1.41 -0.15 4.23 2.02 -0.17 -1.25 117.35 123.71 3m24 s TYR 197 Ca 0.49 -0.34 -0.03 0.00 -0.37 0.00 0.00 57.07 56.82 3m24 s TYR 197 Cb -0.24 -0.85 0.05 0.00 -0.40 0.00 0.00 41.96 40.52 3m24 s TYR 197 CO 0.30 0.04 0.04 0.50 -1.57 0.00 0.00 175.55 174.86 3m24 s ARG 198 N -1.03 0.52 -0.28 -0.62 3.52 -0.25 -2.37 118.95 118.44 3m24 s ARG 198 Ca 0.04 -0.20 -0.07 0.00 -0.13 0.00 0.00 55.73 55.38 3m24 s ARG 198 Cb -0.08 -1.71 -0.00 0.00 -1.56 0.00 0.00 34.95 31.60 3m24 s ARG 198 CO 0.01 -0.54 0.07 -1.17 -0.81 0.00 0.00 175.30 172.86 3m24 s LEU 199 N 1.95 3.66 -0.06 -0.88 0.20 -1.26 -1.44 118.68 120.85 3m24 s LEU 199 Ca 0.01 -0.54 0.06 0.00 0.69 0.00 0.00 54.13 54.35 3m24 s LEU 199 Cb -0.15 -1.88 -0.01 0.00 -0.43 0.00 0.00 46.19 43.71 3m24 s LEU 199 CO -0.07 -0.13 -0.24 -1.61 -0.29 0.00 0.00 176.35 174.00 3m24 s GLU 200 N 1.53 2.44 -0.30 1.98 2.02 0.15 -4.57 118.70 121.96 3m24 s GLU 200 Ca 0.04 -0.86 -0.29 0.00 0.02 0.00 0.00 54.97 53.88 3m24 s GLU 200 Cb -0.16 -2.07 -0.00 0.00 0.10 0.00 0.00 34.13 32.00 3m24 s GLU 200 CO 0.02 0.36 1.33 0.50 0.02 0.00 0.00 175.26 177.49 3m24 s ARG 201 N -0.12 3.89 -0.20 1.61 6.06 -1.26 -1.03 118.95 127.89 3m24 s ARG 201 Ca -0.04 1.27 -0.22 0.00 -2.50 0.00 0.00 55.73 54.24 3m24 s ARG 201 Cb -0.14 -3.90 -0.19 0.00 0.06 0.00 0.00 34.95 30.79 3m24 s ARG 201 CO 0.04 -1.15 0.24 0.82 -2.50 0.00 0.00 175.30 172.75 3m24 h ILE 202 N 6.00 0.95 -2.82 4.11 1.08 -1.19 -3.49 117.51 122.15 3m24 h ILE 202 Ca -0.27 -2.15 -0.11 0.00 -0.39 0.00 0.00 64.86 61.94 3m24 h ILE 202 Cb 1.10 2.24 -0.21 0.00 -3.07 0.00 0.00 36.82 36.88 3m24 h ILE 202 CO 1.03 0.32 -0.20 -0.54 -0.69 0.00 0.00 178.15 178.08 3m24 s LYS 203 N -2.35 0.68 -0.02 2.37 -0.14 -1.09 -4.99 119.74 114.21 3m24 s LYS 203 Ca -0.28 0.03 -0.03 0.00 -1.36 0.00 0.00 55.97 54.34 3m24 s LYS 203 Cb 0.05 0.31 0.00 0.00 -1.68 0.00 0.00 37.83 36.52 3m24 s LYS 203 CO 0.59 -0.18 0.08 -1.83 -0.76 0.00 0.00 175.35 173.25 3m24 s GLU 204 N -0.98 0.19 0.04 1.68 -1.05 -1.26 -0.19 118.70 117.13 3m24 s GLU 204 Ca -0.10 -0.05 0.01 0.00 -0.15 0.00 0.00 54.97 54.67 3m24 s GLU 204 Cb -0.04 0.08 -0.03 0.00 -0.44 0.00 0.00 34.13 33.70 3m24 s GLU 204 CO 0.04 -0.03 -0.05 0.00 0.95 0.00 0.00 175.26 176.18 3m24 s ALA 205 N -0.36 0.38 -1.16 -0.84 0.00 -0.69 -4.94 121.76 114.16 3m24 s ALA 205 Ca -0.04 -0.82 -0.11 0.00 0.00 0.00 0.00 51.96 50.98 3m24 s ALA 205 Cb -0.03 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 3m24 s ALA 205 CO 0.00 -0.17 0.80 0.09 0.00 0.00 0.00 175.76 176.48 3m24 n ASN 206 N 1.14 -4.58 -3.53 0.00 3.02 -1.26 -2.43 115.26 107.61 3m24 n ASN 206 Ca -0.21 -0.89 -0.19 0.00 -0.03 0.00 0.00 54.58 53.27 3m24 n ASN 206 Cb 0.57 -4.04 0.07 0.00 -0.61 0.00 0.00 39.78 35.76 3m24 n ASN 206 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3m24 n