#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a39 n PRO 3 N 0.00 2.02 0.00 1.64 -0.02 -1.26 0.30 135.00 137.68 2a39 n PRO 3 Ca 0.00 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2a39 n PRO 3 Cb 0.00 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.05 2a39 n PRO 3 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a39 n GLY 4 N 2.73 -0.06 0.09 -1.23 0.00 0.25 -4.75 105.19 102.22 2a39 n GLY 4 Ca 0.14 -1.66 -0.05 0.00 0.00 0.00 0.00 46.02 44.45 2a39 n GLY 4 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2a39 n GLU 5 N 0.00 0.64 -1.82 1.61 4.71 -1.26 -4.76 120.64 119.76 2a39 n GLU 5 Ca 0.00 0.17 -0.42 0.00 -0.01 0.00 0.00 57.16 56.91 2a39 n GLU 5 Cb 0.00 -1.72 -0.02 0.00 -1.01 0.00 0.00 31.44 28.69 2a39 n GLU 5 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2a39 s THR 6 N -2.73 2.20 0.33 2.62 2.01 -1.26 -4.93 115.64 113.88 2a39 s THR 6 Ca -0.06 0.16 -0.27 0.00 0.31 0.00 0.00 61.69 61.84 2a39 s THR 6 Cb 0.08 -3.10 -0.09 0.00 0.01 0.00 0.00 72.50 69.39 2a39 s THR 6 CO 0.83 0.02 1.00 -1.59 -0.69 0.00 0.00 174.62 174.19 2a39 s LYS 7 N -0.11 4.52 -0.19 4.92 -2.85 -1.26 -2.18 119.74 122.58 2a39 s LYS 7 Ca 0.65 1.48 -0.21 0.00 -1.00 0.00 0.00 55.97 56.89 2a39 s LYS 7 Cb -0.47 -2.85 -0.03 0.00 -2.06 0.00 0.00 37.83 32.42 2a39 s LYS 7 CO 0.44 0.19 0.63 -2.00 0.10 0.00 0.00 175.35 174.70 2a39 s GLU 8 N -1.96 4.23 -0.37 1.78 2.56 -1.26 -2.52 118.70 121.16 2a39 s GLU 8 Ca 0.50 0.63 -0.00 0.00 0.00 0.00 0.00 54.97 56.10 2a39 s GLU 8 Cb -0.23 -3.56 0.10 0.00 2.00 0.00 0.00 34.13 32.44 2a39 s GLU 8 CO 0.29 -0.21 0.12 0.08 -0.56 0.00 0.00 175.26 174.98 2a39 s VAL 9 N 1.80 2.86 0.03 3.70 1.01 0.04 -4.89 120.40 124.96 2a39 s VAL 9 Ca 0.29 -2.09 -0.30 0.00 0.00 0.00 0.00 61.98 59.88 2a39 s VAL 9 Cb -0.16 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 2a39 s VAL 9 CO 0.11 -0.59 0.97 -1.00 0.00 0.00 0.00 175.10 174.59 2a39 s HIS 10 N 1.06 3.70 0.27 5.22 0.09 -1.26 -4.62 115.29 119.75 2a39 s HIS 10 Ca 0.08 1.72 -0.31 0.00 -0.00 0.00 0.00 55.06 56.55 2a39 s HIS 10 Cb -0.21 -3.10 -0.13 0.00 -0.00 0.00 0.00 32.58 29.15 2a39 s HIS 10 CO -0.05 0.05 1.48 -2.30 -0.00 0.00 0.00 174.74 173.92 2a39 n PRO 11 N 3.59 2.32 -3.15 8.40 -0.02 -1.26 -4.79 135.00 140.09 2a39 n PRO 11 Ca 0.05 0.83 -0.37 0.00 -2.02 0.00 0.00 63.50 61.98 2a39 n PRO 11 Cb 0.50 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 31.39 2a39 n PRO 11 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2a39 s GLN 12 N -0.49 4.26 -0.04 -0.52 0.74 -1.26 -1.23 119.66 121.12 2a39 s GLN 12 Ca 0.66 0.84 -0.00 0.00 0.05 0.00 0.00 55.36 56.91 2a39 s GLN 12 Cb -0.58 -3.02 0.03 0.00 1.10 0.00 0.00 33.01 30.53 2a39 s GLN 12 CO 0.49 0.49 0.00 -1.17 -0.55 0.00 0.00 175.29 174.55 2a39 s LEU 13 N -1.66 0.97 -0.09 3.68 2.96 0.08 -4.74 118.68 119.88 2a39 s LEU 13 Ca 0.38 -0.03 -0.24 0.00 -0.22 0.00 0.00 54.13 54.02 2a39 s LEU 13 Cb -0.18 -0.27 -0.03 0.00 0.50 0.00 0.00 46.19 46.21 2a39 s LEU 13 CO 0.21 -0.13 0.71 -0.89 -1.32 0.00 0.00 176.35 174.94 2a39 s THR 14 N 1.30 5.02 0.40 3.68 2.01 -0.79 -1.07 115.64 126.19 2a39 s THR 14 Ca -0.06 1.46 0.02 0.00 0.31 0.00 0.00 61.69 63.42 2a39 s THR 14 Cb -0.13 -4.05 -0.01 0.00 0.01 0.00 0.00 72.50 68.32 2a39 s THR 14 CO -0.02 0.21 0.08 0.35 -0.69 0.00 0.00 174.62 174.55 2a39 n THR 15 N 3.95 0.00 -4.14 -0.82 -2.24 -0.66 -4.44 114.28 105.93 2a39 n THR 15 Ca -0.00 -2.15 -0.16 0.00 -2.27 0.00 0.00 64.05 59.47 2a39 n THR 15 Cb 0.51 0.63 -0.11 0.00 -2.10 0.00 0.00 70.33 69.26 2a39 n THR 15 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2a39 s PHE 16 N -2.81 1.02 -0.16 4.78 0.08 -0.38 0.77 117.98 121.28 2a39 s PHE 16 Ca 0.11 -0.54 0.01 0.00 0.12 0.00 0.00 56.93 56.63 2a39 s PHE 16 Cb 0.01 -0.57 0.01 0.00 -0.57 0.00 0.00 43.02 41.89 2a39 s PHE 16 CO 0.08 0.00 -0.18 1.03 -0.10 0.00 0.00 175.22 176.05 2a39 s ARG 17 N -2.07 3.11 0.01 0.44 1.81 -0.00 -2.30 118.95 119.94 2a39 s ARG 17 Ca -0.01 -0.80 0.07 0.00 -1.72 0.00 0.00 55.73 53.26 2a39 s ARG 17 Cb -0.07 -2.56 -0.03 0.00 -0.45 0.00 0.00 34.95 31.84 2a39 s ARG 17 CO 0.01 -0.04 -0.20 0.00 -0.68 0.00 0.00 175.30 174.39 2a39 s THR 19 N -0.80 0.56 0.29 0.00 -4.23 -0.20 -2.30 115.64 108.96 2a39 s THR 19 Ca 0.13 -1.45 -0.02 0.00 -1.18 0.00 0.00 61.69 59.16 2a39 s THR 19 Cb -0.10 -1.07 0.22 0.00 1.34 0.00 0.00 72.50 72.89 2a39 s THR 19 CO 0.03 -0.62 1.92 0.11 -0.54 0.00 0.00 174.62 175.51 2a39 h LYS 20 N 3.82 1.01 0.09 3.99 1.57 -1.88 -0.18 116.57 124.98 2a39 h LYS 20 Ca -0.35 -0.11 -0.13 0.00 -1.87 0.00 0.00 60.65 58.19 2a39 h LYS 20 Cb 1.18 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 33.31 2a39 h LYS 20 CO 0.52 0.74 -0.56 0.00 -0.57 0.00 0.00 179.45 179.57 2a39 h ARG 21 N 1.02 0.22 -0.00 3.15 2.47 -1.99 -3.34 114.38 115.91 2a39 h ARG 21 Ca 0.26 -0.36 0.00 0.00 -1.26 0.00 0.00 59.98 58.62 2a39 h ARG 21 Cb 0.02 0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2a39 h ARG 21 CO -0.04 1.16 -0.14 0.41 0.56 0.00 0.00 179.97 181.91 2a39 n GLY 22 N 1.59 -0.95 7.00 0.04 0.00 -1.21 -5.05 105.19 106.60 2a39 n GLY 22 Ca -0.12 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2a39 n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a39 n GLY 23 N 1.31 -0.30 3.55 -0.02 0.00 -0.08 -4.69 105.19 104.96 2a39 n GLY 23 Ca 0.13 -1.06 -0.39 0.00 0.00 0.00 0.00 46.02 44.70 2a39 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 s LYS 25 N 1.73 3.43 0.44 0.00 1.02 -0.11 -4.89 119.74 121.35 2a39 s LYS 25 Ca 0.06 -0.36 -0.24 0.00 0.02 0.00 0.00 55.97 55.45 2a39 s LYS 25 Cb -0.17 -3.00 -0.08 0.00 -0.52 0.00 0.00 37.83 34.07 2a39 s LYS 25 CO 0.10 0.54 1.21 -1.25 -0.92 0.00 0.00 175.35 175.03 2a39 s PRO 26 N -0.39 3.85 0.06 -1.68 0.04 -1.26 -0.82 135.00 134.79 2a39 s PRO 26 Ca 0.08 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.04 2a39 s PRO 26 Cb -0.12 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.83 2a39 s PRO 26 CO 0.02 -0.51 -0.05 0.00 0.04 0.00 0.00 177.00 176.50 2a39 s ALA 27 N -1.42 0.61 -0.16 8.56 0.00 0.23 -4.87 121.76 124.71 2a39 s ALA 27 Ca 0.61 -1.10 -0.14 0.00 0.00 0.00 0.00 51.96 51.33 2a39 s ALA 27 Cb -0.32 0.19 -0.05 0.00 0.00 0.00 0.00 23.12 22.94 2a39 s ALA 27 CO 0.40 -0.25 0.29 0.99 0.00 0.00 0.00 175.76 177.18 2a39 s THR 28 N -3.12 5.31 0.20 0.00 2.01 -1.26 -1.65 115.64 117.13 2a39 s THR 28 Ca 0.03 0.53 0.01 0.00 0.31 0.00 0.00 61.69 62.57 2a39 s THR 28 Cb 0.02 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.86 2a39 s THR 28 CO -0.06 0.39 0.06 0.20 -0.69 0.00 0.00 174.62 174.52 2a39 s ASN 29 N 0.47 0.99 0.23 3.53 -0.87 -0.24 -3.69 114.94 115.37 2a39 s ASN 29 Ca 0.16 -1.28 0.05 0.00 -1.57 0.00 0.00 52.86 50.22 2a39 s ASN 29 Cb -0.13 0.18 -0.05 0.00 -0.02 0.00 0.00 41.25 41.23 2a39 s ASN 29 CO 0.04 -0.68 -0.05 -0.36 -2.57 0.00 0.00 177.10 173.48 2a39 s PHE 30 N -3.79 1.63 -0.09 2.20 0.08 -0.84 -0.74 117.98 116.43 2a39 s PHE 30 Ca 0.31 -0.80 0.01 0.00 0.12 0.00 0.00 56.93 56.57 2a39 s PHE 30 Cb 0.07 -0.91 -0.03 0.00 -0.57 0.00 0.00 43.02 41.59 2a39 s PHE 30 CO 0.08 0.11 -0.09 0.42 -0.10 0.00 0.00 175.22 175.65 2a39 s ILE 31 N -3.25 3.53 -0.02 0.64 -1.09 -0.37 -0.48 121.20 120.16 2a39 s ILE 31 Ca 0.26 -0.53 0.03 0.00 -2.23 0.00 0.00 60.65 58.18 2a39 s ILE 31 Cb 0.04 -2.45 -0.00 0.00 -1.58 0.00 0.00 42.46 38.46 2a39 s ILE 31 CO 0.08 0.57 -0.12 0.54 -1.23 0.00 0.00 174.94 174.79 2a39 s VAL 32 N -0.46 0.96 0.45 2.92 0.11 -0.59 -4.12 120.40 119.67 2a39 s VAL 32 Ca 0.07 -0.48 -0.22 0.00 -2.93 0.00 0.00 61.98 58.42 2a39 s VAL 32 Cb -0.12 -0.83 -0.09 0.00 -1.53 0.00 0.00 36.38 33.82 2a39 s VAL 32 CO 0.02 0.28 1.04 -0.76 -3.33 0.00 0.00 175.10 172.36 2a39 s LEU 33 N -0.02 3.96 0.40 2.54 1.43 -1.26 -0.74 118.68 124.98 2a39 s LEU 33 Ca -0.00 1.97 -0.25 0.00 -1.03 0.00 0.00 54.13 54.82 2a39 s LEU 33 Cb -0.07 -4.41 -0.11 0.00 0.03 0.00 0.00 46.19 41.62 2a39 s LEU 33 CO 0.00 -0.67 1.10 -0.67 0.23 0.00 0.00 176.35 176.34 2a39 n ASP 34 N -0.62 1.74 -0.21 2.29 2.03 -0.64 -4.15 116.55 116.99 2a39 n ASP 34 Ca 0.08 1.09 0.10 0.00 0.52 0.00 0.00 54.79 56.57 2a39 n ASP 34 Cb 0.51 -1.40 0.38 0.00 -0.72 0.00 0.00 41.12 39.90 2a39 n ASP 34 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2a39 h SER 35 N 1.82 0.62 0.50 1.67 4.64 -1.09 -1.99 113.55 119.73 2a39 h SER 35 Ca -0.45 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2a39 h SER 35 Cb 1.32 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2a39 h SER 35 CO 0.59 0.36 0.00 0.18 -0.87 0.00 0.00 176.83 177.09 2a39 n LEU 36 N -4.51 0.00 -0.07 5.97 4.77 -1.26 -1.71 117.00 120.20 2a39 n LEU 36 Ca 0.14 0.27 0.12 0.00 -0.03 0.00 0.00 56.01 56.51 2a39 n LEU 36 Cb 0.36 -0.27 0.24 0.00 -2.33 0.00 0.00 43.42 41.42 2a39 n LEU 36 CO 0.32 -0.02 0.46 -1.20 -1.33 0.00 0.00 177.39 175.61 2a39 n SER 37 N -1.27 0.69 -4.83 -1.43 7.64 -0.75 -4.86 113.62 108.81 2a39 n SER 37 Ca 0.13 -0.48 -0.32 0.00 1.01 0.00 0.00 58.87 59.21 2a39 n SER 37 Cb 0.22 0.29 -0.02 0.00 -1.01 0.00 0.00 64.21 63.69 2a39 n SER 37 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2a39 s HIS 38 N -2.88 3.27 0.01 1.43 3.76 -0.69 -4.97 115.29 115.23 2a39 s HIS 38 Ca 0.14 1.49 -0.30 0.00 -0.15 0.00 0.00 55.06 56.24 2a39 s HIS 38 Cb 0.18 -2.88 -0.08 0.00 1.11 0.00 0.00 32.58 30.90 2a39 s HIS 38 CO 0.67 -0.63 1.96 -2.14 -0.85 0.00 0.00 174.74 173.76 2a39 s PRO 39 N -3.99 4.08 -0.16 8.40 0.02 -1.26 -4.84 135.00 137.24 2a39 s PRO 39 Ca 0.61 2.55 0.00 0.00 0.02 0.00 0.00 61.00 64.18 2a39 s PRO 39 Cb -0.12 -4.17 0.01 0.00 0.02 0.00 0.00 34.50 30.24 2a39 s PRO 39 CO 0.32 -1.02 -0.17 0.42 -0.33 0.00 0.00 177.00 176.22 2a39 s ILE 40 N 4.68 2.47 0.26 2.83 1.01 -1.26 -0.46 121.20 130.73 2a39 s ILE 40 Ca 0.88 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 60.73 2a39 s ILE 40 Cb -0.41 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 2a39 s ILE 40 CO 0.40 0.52 0.17 -1.38 0.00 0.00 0.00 174.94 174.65 2a39 s HIS 41 N 1.00 1.42 0.42 3.97 -3.43 0.01 -4.57 115.29 114.11 2a39 s HIS 41 Ca -0.02 -1.43 -0.21 0.00 -0.80 0.00 0.00 55.06 52.60 2a39 s HIS 41 Cb -0.15 -0.69 -0.11 0.00 -1.43 0.00 0.00 32.58 30.21 2a39 s HIS 41 CO -0.04 -0.64 0.95 1.03 -2.00 0.00 0.00 174.74 174.04 2a39 s ARG 42 N -3.92 4.24 0.74 -0.38 0.52 -1.11 -0.90 118.95 118.15 2a39 s ARG 42 Ca 0.39 1.13 -0.15 0.00 -0.52 0.00 0.00 55.73 56.57 2a39 s ARG 42 Cb 0.06 -2.21 0.04 0.00 0.52 0.00 0.00 34.95 33.36 2a39 s ARG 42 CO 0.17 -0.01 1.20 0.00 0.02 0.00 0.00 175.30 176.67 2a39 s ALA 43 N -2.15 2.10 0.38 2.13 0.00 0.07 -4.80 121.76 119.50 2a39 s ALA 43 Ca 0.61 0.84 -0.27 0.00 0.00 0.00 0.00 51.96 53.14 2a39 s ALA 43 Cb -0.09 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 19.46 2a39 s ALA 43 CO 0.14 -1.89 1.28 -0.85 0.00 0.00 0.00 175.76 174.44 2a39 n GLU 44 N -2.80 2.05 0.00 0.00 0.28 -1.26 -1.26 120.64 117.64 2a39 n GLU 44 Ca 0.13 0.72 0.00 0.00 -0.16 0.00 0.00 57.16 57.85 2a39 n GLU 44 Cb 0.50 -2.37 0.00 0.00 1.43 0.00 0.00 31.44 31.01 2a39 n GLU 44 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2a39 n GLY 45 N 0.78 1.79 3.88 -1.84 0.00 -1.26 -5.03 105.19 103.51 2a39 n GLY 45 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 2a39 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a39 s LEU 46 N 0.00 4.06 0.85 0.99 1.43 -0.39 -5.08 118.68 120.54 2a39 s LEU 46 Ca 0.00 -0.03 -0.12 0.00 -1.03 0.00 0.00 54.13 52.95 2a39 s LEU 46 Cb 0.00 -2.63 0.11 0.00 0.03 0.00 0.00 46.19 43.70 2a39 s LEU 46 CO 0.00 0.01 1.17 -0.83 0.23 0.00 0.00 176.35 176.94 2a39 s GLY 47 N -3.47 1.92 0.58 -3.19 0.00 -1.26 -4.89 107.32 97.01 2a39 s GLY 47 Ca 0.33 0.70 -0.20 0.00 0.00 0.00 0.00 44.72 45.55 2a39 s GLY 47 CO 0.26 1.12 1.31 2.56 0.00 0.00 0.00 173.10 178.35 2a39 s PRO 48 N -4.40 2.94 0.00 2.90 0.04 -1.26 -4.78 135.00 130.43 2a39 s PRO 48 Ca 0.70 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.84 2a39 s PRO 48 Cb -0.25 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2a39 s PRO 48 CO 0.54 -1.31 0.00 0.41 0.04 0.00 0.00 177.00 176.68 2a39 n GLY 49 N 0.75 -1.53 0.26 0.56 0.00 -1.26 -5.00 105.19 98.97 2a39 n GLY 49 Ca 0.13 -1.27 -0.02 0.00 0.00 0.00 0.00 46.02 44.86 2a39 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a39 n GLY 50 N -0.14 4.12 1.59 -0.02 0.00 -1.26 -2.75 105.19 106.73 2a39 n GLY 50 Ca 0.00 -2.13 -0.05 0.00 0.00 0.00 0.00 46.02 43.84 2a39 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 n GLY 52 N -0.61 2.35 3.74 0.00 0.00 -1.26 -4.35 105.19 105.05 2a39 n GLY 52 Ca 0.23 -1.78 -0.22 0.00 0.00 0.00 0.00 46.02 44.24 2a39 n GLY 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a39 s ASP 53 N 0.00 4.95 0.11 1.61 1.01 -1.26 -4.91 116.67 118.17 2a39 s ASP 53 Ca 0.00 -0.53 -0.36 0.00 0.71 0.00 0.00 52.55 52.37 2a39 s ASP 53 Cb 0.00 -1.01 -0.16 0.00 1.01 0.00 0.00 42.92 42.75 2a39 s ASP 53 CO 0.00 -0.10 1.31 1.87 0.21 0.00 0.00 175.17 178.46 2a39 n TRP 54 N -1.08 1.49 0.00 4.23 -0.00 -1.26 -1.71 117.44 119.11 2a39 n TRP 54 Ca -0.06 0.64 0.00 0.00 -0.00 0.00 0.00 57.50 58.08 2a39 n TRP 54 Cb 0.59 -2.33 0.00 0.00 -0.00 0.00 0.00 31.31 29.57 2a39 n TRP 54 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2a39 n GLY 55 N 2.44 0.14 3.24 5.87 0.00 0.10 -5.01 105.19 111.99 2a39 n GLY 55 Ca 0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 2a39 n GLY 55 