ASN 207 N -2.92 -2.06 -1.16 6.41 3.02 -1.26 -2.53 115.26 114.75 3m24 n ASN 207 Ca -0.14 -0.71 -0.15 0.00 -0.03 0.00 0.00 54.58 53.54 3m24 n ASN 207 Cb 0.62 -4.68 -0.07 0.00 -0.61 0.00 0.00 39.78 35.05 3m24 n ASN 207 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3m24 n GLU 208 N -4.13 -1.16 0.07 3.52 1.02 -1.19 -4.53 120.64 114.25 3m24 n GLU 208 Ca -0.28 1.03 -0.08 0.00 -0.02 0.00 0.00 57.16 57.81 3m24 n GLU 208 Cb 0.67 -5.21 0.06 0.00 -0.02 0.00 0.00 31.44 26.94 3m24 n GLU 208 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3m24 h THR 209 N 0.00 1.40 -3.33 2.62 2.02 -1.19 -3.41 112.91 111.02 3m24 h THR 209 Ca -0.31 -2.14 -0.67 0.00 0.77 0.00 0.00 66.41 64.06 3m24 h THR 209 Cb 1.04 2.11 -0.31 0.00 -1.74 0.00 0.00 68.15 69.24 3m24 h THR 209 CO 0.46 0.63 -0.85 -0.47 0.37 0.00 0.00 175.52 175.66 3m24 s TYR 210 N -3.63 2.63 -0.04 3.16 5.04 -1.02 -1.39 117.35 122.11 3m24 s TYR 210 Ca -0.05 -0.95 0.00 0.00 -2.44 0.00 0.00 57.07 53.63 3m24 s TYR 210 Cb 0.11 -1.75 0.03 0.00 0.35 0.00 0.00 41.96 40.70 3m24 s TYR 210 CO 0.82 -0.37 -0.01 0.08 -1.34 0.00 0.00 175.55 174.73 3m24 s VAL 211 N 0.36 0.28 -0.23 3.14 1.01 -0.91 -1.71 120.40 122.35 3m24 s VAL 211 Ca -0.16 0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.79 3m24 s VAL 211 Cb -0.17 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 3m24 s VAL 211 CO 0.08 0.17 0.05 -0.70 0.00 0.00 0.00 175.10 174.70 3m24 s GLU 212 N 1.06 3.65 0.05 2.72 2.12 0.74 0.04 118.70 129.08 3m24 s GLU 212 Ca -0.09 -0.49 0.06 0.00 0.36 0.00 0.00 54.97 54.81 3m24 s GLU 212 Cb -0.14 -3.24 -0.03 0.00 0.26 0.00 0.00 34.13 30.99 3m24 s GLU 212 CO -0.01 -0.11 -0.18 1.14 -0.54 0.00 0.00 175.26 175.56 3m24 s GLN 213 N 1.37 1.14 0.05 4.30 -2.07 0.55 -0.55 119.66 124.44 3m24 s GLN 213 Ca 0.05 -0.91 0.09 0.00 -1.82 0.00 0.00 55.36 52.77 3m24 s GLN 213 Cb -0.15 -1.23 -0.03 0.00 -1.09 0.00 0.00 33.01 30.51 3m24 s GLN 213 CO 0.03 0.30 -0.23 -1.58 -1.32 0.00 0.00 175.29 172.49 3m24 s HIS 214 N -0.90 2.41 -0.03 9.60 5.65 -0.20 -0.60 115.29 131.21 3m24 s HIS 214 Ca 0.04 -0.35 0.00 0.00 0.25 0.00 0.00 55.06 55.01 3m24 s HIS 214 Cb -0.09 -1.41 0.03 0.00 -1.18 0.00 0.00 32.58 29.93 3m24 s HIS 214 CO 0.02 0.19 -0.01 -2.00 -0.65 0.00 0.00 174.74 172.29 3m24 s GLU 215 N -1.36 0.39 -0.09 2.88 2.12 -0.13 -0.67 118.70 121.84 3m24 s GLU 215 Ca 0.13 0.05 0.01 0.00 0.36 0.00 0.00 54.97 55.52 3m24 s GLU 215 Cb -0.10 -0.56 -0.02 0.00 0.26 0.00 0.00 34.13 33.70 3m24 s GLU 215 CO 0.04 -0.14 -0.10 0.54 -0.54 0.00 0.00 175.26 175.06 3m24 s VAL 216 N 1.07 3.37 -0.10 3.70 0.11 -0.52 -1.84 120.40 126.19 3m24 s VAL 216 Ca -0.09 -0.58 -0.04 0.00 -2.93 0.00 0.00 61.98 58.34 3m24 s VAL 216 Cb -0.14 -2.39 0.05 0.00 -1.53 0.00 0.00 36.38 32.38 3m24 s VAL 216 CO -0.02 0.56 0.21 0.00 -3.33 0.00 0.00 175.10 