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2a39 s ASN 56 N -2.02 1.60 0.75 1.61 0.01 -0.69 -4.81 114.94 111.38 2a39 s ASN 56 Ca 0.00 -1.06 -0.11 0.00 -0.71 0.00 0.00 52.86 50.98 2a39 s ASN 56 Cb 0.00 0.03 0.04 0.00 0.41 0.00 0.00 41.25 41.73 2a39 s ASN 56 CO 0.00 -0.41 1.09 -2.84 -1.51 0.00 0.00 177.10 173.43 2a39 s PRO 57 N -3.80 2.43 0.84 -0.60 0.02 -1.26 -1.88 135.00 130.75 2a39 s PRO 57 Ca 0.18 1.16 -0.11 0.00 0.02 0.00 0.00 61.00 62.25 2a39 s PRO 57 Cb 0.04 -1.92 0.10 0.00 0.02 0.00 0.00 34.50 32.74 2a39 s PRO 57 CO 0.01 -1.51 1.10 -1.25 -0.33 0.00 0.00 177.00 175.02 2a39 s PRO 58 N -4.84 1.68 0.33 5.54 0.04 -1.26 -4.76 135.00 131.73 2a39 s PRO 58 Ca 0.61 1.11 -0.29 0.00 0.04 0.00 0.00 61.00 62.47 2a39 s PRO 58 Cb -0.17 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 2a39 s PRO 58 CO 0.54 -2.03 1.35 -1.25 0.04 0.00 0.00 177.00 175.65 2a39 s PRO 59 N -4.86 4.31 0.48 0.56 0.04 -1.26 -4.89 135.00 129.38 2a39 s PRO 59 Ca 0.63 2.27 0.26 0.00 0.04 0.00 0.00 61.00 64.20 2a39 s PRO 59 Cb -0.18 -3.06 1.21 0.00 0.04 0.00 0.00 34.50 32.51 2a39 s PRO 59 CO 0.57 -0.26 1.96 0.87 0.04 0.00 0.00 177.00 180.18 2a39 h LYS 60 N 3.52 0.00 -0.00 4.56 1.57 -1.93 0.76 116.57 125.05 2a39 h LYS 60 Ca -0.49 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 2a39 h LYS 60 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2a39 h LYS 60 CO 0.67 0.17 -0.11 0.38 -0.57 0.00 0.00 179.45 179.99 2a39 h ASP 61 N 0.00 0.10 0.25 0.86 2.03 -2.01 -3.22 116.42 114.43 2a39 h ASP 61 Ca -0.00 -0.77 0.00 0.00 -0.73 0.00 0.00 57.03 55.52 2a39 h ASP 61 Cb 0.52 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.99 2a39 h ASP 61 CO 0.02 0.86 -1.05 1.33 -1.03 0.00 0.00 179.24 179.37 2a39 n VAL 62 N -4.62 0.07 -2.98 4.15 0.24 -1.22 -4.56 118.33 109.41 2a39 n VAL 62 Ca -0.09 -0.15 -0.24 0.00 -2.04 0.00 0.00 64.34 61.81 2a39 n VAL 62 Cb 0.43 0.46 -0.03 0.00 -1.47 0.00 0.00 33.84 33.23 2a39 n VAL 62 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2a39 h PRO 64 N 2.96 0.00 -3.80 0.00 0.13 -1.72 -3.42 132.00 126.16 2a39 h PRO 64 Ca 0.13 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.15 2a39 h PRO 64 Cb 0.67 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.71 2a39 h PRO 64 CO 0.73 0.20 -0.17 0.16 -0.23 0.00 0.00 178.00 178.69 2a39 s ASP 65 N -6.59 0.08 0.23 1.44 1.47 -1.26 -5.04 116.67 107.00 2a39 s ASP 65 Ca -0.03 -1.07 -0.07 0.00 1.18 0.00 0.00 52.55 52.56 2a39 s ASP 65 Cb 0.14 0.58 0.19 0.00 -0.34 0.00 0.00 42.92 43.50 2a39 s ASP 65 CO 0.65 -1.15 1.82 0.58 0.68 0.00 0.00 175.17 177.75 2a39 h VAL 66 N 2.26 1.26 -0.50 2.11 2.07 -1.88 -2.10 116.25 119.48 2a39 h VAL 66 Ca -0.28 -0.74 -0.12 0.00 0.82 0.00 0.00 66.70 66.38 2a39 h VAL 66 Cb 1.25 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2a39 h VAL 66 CO 0.38 0.32 -0.15 -0.33 0.02 0.00 0.00 177.57 177.81 2a39 h GLU 67 N 1.20 0.96 -0.24 1.57 3.07 -1.98 -1.40 114.58 117.77 2a39 h GLU 67 Ca 0.29 -0.37 -0.20 0.00 -0.50 0.00 0.00 59.36 58.58 2a39 h GLU 67 Cb 0.13 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 2a39 h GLU 67 CO -0.03 1.04 -0.63 0.77 -1.40 0.00 0.00 179.01 178.75 2a39 h SER 68 N 0.85 0.98 -1.00 1.42 0.02 -1.82 -3.04 113.55 110.95 2a39 h SER 68 Ca 0.13 -0.57 0.03 0.00 -0.84 0.00 0.00 61.79 60.54 2a39 h SER 68 Cb 0.70 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.90 2a39 h SER 68 CO 0.05 1.37 0.66 0.00 -1.14 0.00 0.00 176.83 177.77 2a39 h ALA 70 N 1.40 1.14 0.00 0.00 0.00 -1.15 -2.17 119.26 118.48 2a39 h ALA 70 Ca 0.39 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 2a39 h ALA 70 Cb -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2a39 h ALA 70 CO -0.11 0.09 -1.77 0.36 0.00 0.00 0.00 179.25 177.82 2a39 n LYS 71 N -3.37 0.69 0.08 0.00 2.85 -0.51 -3.74 118.16 114.16 2a39 n LYS 71 Ca -0.01 -0.12 0.12 0.00 -1.05 0.00 0.00 58.31 57.25 2a39 n LYS 71 Cb 0.23 -1.37 0.09 0.00 -0.65 0.00 0.00 35.03 33.33 2a39 n LYS 71 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 177.40 176.44 2a39 h ASN 72 N 0.00 0.00 -3.38 -5.58 2.35 -0.61 -3.44 115.58 104.92 2a39 h ASN 72 Ca -0.07 -0.13 -0.65 0.00 -0.55 0.00 0.00 56.30 54.89 2a39 h ASN 72 Cb 0.94 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.05 2a39 h ASN 72 CO 0.00 0.06 -0.71 0.00 -1.65 0.00 0.00 177.43 175.14 2a39 s ILE 74 N 1.07 3.19 -0.28 0.00 -1.09 -0.07 -1.79 121.20 122.23 2a39 s ILE 74 Ca 0.01 -0.63 -0.06 0.00 -2.23 0.00 0.00 60.65 57.75 2a39 s ILE 74 Cb -0.15 -2.33 0.01 0.00 -1.58 0.00 0.00 42.46 38.42 2a39 s ILE 74 CO -0.00 0.54 0.05 -0.32 -1.23 0.00 0.00 174.94 173.98 2a39 s MET 75 N 0.08 3.08 0.43 2.79 -2.45 0.15 -0.81 119.30 122.56 2a39 s MET 75 Ca -0.05 -0.85 -0.14 0.00 -1.25 0.00 0.00 55.69 53.40 2a39 s MET 75 Cb -0.14 -3.29 -0.08 0.00 1.25 0.00 0.00 34.83 32.57 2a39 s MET 75 CO 0.04 -0.42 0.85 -1.21 1.05 0.00 0.00 175.02 175.34 2a39 s GLU 76 N 1.47 3.91 0.69 4.11 0.41 0.39 0.85 118.70 130.54 2a39 s GLU 76 Ca 0.02 0.72 -0.12 0.00 -0.41 0.00 0.00 54.97 55.18 2a39 s GLU 76 Cb -0.17 -2.30 0.01 0.00 -1.78 0.00 0.00 34.13 29.90 2a39 s GLU 76 CO 0.01 -0.08 1.07 0.20 -0.49 0.00 0.00 175.26 175.98 2a39 s GLY 77 N -2.89 1.80 -0.30 -1.39 0.00 -0.93 -4.28 107.32 99.33 2a39 s GLY 77 Ca 0.55 0.23 -0.03 0.00 0.00 0.00 0.00 44.72 45.47 2a39 s GLY 77 CO 0.27 0.56 0.03 -0.42 0.00 0.00 0.00 173.10 173.54 2a39 s ILE 78 N -2.83 3.28 -0.43 0.90 1.01 -1.19 -4.64 121.20 117.29 2a39 s ILE 78 Ca 0.61 -1.20 0.23 0.00 0.00 0.00 0.00 60.65 60.29 2a39 s ILE 78 Cb -0.16 -2.83 0.33 0.00 0.01 0.00 0.00 42.46 39.82 2a39 s ILE 78 CO 0.51 -0.06 1.59 1.55 0.00 0.00 0.00 174.94 178.53 2a39 h PRO 79 N 8.08 0.00 -2.77 2.79 0.13 -1.82 0.16 132.00 138.57 2a39 h PRO 79 Ca -0.24 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.35 2a39 h PRO 79 Cb 1.08 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.81 2a39 h PRO 79 CO 0.56 0.00 -0.79 0.34 -0.23 0.00 0.00 178.00 177.89 2a39 s ASP 80 N -6.18 3.48 0.61 1.44 2.15 -1.26 -4.49 116.67 112.41 2a39 s ASP 80 Ca 0.07 -1.39 0.38 0.00 0.43 0.00 0.00 52.55 52.05 2a39 s ASP 80 Cb 0.05 -0.35 1.90 0.00 -0.30 0.00 0.00 42.92 44.22 2a39 s ASP 80 CO 0.67 -0.43 2.19 1.88 -0.17 0.00 0.00 175.17 179.31 2a39 h TYR 81 N 8.26 0.00 0.00 -5.34 -1.99 -1.82 -2.61 116.97 113.47 2a39 h TYR 81 Ca -0.17 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.54 2a39 h TYR 81 Cb 1.01 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.73 2a39 h TYR 81 CO 0.31 0.01 -0.09 0.66 -0.00 0.00 0.00 178.16 179.05 2a39 h SER 82 N 0.00 0.00 0.63 3.88 4.64 -1.90 0.20 113.55 120.99 2a39 h SER 82 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a39 h SER 82 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2a39 h SER 82 CO 0.00 0.09 0.00 1.56 -0.87 0.00 0.00 176.83 177.61 2a39 h GLN 83 N 0.00 0.00 -0.33 4.77 1.08 -1.77 -1.84 115.11 117.01 2a39 h GLN 83 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2a39 h GLN 83 Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 2a39 h GLN 83 CO 0.01 0.00 0.00 0.66 -0.95 0.00 0.00 178.83 178.55 2a39 n TYR 84 N -2.34 1.00 -1.59 2.96 4.02 0.02 -4.94 117.16 116.28 2a39 n TYR 84 Ca 0.01 -0.78 -0.05 0.00 -0.01 0.00 0.00 57.90 57.07 2a39 n TYR 84 Cb 0.20 -0.28 -0.01 0.00 -0.02 0.00 0.00 39.34 39.23 2a39 n TYR 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2a39 n GLY 85 N -0.11 0.49 3.03 2.72 0.00 -0.69 -4.42 105.19 106.20 2a39 n GLY 85 Ca 0.20 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 2a39 n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a39 s VAL 86 N -2.22 1.64 0.01 1.61 1.01 -0.99 -0.79 120.40 120.68 2a39 s VAL 86 Ca 0.00 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 2a39 s VAL 86 Cb 0.00 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 2a39 s VAL 86 CO 0.00 0.43 0.04 0.42 0.00 0.00 0.00 175.10 175.99 2a39 s THR 87 N 1.45 0.10 0.11 3.92 -4.23 -0.96 -2.71 115.64 113.32 2a39 s THR 87 Ca 0.04 -0.85 0.07 0.00 -1.18 0.00 0.00 61.69 59.77 2a39 s THR 87 Cb -0.13 -0.36 -0.04 0.00 1.34 0.00 0.00 72.50 73.31 2a39 s THR 87 CO -0.11 -0.47 -0.16 0.42 -0.54 0.00 0.00 174.62 173.77 2a39 s THR 88 N -1.51 1.43 -0.32 3.99 -4.23 -1.26 -0.74 115.64 112.99 2a39 s THR 88 Ca -0.15 -1.62 0.01 0.00 -1.18 0.00 0.00 61.69 58.75 2a39 s THR 88 Cb -0.09 -1.48 0.14 0.00 1.34 0.00 0.00 72.50 72.42 2a39 s THR 88 CO -0.00 -0.29 0.33 0.21 -0.54 0.00 0.00 174.62 174.33 2a39 s ASN 89 N -2.22 1.45 0.93 3.99 3.84 -0.41 -5.01 114.94 117.51 2a39 s ASN 89 Ca 0.07 -1.09 0.00 0.00 0.21 0.00 0.00 52.86 52.05 2a39 s ASN 89 Cb -0.07 0.54 0.00 0.00 -0.55 0.00 0.00 41.25 41.16 2a39 s ASN 89 CO 0.04 -0.34 0.00 0.61 -2.79 0.00 0.00 177.10 174.62 2a39 n GLY 90 N 4.87 1.15 0.81 1.21 0.00 -1.26 -1.67 105.19 110.31 2a39 n GLY 90 Ca 0.03 0.28 0.09 0.00 0.00 0.00 0.00 46.02 46.43 2a39 n GLY 90 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a39 n THR 91 N 0.00 0.38 -4.03 2.61 -2.24 -1.26 -1.88 114.28 107.85 2a39 n THR 91 Ca 0.00 -0.69 -0.34 0.00 -2.27 0.00 0.00 64.05 60.75 2a39 n THR 91 Cb 0.00 1.04 -0.07 0.00 -2.10 0.00 0.00 70.33 69.20 2a39 n THR 91 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2a39 s SER 92 N -1.28 5.97 -0.21 3.42 0.01 -0.67 -1.58 113.70 119.37 2a39 s SER 92 Ca 0.26 0.28 0.01 0.00 1.31 0.00 0.00 55.95 57.82 2a39 s SER 92 Cb 0.16 -1.82 0.05 0.00 0.21 0.00 0.00 66.02 64.63 2a39 s SER 92 CO 0.23 0.33 -0.08 -0.22 0.41 0.00 0.00 173.24 173.91 2a39 s LEU 93 N -1.45 2.39 -0.16 2.44 2.96 0.81 -1.29 118.68 124.38 2a39 s LEU 93 Ca 0.20 -1.01 -0.06 0.00 -0.22 0.00 0.00 54.13 53.04 2a39 s LEU 93 Cb -0.12 -1.19 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 2a39 s LEU 93 CO 0.10 -0.19 0.05 -0.60 -1.32 0.00 0.00 176.35 174.40 2a39 s ARG 94 N 1.40 3.72 -0.19 1.98 3.52 0.08 -0.98 118.95 128.49 2a39 s ARG 94 Ca -0.03 -0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.24 2a39 s ARG 94 Cb -0.17 -3.12 0.03 0.00 -1.56 0.00 0.00 34.95 30.13 2a39 s ARG 94 CO -0.07 0.41 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.15 2a39 s LEU 95 N -0.02 2.28 -0.22 -0.88 1.43 -0.39 -2.27 118.68 118.60 2a39 s LEU 95 Ca 0.06 -0.77 -0.08 0.00 -1.03 0.00 0.00 54.13 52.30 2a39 s LEU 95 Cb -0.12 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 2a39 s LEU 95 CO 0.01 -0.06 0.10 -1.10 0.23 0.00 0.00 176.35 175.53 2a39 s GLN 96 N 1.31 3.92 0.04 1.70 -0.21 0.03 -1.48 119.66 124.97 2a39 s GLN 96 Ca 0.02 -0.36 -0.17 0.00 0.02 0.00 0.00 55.36 54.87 2a39 s GLN 96 Cb -0.14 -3.36 -0.21 0.00 1.00 0.00 0.00 33.01 30.29 2a39 s GLN 96 CO -0.11 0.06 1.18 1.25 -2.12 0.00 0.00 175.29 175.56 2a39 h HIS 97 N 7.44 0.77 -3.66 0.91 -0.00 -1.65 -3.39 115.15 115.57 2a39 h HIS 97 Ca -0.37 -0.38 -0.51 0.00 -0.00 0.00 0.00 60.37 59.10 2a39 h HIS 97 Cb 1.17 -0.10 -0.32 0.00 -0.00 0.00 0.00 27.41 28.16 2a39 h HIS 97 CO 0.63 1.19 -0.82 0.42 -0.00 0.00 0.00 177.93 179.36 2a39 s ILE 98 N -3.44 1.16 0.61 6.26 1.01 -1.25 -2.72 121.20 122.83 2a39 s ILE 98 Ca -0.12 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 59.96 2a39 s ILE 98 Cb 0.05 -1.03 0.04 0.00 0.01 0.00 0.00 42.46 41.52 2a39 s ILE 98 CO 0.85 0.35 0.89 -0.76 0.00 0.00 0.00 174.94 176.27 2a39 s LEU 99 N 0.36 3.12 0.60 2.97 1.43 0.61 -4.73 118.68 123.03 2a39 s LEU 99 Ca -0.09 0.37 0.32 0.00 -1.03 0.00 0.00 54.13 53.70 2a39 s LEU 99 Cb -0.13 -3.14 1.89 0.00 0.03 0.00 0.00 46.19 44.84 2a39 s LEU 99 CO 0.03 -1.26 2.26 -0.65 0.23 0.00 0.00 176.35 176.95 2a39 h PRO 100 N -0.22 0.00 -0.27 1.29 0.11 -1.98 0.12 132.00 131.05 2a39 h PRO 100 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2a39 h PRO 100 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2a39 h PRO 100 CO 0.58 0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 177.98 2a39 n ASP 101 N -3.70 1.64 0.00 -2.05 5.68 -1.26 -4.94 116.55 111.93 2a39 n ASP 101 Ca -0.03 -1.90 0.00 0.00 -0.50 0.00 0.00 54.79 52.36 2a39 n ASP 101 Cb 0.10 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 2a39 n ASP 101 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2a39 n GLY 102 N 1.04 2.90 3.76 6.12 0.00 0.03 -5.05 105.19 113.98 2a39 n GLY 102 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2a39 n GLY 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a39 s ARG 103 N -0.82 2.88 -0.67 1.61 0.52 -1.26 -4.77 118.95 116.45 2a39 s ARG 103 Ca 0.00 1.52 0.05 0.00 -0.52 0.00 0.00 55.73 56.78 2a39 s ARG 103 Cb 0.00 -1.95 0.20 0.00 0.52 0.00 0.00 34.95 33.72 2a39 s ARG 103 CO 0.00 -1.21 0.57 0.28 0.02 0.00 0.00 175.30 174.96 2a39 n VAL 104 N -2.10 1.68 0.20 3.52 0.31 -1.26 -0.29 118.33 120.39 2a39 n VAL 104 Ca 0.11 -4.89 0.04 0.00 -0.01 0.00 0.00 64.34 59.59 2a39 n VAL 104 Cb 0.51 -2.13 0.42 0.00 -0.91 0.00 0.00 33.84 31.73 2a39 n VAL 104 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2a39 h PRO 105 N 5.00 0.00 -6.95 5.55 0.13 -1.80 -3.47 132.00 130.45 2a39 h PRO 105 Ca 0.17 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.71 2a39 h PRO 105 Cb 0.73 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.85 2a39 h PRO 105 CO 0.73 0.32 -1.03 0.45 -0.23 0.00 0.00 178.00 178.25 2a39 n SER 106 N -4.00 -4.15 -4.76 1.44 2.88 -1.10 -4.80 113.62 99.13 2a39 n SER 106 Ca -0.02 -1.27 -0.39 0.00 -1.33 0.00 0.00 58.87 55.87 2a39 n SER 106 Cb 0.38 -1.57 0.01 0.00 -0.75 0.00 0.00 64.21 