172.52 3m24 s ALA 217 N -0.30 -0.37 -0.12 1.54 0.00 0.71 -1.09 121.76 122.13 3m24 s ALA 217 Ca 0.03 0.77 -0.00 0.00 0.00 0.00 0.00 51.96 52.76 3m24 s ALA 217 Cb -0.13 -0.83 0.02 0.00 0.00 0.00 0.00 23.12 22.19 3m24 s ALA 217 CO 0.03 -0.50 -0.09 0.08 0.00 0.00 0.00 175.76 175.27 3m24 s VAL 218 N 2.09 1.17 0.14 0.00 1.01 -0.38 -2.12 120.40 122.30 3m24 s VAL 218 Ca -0.01 -0.38 -0.21 0.00 0.00 0.00 0.00 61.98 61.38 3m24 s VAL 218 Cb -0.12 -1.16 -0.07 0.00 0.00 0.00 0.00 36.38 35.03 3m24 s VAL 218 CO -0.07 0.39 0.68 0.00 0.00 0.00 0.00 175.10 176.09 3m24 s ALA 219 N 1.65 3.50 0.17 5.51 0.00 -0.08 -0.98 121.76 131.54 3m24 s ALA 219 Ca 0.05 0.17 -0.19 0.00 0.00 0.00 0.00 51.96 51.99 3m24 s ALA 219 Cb -0.13 -2.78 0.04 0.00 0.00 0.00 0.00 23.12 20.25 3m24 s ALA 219 CO -0.09 0.35 0.52 -0.98 0.00 0.00 0.00 175.76 175.56 3m24 s ARG 220 N -1.36 1.29 0.85 0.00 1.70 0.24 -2.47 118.95 119.20 3m24 s ARG 220 Ca 0.35 -0.72 -0.08 0.00 -0.47 0.00 0.00 55.73 54.80 3m24 s ARG 220 Cb -0.20 0.53 0.17 0.00 -0.57 0.00 0.00 34.95 34.88 3m24 s ARG 220 CO 0.22 -0.55 1.17 0.71 -1.08 0.00 0.00 175.30 175.77 3m24 s TYR 221 N -3.82 1.45 -0.13 5.89 2.02 -1.26 -1.44 117.35 120.06 3m24 s TYR 221 Ca 0.05 -0.03 -0.24 0.00 -0.37 0.00 0.00 57.07 56.48 3m24 s TYR 221 Cb -0.00 -3.57 -0.03 0.00 -0.40 0.00 0.00 41.96 37.96 3m24 s TYR 221 CO -0.07 -2.25 0.75 0.00 -1.57 0.00 0.00 175.55 172.41 3m24 n ASP 223 N 4.58 1.58 -4.75 0.00 5.75 -1.26 -4.96 116.55 117.50 3m24 n ASP 223 Ca 0.01 -1.41 -0.37 0.00 -0.01 0.00 0.00 54.79 53.01 3m24 n ASP 223 Cb 0.50 0.05 0.03 0.00 -1.03 0.00 0.00 41.12 40.68 3m24 n ASP 223 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3m24 s LEU 224 N -2.14 3.80 0.23 -2.12 1.43 -1.26 -4.92 118.68 113.69 3m24 s LEU 224 Ca 0.33 2.56 -0.32 0.00 -1.03 0.00 0.00 54.13 55.67 3m24 s LEU 224 Cb 0.20 -4.40 -0.13 0.00 0.03 0.00 0.00 46.19 41.89 3m24 s LEU 224 CO 0.39 -1.51 1.45 -2.65 0.23 0.00 0.00 176.35 174.26 3m24 n PRO 225 N -1.18 2.11 -4.08 1.29 -0.02 -1.26 -4.98 135.00 126.87 3m24 n PRO 225 Ca 0.11 0.75 -0.34 0.00 -2.02 0.00 0.00 63.50 62.00 3m24 n PRO 225 Cb 0.47 -2.44 -0.10 0.00 -0.02 0.00 0.00 33.50 31.41 3m24 n PRO 225 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3m24 s SER 226 N 0.42 5.46 -0.02 2.55 0.15 -1.26 -5.01 113.70 115.99 3m24 s SER 226 Ca 0.70 0.04 -0.21 0.00 0.70 0.00 0.00 55.95 57.18 3m24 s SER 226 Cb -0.64 -1.93 -0.27 0.00 -1.71 0.00 0.00 66.02 61.47 3m24 s SER 226 CO 0.47 0.17 1.01 0.50 1.20 0.00 0.00 173.24 176.59 3m24 h LYS 227 N 6.72 0.36 -0.01 5.44 1.63 -2.06 -3.56 116.57 125.10 3m24 h LYS 227 Ca -0.36 -0.48 0.00 0.00 -0.85 0.00 0.00 60.65 58.96 3m24 h LYS 227 Cb 1.17 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.96 3m24 h LYS 227 CO 0.69 1.17 0.00 1.47 -3.45 0.00 0.00 179.45 179.33