62.28 2a39 n SER 106 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2a39 s PRO 107 N -7.17 3.70 -0.15 -1.46 0.04 -1.26 -4.70 135.00 124.01 2a39 s PRO 107 Ca 0.43 2.19 -0.00 0.00 0.04 0.00 0.00 61.00 63.66 2a39 s PRO 107 Cb -0.24 -2.59 0.03 0.00 0.04 0.00 0.00 34.50 31.75 2a39 s PRO 107 CO 0.96 -0.72 -0.08 0.50 0.04 0.00 0.00 177.00 177.70 2a39 s ARG 108 N -2.48 1.63 0.21 4.56 3.52 -1.26 -2.29 118.95 122.83 2a39 s ARG 108 Ca 0.62 -0.46 0.09 0.00 -0.13 0.00 0.00 55.73 55.84 2a39 s ARG 108 Cb -0.39 -1.92 -0.05 0.00 -1.56 0.00 0.00 34.95 31.04 2a39 s ARG 108 CO 0.49 -0.35 -0.18 0.14 -0.81 0.00 0.00 175.30 174.59 2a39 s VAL 109 N 1.62 1.97 0.24 7.11 -7.23 0.35 -1.62 120.40 122.84 2a39 s VAL 109 Ca 0.02 -2.14 0.11 0.00 -1.81 0.00 0.00 61.98 58.16 2a39 s VAL 109 Cb -0.14 -2.04 -0.05 0.00 0.56 0.00 0.00 36.38 34.71 2a39 s VAL 109 CO -0.08 -0.43 -0.21 -0.31 -0.31 0.00 0.00 175.10 173.76 2a39 s TYR 110 N -2.47 2.23 -0.26 2.82 2.02 0.08 -1.07 117.35 120.69 2a39 s TYR 110 Ca 0.22 -0.36 -0.15 0.00 -0.37 0.00 0.00 57.07 56.40 2a39 s TYR 110 Cb -0.04 -1.02 -0.04 0.00 -0.40 0.00 0.00 41.96 40.47 2a39 s TYR 110 CO 0.09 0.61 0.38 -1.17 -1.57 0.00 0.00 175.55 173.88 2a39 s LEU 111 N -3.20 4.05 0.26 -1.29 2.96 -0.85 -1.55 118.68 119.07 2a39 s LEU 111 Ca 0.26 0.32 -0.06 0.00 -0.22 0.00 0.00 54.13 54.43 2a39 s LEU 111 Cb -0.06 -2.44 -0.06 0.00 0.50 0.00 0.00 46.19 44.14 2a39 s LEU 111 CO 0.12 -0.17 0.54 -0.76 -1.32 0.00 0.00 176.35 174.77 2a39 s LEU 112 N 1.96 4.10 0.00 -0.68 1.43 0.36 -1.37 118.68 124.48 2a39 s LEU 112 Ca 0.16 0.76 -0.14 0.00 -1.03 0.00 0.00 54.13 53.87 2a39 s LEU 112 Cb -0.16 -3.56 0.20 0.00 0.03 0.00 0.00 46.19 42.71 2a39 s LEU 112 CO 0.09 -0.15 0.97 -0.90 0.23 0.00 0.00 176.35 176.60 2a39 n ASP 113 N -0.65 -0.61 0.29 2.29 5.68 0.43 -1.99 116.55 121.99 2a39 n ASP 113 Ca -0.01 -1.25 0.13 0.00 -0.50 0.00 0.00 54.79 53.16 2a39 n ASP 113 Cb 0.53 -0.79 0.83 0.00 -1.14 0.00 0.00 41.12 40.56 2a39 n ASP 113 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2a39 h LYS 114 N 0.00 0.00 0.00 0.11 3.64 -1.87 -1.57 116.57 116.88 2a39 h LYS 114 Ca -0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2a39 h LYS 114 Cb 0.94 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 2a39 h LYS 114 CO 0.23 0.01 -0.14 1.79 -2.27 0.00 0.00 179.45 179.07 2a39 h THR 115 N 0.00 0.00 0.00 1.00 1.35 -1.92 -3.48 112.91 109.87 2a39 h THR 115 Ca -0.00 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2a39 h THR 115 Cb 0.03 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2a39 h THR 115 CO 0.00 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.56 2a39 n LYS 116 N -2.51 -0.72 -0.02 4.72 5.02 -0.59 -4.81 118.16 119.25 2a39 n LYS 116 Ca 0.05 0.18 0.04 0.00 -2.02 0.00 0.00 58.31 56.56 2a39 n LYS 116 Cb 0.47 -3.91 0.05 0.00 -0.02 0.00 0.00 35.03 31.62 2a39 n LYS 116 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2a39 n ARG 117 N -1.23 0.59 -3.77 1.97 3.00 -1.26 -3.66 116.66 112.29 2a39 n ARG 117 Ca 0.00 -1.14 -0.13 0.00 -0.01 0.00 0.00 57.85 56.58 2a39 n ARG 117 Cb 0.18 -1.16 -0.10 0.00 0.00 0.00 0.00 32.46 31.38 2a39 n ARG 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2a39 s ARG 118 N -0.73 0.47 0.56 5.56 3.52 -1.26 -4.54 118.95 122.53 2a39 s ARG 118 Ca 0.11 0.15 -0.19 0.00 -0.13 0.00 0.00 55.73 55.67 2a39 s ARG 118 Cb 0.07 0.22 -0.05 0.00 -1.56 0.00 0.00 34.95 33.63 2a39 s ARG 118 CO 0.10 -0.10 1.13 0.71 -0.81 0.00 0.00 175.30 176.34 2a39 s TYR 119 N -0.47 2.64 -0.19 5.12 2.02 0.19 -0.43 117.35 126.24 2a39 s TYR 119 Ca -0.06 1.54 -0.29 0.00 -0.37 0.00 0.00 57.07 57.89 2a39 s TYR 119 Cb -0.04 -3.29 -0.03 0.00 -0.40 0.00 0.00 41.96 38.20 2a39 s TYR 119 CO 0.02 -1.64 1.58 -2.00 -1.57 0.00 0.00 175.55 171.94 2a39 s GLU 120 N -3.38 3.90 -0.24 -0.62 2.56 -0.47 -4.43 118.70 116.02 2a39 s GLU 120 Ca 0.72 1.72 -0.21 0.00 0.00 0.00 0.00 54.97 57.21 2a39 s GLU 120 Cb -0.24 -4.00 -0.02 0.00 2.00 0.00 0.00 34.13 31.88 2a39 s GLU 120 CO 0.29 -1.16 0.66 -1.64 -0.56 0.00 0.00 175.26 172.85 2a39 s MET 121 N 4.45 4.14 -0.06 4.30 -1.94 -1.26 -4.48 119.30 124.44 2a39 s MET 121 Ca 0.70 0.62 -0.16 0.00 -1.71 0.00 0.00 55.69 55.14 2a39 s MET 121 Cb -0.26 -3.63 -0.05 0.00 2.01 0.00 0.00 34.83 32.90 2a39 s MET 121 CO 0.28 -0.40 0.42 -0.51 -0.01 0.00 0.00 175.02 174.80 2a39 s LEU 122 N 2.44 4.37 -0.54 -0.03 2.01 0.00 -4.84 118.68 122.09 2a39 s LEU 122 Ca 0.28 0.85 0.04 0.00 0.01 0.00 0.00 54.13 55.31 2a39 s LEU 122 Cb -0.16 -2.61 0.14 0.00 0.01 0.00 0.00 46.19 43.58 2a39 s LEU 122 CO 0.09 0.17 0.31 -1.00 1.01 0.00 0.00 176.35 176.93 2a39 s HIS 123 N -0.24 3.00 -1.06 0.29 3.76 -1.26 -1.55 115.29 118.22 2a39 s HIS 123 Ca 0.24 -3.06 0.23 0.00 -0.15 0.00 0.00 55.06 52.32 2a39 s HIS 123 Cb -0.16 -2.58 0.21 0.00 1.11 0.00 0.00 32.58 31.17 2a39 s HIS 123 CO 0.11 -0.71 1.21 1.28 -0.85 0.00 0.00 174.74 175.79 2a39 n LEU 124 N 2.92 0.76 -4.65 0.89 4.77 -1.21 -4.84 117.00 115.64 2a39 n LEU 124 Ca 0.10 -0.23 -0.43 0.00 -0.03 0.00 0.00 56.01 55.42 2a39 n LEU 124 Cb 0.34 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2a39 n LEU 124 CO 0.30 0.18 1.63 0.41 -1.33 0.00 0.00 177.39 178.58 2a39 n THR 125 N -1.42 0.69 -0.40 -5.08 -1.04 -1.26 -1.09 114.28 104.67 2a39 n THR 125 Ca 0.05 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 2a39 n THR 125 Cb 0.34 -2.30 0.00 0.00 -1.82 0.00 0.00 70.33 66.55 2a39 n THR 125 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2a39 n GLY 126 N 4.72 0.78 3.08 3.41 0.00 0.17 -4.95 105.19 112.40 2a39 n GLY 126 Ca 0.22 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 2a39 n GLY 126 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2a39 n PHE 127 N -2.31 -0.11 -4.22 1.61 3.72 -0.25 -4.50 117.46 111.39 2a39 n PHE 127 Ca 0.00 -2.48 -0.18 0.00 -0.05 0.00 0.00 57.45 54.74 2a39 n PHE 127 Cb 0.00 0.07 -0.11 0.00 -0.94 0.00 0.00 39.48 38.50 2a39 n PHE 127 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 2a39 s GLU 128 N -3.39 0.98 -0.07 -1.08 -1.05 0.38 -1.34 118.70 113.13 2a39 s GLU 128 Ca 0.24 -1.18 0.02 0.00 -0.15 0.00 0.00 54.97 53.90 2a39 s GLU 128 Cb 0.01 -0.87 0.01 0.00 -0.44 0.00 0.00 34.13 32.85 2a39 s GLU 128 CO 0.17 0.17 -0.11 0.12 0.95 0.00 0.00 175.26 176.55 2a39 s PHE 129 N -2.01 1.42 0.05 4.83 2.19 -0.32 -1.39 117.98 122.74 2a39 s PHE 129 Ca 0.07 -0.53 0.02 0.00 0.33 0.00 0.00 56.93 56.81 2a39 s PHE 129 Cb -0.06 -1.06 -0.03 0.00 -1.31 0.00 0.00 43.02 40.57 2a39 s PHE 129 CO 0.03 -0.29 -0.07 0.99 1.83 0.00 0.00 175.22 177.71 2a39 s THR 130 N 0.75 0.54 0.15 0.12 2.01 0.24 -1.36 115.64 118.07 2a39 s THR 130 Ca -0.13 -1.23 -0.17 0.00 0.31 0.00 0.00 61.69 60.47 2a39 s THR 130 Cb -0.16 -0.79 0.03 0.00 0.01 0.00 0.00 72.50 71.60 2a39 s THR 130 CO 0.03 -0.48 0.45 0.72 -0.69 0.00 0.00 174.62 174.64 2a39 s PHE 131 N -1.82 -0.19 -0.05 4.92 -0.71 -0.94 -0.95 117.98 118.25 2a39 s PHE 131 Ca -0.06 -0.13 -0.04 0.00 -1.04 0.00 0.00 56.93 55.66 2a39 s PHE 131 Cb -0.07 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 42.01 2a39 s PHE 131 CO -0.01 -0.78 0.14 -0.51 -1.34 0.00 0.00 175.22 172.72 2a39 s ASP 132 N -2.83 6.18 0.03 1.98 1.01 -0.17 -0.90 116.67 121.98 2a39 s ASP 132 Ca 0.05 0.34 0.02 0.00 0.71 0.00 0.00 52.55 53.68 2a39 s ASP 132 Cb 0.01 -1.93 -0.02 0.00 1.01 0.00 0.00 42.92 41.99 2a39 s ASP 132 CO -0.09 0.33 -0.07 0.54 0.21 0.00 0.00 175.17 176.08 2a39 s VAL 133 N -1.17 0.53 -0.35 -1.27 0.11 -0.19 -0.77 120.40 117.30 2a39 s VAL 133 Ca 0.21 -0.88 0.02 0.00 -2.93 0.00 0.00 61.98 58.39 2a39 s VAL 133 Cb -0.12 -0.57 0.10 0.00 -1.53 0.00 0.00 36.38 34.26 2a39 s VAL 133 CO 0.11 -0.26 0.08 -0.62 -3.33 0.00 0.00 175.10 171.09 2a39 s ASP 134 N -1.24 4.89 -0.08 3.54 -1.08 -0.81 -2.24 116.67 119.66 2a39 s ASP 134 Ca -0.07 -1.99 0.18 0.00 -0.52 0.00 0.00 52.55 50.15 2a39 s ASP 134 Cb -0.08 -1.69 0.63 0.00 -1.46 0.00 0.00 42.92 40.33 2a39 s ASP 134 CO 0.00 -0.40 1.54 0.00 0.52 0.00 0.00 175.17 176.84 2a39 n ALA 135 N 4.39 2.80 0.26 3.66 0.00 -1.26 -3.27 120.51 127.09 2a39 n ALA 135 Ca -0.01 -1.53 0.11 0.00 0.00 0.00 0.00 53.44 52.01 2a39 n ALA 135 Cb 0.42 -0.88 0.69 0.00 0.00 0.00 0.00 19.45 19.67 2a39 n ALA 135 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2a39 h THR 136 N 3.65 0.70 -0.91 0.00 1.35 -1.90 -2.94 112.91 112.87 2a39 h THR 136 Ca 0.00 -0.51 -0.50 0.00 -0.55 0.00 0.00 66.41 64.84 2a39 h THR 136 Cb 1.26 1.31 -0.28 0.00 -1.73 0.00 0.00 68.15 68.71 2a39 h THR 136 CO 0.15 0.12 0.64 0.29 -0.25 0.00 0.00 175.52 176.48 2a39 n LYS 137 N -3.83 2.22 -3.89 4.72 5.02 -1.26 -4.78 118.16 116.36 2a39 n LYS 137 Ca -0.02 -2.80 -0.30 0.00 -2.02 0.00 0.00 58.31 53.17 2a39 n LYS 137 Cb 0.23 -2.10 -0.15 0.00 -0.02 0.00 0.00 35.03 32.99 2a39 n LYS 137 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2a39 s LEU 138 N -3.11 3.77 0.91 -0.35 1.43 -1.11 -3.24 118.68 116.99 2a39 s LEU 138 Ca 0.53 -2.24 -0.13 0.00 -1.03 0.00 0.00 54.13 51.27 2a39 s LEU 138 Cb 0.44 -1.36 0.18 0.00 0.03 0.00 0.00 46.19 45.49 2a39 s LEU 138 CO 0.08 -0.35 1.26 -2.16 0.23 0.00 0.00 176.35 175.40 2a39 s PRO 139 N 0.80 0.86 0.45 1.29 0.04 -1.26 -0.66 135.00 136.52 2a39 s PRO 139 Ca 0.13 -0.56 -0.22 0.00 0.04 0.00 0.00 61.00 60.39 2a39 s PRO 139 Cb -0.21 -1.95 -0.12 0.00 0.04 0.00 0.00 34.50 32.27 2a39 s PRO 139 CO -0.10 -2.21 0.56 0.00 0.04 0.00 0.00 177.00 175.29 2a39 n GLY 141 N 1.75 2.94 3.84 0.00 0.00 -1.26 -4.43 105.19 108.04 2a39 n GLY 141 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2a39 n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2a39 s MET 142 N -0.18 4.06 -0.22 1.61 1.00 -0.95 -4.28 119.30 120.34 2a39 s MET 142 Ca 0.00 0.79 -0.01 0.00 0.00 0.00 0.00 55.69 56.46 2a39 s MET 142 Cb 0.00 -2.36 0.06 0.00 0.00 0.00 0.00 34.83 32.53 2a39 s MET 142 CO 0.00 0.10 0.01 1.21 0.00 0.00 0.00 175.02 176.35 2a39 s ASN 143 N -2.26 3.37 -0.18 3.03 3.84 -0.32 -4.42 114.94 117.99 2a39 s ASN 143 Ca 0.56 -1.04 -0.18 0.00 0.21 0.00 0.00 52.86 52.41 2a39 s ASN 143 Cb -0.10 -0.83 -0.03 0.00 -0.55 0.00 0.00 41.25 39.74 2a39 s ASN 143 CO 0.16 -0.29 0.50 -0.94 -2.79 0.00 0.00 177.10 173.74 2a39 s SER 144 N 1.67 6.58 0.10 -4.21 1.04 -0.23 -1.65 113.70 117.01 2a39 s SER 144 Ca -0.01 0.70 0.08 0.00 0.48 0.00 0.00 55.95 57.20 2a39 s SER 144 Cb -0.18 -2.29 -0.04 0.00 0.10 0.00 0.00 66.02 63.62 2a39 s SER 144 CO -0.09 -0.13 -0.21 0.00 0.98 0.00 0.00 173.24 173.78 2a39 s ALA 145 N 1.39 1.83 -0.23 5.32 0.00 0.16 -1.87 121.76 128.37 2a39 s ALA 145 Ca 0.24 -1.25 -0.03 0.00 0.00 0.00 0.00 51.96 50.91 2a39 s ALA 145 Cb -0.15 -0.25 0.12 0.00 0.00 0.00 0.00 23.12 22.83 2a39 s ALA 145 CO 0.10 0.37 0.31 -1.17 0.00 0.00 0.00 175.76 175.37 2a39 s LEU 146 N -1.91 -0.41 0.30 0.00 0.20 0.74 -1.31 118.68 116.30 2a39 s LEU 146 Ca 0.07 0.04 -0.14 0.00 0.69 0.00 0.00 54.13 54.79 2a39 s LEU 146 Cb -0.10 0.80 0.02 0.00 -0.43 0.00 0.00 46.19 46.48 2a39 s LEU 146 CO 0.04 -0.31 0.60 -0.72 -0.29 0.00 0.00 176.35 175.68 2a39 s TYR 147 N 2.45 0.29 -0.03 5.38 1.13 0.11 -0.86 117.35 125.81 2a39 s TYR 147 Ca 0.10 -0.72 0.06 0.00 -1.41 0.00 0.00 57.07 55.10 2a39 s TYR 147 Cb -0.16 0.41 -0.01 0.00 -1.10 0.00 0.00 41.96 41.11 2a39 s TYR 147 CO -0.14 -1.20 -0.20 -0.51 -2.51 0.00 0.00 175.55 170.98 2a39 s LEU 148 N -3.04 2.01 0.09 -3.49 1.43 -0.29 -0.17 118.68 115.22 2a39 s LEU 148 Ca 0.19 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 52.99 2a39 s LEU 148 Cb -0.03 -1.09 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 2a39 s LEU 148 CO 0.11 0.23 -0.22 -0.44 0.23 0.00 0.00 176.35 176.25 2a39 s SER 149 N -0.29 2.66 -1.33 2.29 0.01 -0.65 -0.50 113.70 115.89 2a39 s SER 149 Ca 0.03 -0.64 -0.11 0.00 1.31 0.00 0.00 55.95 56.54 2a39 s SER 149 Cb -0.10 -0.18 0.13 0.00 0.21 0.00 0.00 66.02 66.09 2a39 s SER 149 CO 0.01 0.11 1.96 1.21 0.41 0.00 0.00 173.24 176.94 2a39 n GLU 150 N 1.31 3.40 -2.44 12.44 2.13 -0.60 -1.16 120.64 135.72 2a39 n GLU 150 Ca -0.18 -3.28 -0.30 0.00 0.66 0.00 0.00 57.16 54.06 2a39 n GLU 150 Cb 0.53 -3.04 -0.01 0.00 0.27 0.00 0.00 31.44 29.19 2a39 n GLU 150 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 2a39 s MET 151 N 1.24 3.70 0.25 5.31 -1.94 -1.26 -3.70 119.30 122.92 2a39 s MET 151 Ca 0.42 0.57 -0.30 0.00 -1.71 0.00 0.00 55.69 54.67 2a39 s MET 151 Cb 0.10 -2.25 -0.09 0.00 2.01 0.00 0.00 34.83 34.60 2a39 s MET 151 CO -0.02 -0.27 1.26 -1.58 -0.01 0.00 0.00 175.02 174.40 2a39 s HIS 152 N -2.73 3.26 0.46 -0.03 2.46 -1.26 -4.72 115.29 112.72 2a39 s HIS 152 Ca 0.53 1.38 0.13 0.00 0.47 0.00 0.00 55.06 57.57 2a39 s HIS 152 Cb -0.10 -3.56 1.06 0.00 -0.13 0.00 0.00 32.58 29.85 2a39 s HIS 152 CO 0.41 -1.60 2.06 -1.35 -2.47 0.00 0.00 174.74 171.79 2a39 h PRO 153 N 4.45 0.31 -0.61 2.88 0.11 -1.96 -1.42 132.00 135.76 2a39 h PRO 153 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2a39 h PRO 153 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2a39 h PRO 153 CO 0.71 0.20 0.00 0.25 -0.21 0.00 0.00 178.00 178.96 2a39 n THR 154 N -4.48 1.04 -1.41 -1.15 -2.24 -1.26 -0.63 114.28 104.14 2a39 n THR 154 Ca 0.04 -1.01 -0.06 0.00 -2.27 0.00 0.00 64.05 60.75 2a39 n THR 154 Cb 0.20 0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 68.89 2a39 n THR 154 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a39 n GLY 155 N 1.26 0.65 3.08 3.38 0.00 -0.53 -1.02 105.19 112.01 2a39 n GLY 155 Ca 0.21 -0.76 -0.17 0.00 0.00 0.00 0.00 46.02 45.30 2a39 n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 n ALA 156 N 0.50 -1.24 -1.66 4.61 0.00 -1.26 -4.13 120.51 117.33 2a39 n ALA 156 Ca -0.06 0.19 -0.46 0.00 0.00 0.00 0.00 53.44 53.11 2a39 n ALA 156 Cb 0.28 -3.61 -0.03 0.00 0.00 0.00 0.00 19.45 16.09 2a39 n ALA 156 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2a39 n LYS 157 N -3.87 1.98 -3.24 0.00 4.81 -1.12 -4.81 118.16 111.91 2a39 n LYS 157 Ca -0.08 0.71 -0.07 0.00 -0.87 0.00 0.00 58.31 58.00 2a39 n LYS 157 Cb 0.58 -2.39 0.02 0.00 0.02 0.00 0.00 35.03 33.27 2a39 n LYS 157 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2a39 n SER 158 N 2.50 -1.86 -0.21 3.14 3.41 0.15 -4.96 113.62 115.79 2a39 n SER 158 Ca 0.13 -2.28 -0.02 0.00 -0.26 0.00 0.00 58.87 56.44 2a39 n SER 158 Cb 0.30 3.10 0.09 0.00 -0.26 0.00 0.00 64.21 67.43 2a39 n SER 158 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2a39 h LYS 159 N 0.00 0.58 -0.01 4.33 3.64 -2.00 -2.03 116.57 121.08 2a39 h LYS 159 Ca -0.27 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2a39 h LYS 159 Cb 1.00 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2a39 h LYS 159 CO 0.34 0.39 -0.05 0.66 -2.27 0.00 0.00 179.45 178.52 2a39 n TYR 160 N -4.84 0.00 -3.30 1.91 4.01 -1.26 -4.29 117.16 109.39 2a39 n TYR 160 Ca 0.07 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.56 2a39 n TYR 160 Cb 0.17 -0.03 -0.08 0.00 -0.31 0.00 0.00 39.34 39.10 2a39 n TYR 160 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2a39 n ASN 161 N -0.01 1.07 0.19 7.72 5.15 -0.78 -4.73 115.26 123.87 2a39 n ASN 161 Ca 0.18 -2.86 0.06 0.00 -0.60 0.00 0.00 54.58 51.36 2a39 n ASN 161 Cb 0.35 -0.64 0.34 0.00 -0.53 0.00 0.00 39.78 39.30 2a39 n ASN 161 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2a39 h PRO 162 N 4.29 0.00 0.23 1.20 0.13 -1.69 0.45 132.00 136.60 2a39 h PRO 162 Ca 0.13 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 2a39 h PRO 162 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 2a39 h PRO 162 CO 0.55 0.36 -0.11 0.78 -0.23 0.00 0.00 178.00 179.35 2a39 h GLY 163 N 2.12 -0.32 0.00 1.56 0.00 -1.92 -3.47 103.07 101.05 2a39 h GLY 163 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2a39 h GLY 163 CO 0.05 -0.12 0.00 0.61 0.00 0.00 0.00 176.54 177.08 2a39 n GLY 164 N -0.79 0.44 0.28 4.60 0.00 -1.24 -3.39 105.19 105.09 2a39 n GLY 164 Ca -0.09 -0.82 0.13 0.00 0.00 0.00 0.00 46.02 45.23 2a39 n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 h ALA 165 N -0.64 1.69 -0.35 4.61 0.00 -1.31 -1.78 119.26 121.47 2a39 h ALA 165 Ca 0.00 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.01 2a39 h ALA 165 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2a39 h ALA 165 CO 0.00 0.00 0.28 -0.92 0.00 0.00 0.00 179.25 178.61 2a39 h TYR 166 N 0.00 0.00 -0.27 0.00 5.03 -1.62 -0.85 116.97 119.26 2a39 h TYR 166 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2a39 h TYR 166 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.28 2a39 h TYR 166 CO 0.00 0.00 0.00 0.66 -1.32 0.00 0.00 178.16 177.50 2a39 n TYR 167 N -4.22 0.49 -2.18 -3.82 4.02 -0.69 -5.00 117.16 105.76 2a39 n TYR 167 Ca 0.06 -0.60 -0.04 0.00 -0.01 0.00 0.00 57.90 57.30 2a39 n TYR 167 Cb 0.46 -0.10 0.00 0.00 -0.02 0.00 0.00 39.34 39.68 2a39 n TYR 167 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2a39 n GLY 168 N 0.08 0.29 3.89 2.72 0.00 -0.33 -2.82 105.19 109.02 2a39 n GLY 168 Ca 0.12 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 2a39 n GLY 168 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2a39 s THR 169 N -2.34 3.85 0.00 2.61 -4.23 -1.12 -1.46 115.64 112.95 2a39 s THR 169 Ca 0.02 0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 2a39 s THR 169 Cb -0.01 -3.57 0.00 0.00 1.34 0.00 0.00 72.50 70.26 2a39 s THR 169 CO 0.02 -0.69 0.00 0.61 -0.54 0.00 0.00 174.62 174.02 2a39 n GLY 170 N -2.79 0.86 3.73 3.99 0.00 -1.26 -4.46 105.19 105.25 2a39 n GLY 170 Ca 0.06 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2a39 n GLY 170 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2a39 n TYR 171 N -2.27 2.11 -3.46 1.61 9.36 -1.26 -4.56 117.16 118.68 2a39 n TYR 171 Ca 0.00 0.43 -0.13 0.00 3.32 0.00 0.00 57.90 61.52 2a39 n TYR 171 Cb 0.00 -2.33 -0.03 0.00 -0.63 0.00 0.00 39.34 36.35 2a39 n TYR 171 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2a39 n ASP 173 N -0.03 -1.75 0.00 0.00 5.68 -1.20 -4.75 116.55 114.49 2a39 n ASP 173 Ca -0.17 -2.24 0.14 0.00 -0.50 0.00 0.00 54.79 52.02 2a39 n ASP 173 Cb 0.63 2.93 0.82 0.00 -1.14 0.00 0.00 41.12 44.36 2a39 n ASP 173 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2a39 n ALA 174 N -1.13 2.53 0.81 2.12 0.00 -1.10 -2.12 120.51 121.63 2a39 n ALA 174 Ca -0.13 -0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.26 2a39 n ALA 174 Cb 0.46 -1.45 0.23 0.00 0.00 0.00 0.00 19.45 18.68 2a39 n ALA 174 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2a39 n GLN 175 N -1.01 0.13 -3.63 0.00 1.13 -1.26 -4.21 117.38 108.52 2a39 n GLN 175 Ca 0.21 0.03 -0.24 0.00 -1.94 0.00 0.00 57.00 55.06 2a39 n GLN 175 Cb 0.10 -1.58 0.07 0.00 0.11 0.00 0.00 30.24 28.94 2a39 n GLN 175 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2a39 s PHE 177 N -3.33 2.87 -0.22 0.00 0.08 -1.25 -3.92 117.98 112.20 2a39 s PHE 177 Ca 0.53 1.53 -0.19 0.00 0.12 0.00 0.00 56.93 58.91 2a39 s PHE 177 Cb -0.24 -3.08 -0.03 0.00 -0.57 0.00 0.00 43.02 39.11 2a39 s PHE 177 CO 0.75 -1.27 0.56 0.08 -0.10 0.00 0.00 175.22 175.24 2a39 s VAL 178 N -2.31 5.06 0.12 -0.44 1.01 -1.26 -0.61 120.40 121.96 2a39 s VAL 178 Ca 0.66 1.01 0.07 0.00 0.00 0.00 0.00 61.98 63.72 2a39 s VAL 178 Cb -0.18 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 2a39 s VAL 178 CO 0.35 0.12 -0.17 0.42 0.00 0.00 0.00 175.10 175.82 2a39 s THR 179 N 2.00 1.50 0.46 3.92 -4.23 -1.26 0.03 115.64 118.06 2a39 s THR 179 Ca 0.25 -1.63 0.17 0.00 -1.18 0.00 0.00 61.69 59.29 2a39 s THR 179 Cb -0.16 -1.51 0.21 0.00 1.34 0.00 0.00 72.50 72.38 2a39 s THR 179 CO 0.09 -0.25 2.04 1.55 -0.54 0.00 0.00 174.62 177.51 2a39 h PRO 180 N 3.78 0.00 -6.03 3.99 0.13 -1.60 -3.41 132.00 128.86 2a39 h PRO 180 Ca -0.42 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.10 2a39 h PRO 180 Cb 1.19 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.03 2a39 h PRO 180 CO 0.45 0.14 -0.85 -0.06 -0.23 0.00 0.00 178.00 177.45 2a39 s PHE 181 N -4.66 1.85 -0.06 1.56 0.40 -1.26 -0.99 117.98 114.82 2a39 s PHE 181 Ca -0.04 -0.35 -0.00 0.00 -0.60 0.00 0.00 56.93 55.94 2a39 s PHE 181 Cb 0.16 -1.18 0.03 0.00 0.51 0.00 0.00 43.02 42.53 2a39 s PHE 181 CO 0.67 -0.02 -0.02 0.42 0.70 0.00 0.00 175.22 176.98 2a39 s ILE 182 N -0.52 0.42 -1.56 0.64 1.01 -0.21 -4.79 121.20 116.20 2a39 s ILE 182 Ca 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.70 2a39 s ILE 182 Cb -0.08 -0.52 0.01 0.00 0.01 0.00 0.00 42.46 41.88 2a39 s ILE 182 CO -0.01 0.23 0.61 0.59 0.00 0.00 0.00 174.94 176.37 2a39 n ASN 183 N 4.60 -6.06 -0.53 3.58 3.02 -1.26 -1.69 115.26 116.92 2a39 n ASN 183 Ca -0.16 -0.29 -0.07 0.00 -0.03 0.00 0.00 54.58 54.02 2a39 n ASN 183 Cb 0.50 -4.90 -0.03 0.00 -0.61 0.00 0.00 39.78 34.74 2a39 n ASN 183 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2a39 n GLY 184 N -1.52 0.82 3.33 7.41 0.00 -1.26 -4.82 105.19 109.14 2a39 n GLY 184 Ca -0.11 -0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 2a39 n GLY 184 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a39 s LEU 185 N -1.57 2.12 0.11 0.99 1.43 -0.68 -4.46 118.68 116.62 2a39 s LEU 185 Ca 0.00 -0.46 -0.34 0.00 -1.03 0.00 0.00 54.13 52.30 2a39 s LEU 185 Cb 0.00 -1.35 -0.14 0.00 0.03 0.00 0.00 46.19 44.73 2a39 s LEU 185 CO 0.00 0.32 1.63 0.61 0.23 0.00 0.00 176.35 179.13 2a39 n GLY 186 N 2.37 1.17 2.65 -3.19 0.00 -1.26 -1.04 105.19 105.88 2a39 n GLY 186 Ca -0.16 0.69 -0.41 0.00 0.00 0.00 0.00 46.02 46.14 2a39 n GLY 186 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2a39 n ASN 187 N 3.98 6.75 -0.32 1.61 5.15 -0.17 -4.79 115.26 127.48 2a39 n ASN 187 Ca 0.18 -3.12 0.20 0.00 -0.60 0.00 0.00 54.58 51.24 2a39 n ASN 187 Cb 0.29 -1.42 0.40 0.00 -0.53 0.00 0.00 39.78 38.52 2a39 n ASN 187 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 2a39 h ILE 188 N 3.12 0.27 -0.05 -1.44 1.08 -1.89 -0.62 117.51 117.98 2a39 h ILE 188 Ca 0.57 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.95 2a39 h ILE 188 Cb 0.45 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.20 2a39 h ILE 188 CO 1.55 0.05 0.00 -0.62 -0.69 0.00 0.00 178.15 178.44 2a39 n GLU 189 N -5.15 1.57 -3.15 2.37 1.02 -1.26 -4.89 120.64 111.14 2a39 n GLU 189 Ca 0.28 -0.83 -0.19 0.00 -0.02 0.00 0.00 57.16 56.40 2a39 n GLU 189 Cb 0.88 -1.45 0.05 0.00 -0.02 0.00 0.00 31.44 30.90 2a39 n GLU 189 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2a39 n GLY 190 N 1.12 -0.29 3.84 0.62 0.00 -0.24 -5.01 105.19 105.24 2a39 n GLY 190 Ca 0.19 0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2a39 n GLY 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a39 s LYS 191 N -5.80 2.18 0.21 1.61 1.02 -1.26 -4.95 119.74 112.75 2a39 s LYS 191 Ca 0.37 0.45 0.03 0.00 0.02 0.00 0.00 55.97 56.84 2a39 s LYS 191 Cb -0.16 -1.95 -0.03 0.00 -0.52 0.00 0.00 37.83 35.17 2a39 s LYS 191 CO 0.46 -1.51 0.34 0.20 -0.92 0.00 0.00 175.35 173.92 2a39 s GLY 192 N -4.18 1.45 -0.39 -3.33 0.00 -0.55 -4.41 107.32 95.91 2a39 s GLY 192 Ca 0.61 -1.11 -0.08 0.00 0.00 0.00 0.00 44.72 44.13 2a39 s GLY 192 CO 0.52 -1.11 0.21 -0.45 0.00 0.00 0.00 173.10 172.27 2a39 s SER 193 N -3.64 5.54 -0.03 1.64 0.15 0.22 -2.24 113.70 115.33 2a39 s SER 193 Ca 0.35 -1.40 0.03 0.00 0.70 0.00 0.00 55.95 55.63 2a39 s SER 193 Cb -0.10 -1.95 -0.03 0.00 -1.71 0.00 0.00 66.02 62.23 2a39 s SER 193 CO 0.29 -0.47 -0.11 0.00 1.20 0.00 0.00 173.24 174.15 2a39 n ASN 196 N -0.11 1.68 -3.73 0.00 3.02 -1.26 -2.71 115.26 112.13 2a39 n ASN 196 Ca -0.06 1.09 -0.14 0.00 -0.03 0.00 0.00 54.58 55.43 2a39 n ASN 196 Cb 0.60 -1.39 -0.14 0.00 -0.61 0.00 0.00 39.78 38.24 2a39 n ASN 196 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2a39 s GLU 197 N -1.98 0.09 -0.32 3.52 2.12 -0.90 -1.56 118.70 119.67 2a39 s GLU 197 Ca 0.61 0.42 -0.05 0.00 0.36 0.00 0.00 54.97 56.31 2a39 s GLU 197 Cb -0.57 -0.19 0.04 0.00 0.26 0.00 0.00 34.13 33.67 2a39 s GLU 197 CO 0.58 -0.19 0.07 1.41 -0.54 0.00 0.00 175.26 176.59 2a39 s MET 198 N 1.37 2.64 -0.75 4.30 -2.45 0.34 -0.53 119.30 124.22 2a39 s MET 198 Ca -0.07 -1.16 -0.20 0.00 -1.25 0.00 0.00 55.69 53.01 2a39 s MET 198 Cb -0.12 -3.37 0.10 0.00 1.25 0.00 0.00 34.83 32.70 2a39 s MET 198 CO -0.06 -0.62 0.97 -0.51 1.05 0.00 0.00 175.02 175.85 2a39 s ASP 199 N 1.38 6.35 0.04 1.11 1.01 0.14 -1.13 116.67 125.55 2a39 s ASP 199 Ca -0.02 -1.47 -0.23 0.00 0.71 0.00 0.00 52.55 51.54 2a39 s ASP 199 Cb -0.19 -2.39 -0.16 0.00 1.01 0.00 0.00 42.92 41.19 2a39 s ASP 199 CO 0.02 -1.24 1.46 0.40 0.21 0.00 0.00 175.17 176.02 2a39 h ILE 200 N 5.90 1.25 -3.28 0.77 2.04 -1.80 0.03 117.51 122.43 2a39 h ILE 200 Ca -0.12 -0.79 -0.32 0.00 1.00 0.00 0.00 64.86 64.63 2a39 h ILE 200 Cb 1.06 1.65 -0.36 0.00 -0.74 0.00 0.00 36.82 38.43 2a39 h ILE 200 CO 1.13 0.22 -0.69 0.86 0.00 0.00 0.00 178.15 179.67 2a39 s TRP 201 N -4.95 -0.04 -0.25 1.37 -0.11 -0.04 -4.57 118.94 110.36 2a39 s TRP 201 Ca -0.15 0.36 -0.02 0.00 1.22 0.00 0.00 56.10 57.52 2a39 s TRP 201 Cb 0.04 -0.32 0.08 0.00 -1.50 0.00 0.00 33.47 31.77 2a39 s TRP 201 CO 0.69 -0.19 0.06 -1.21 -4.62 0.00 0.00 176.95 171.68 2a39 s GLU 202 N 1.87 0.67 0.27 5.86 2.02 -0.96 -0.18 118.70 128.24 2a39 s GLU 202 Ca -0.00 -0.68 -0.19 0.00 0.02 0.00 0.00 54.97 54.12 2a39 s GLU 202 Cb -0.12 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.13 2a39 s GLU 202 CO -0.04 -0.80 0.65 0.00 0.02 0.00 0.00 175.26 175.09 2a39 s ALA 203 N 1.78 -0.98 0.00 5.21 0.00 -0.78 -1.35 121.76 125.64 2a39 s ALA 203 Ca 0.03 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.56 2a39 s ALA 203 Cb -0.17 0.91 0.00 0.00 0.00 0.00 0.00 23.12 23.85 2a39 s ALA 203 CO -0.17 -0.98 0.00 0.27 0.00 0.00 0.00 175.76 174.88 2a39 n ASN 204 N -0.43 0.00 -0.09 0.00 0.23 -0.75 -1.06 115.26 113.14 2a39 n ASN 204 Ca -0.04 -0.49 0.16 0.00 -0.53 0.00 0.00 54.58 53.68 2a39 n ASN 204 Cb 0.60 0.00 0.85 0.00 -2.08 0.00 0.00 39.78 39.15 2a39 n ASN 204 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2a39 n SER 205 N -1.39 0.30 -0.05 0.53 3.41 0.16 -3.78 113.62 112.81 2a39 n SER 205 Ca 0.00 -1.04 -0.05 0.00 -0.26 0.00 0.00 58.87 57.52 2a39 n SER 205 Cb 0.00 -0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 63.86 2a39 n SER 205 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2a39 n ARG 206 N -0.79 2.34 -3.78 4.33 5.12 -1.26 -3.66 116.66 118.96 2a39 n ARG 206 Ca 0.22 -0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 56.03 2a39 n ARG 206 Cb 0.17 -1.24 -0.08 0.00 -1.16 0.00 0.00 32.46 30.15 2a39 n ARG 206 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2a39 s ALA 207 N -2.23 -0.61 -0.04 7.54 0.00 -1.25 -4.68 121.76 120.49 2a39 s ALA 207 Ca -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2a39 s ALA 207 Cb 0.03 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.45 2a39 s ALA 207 CO 0.38 -0.38 0.02 0.45 0.00 0.00 0.00 175.76 176.24 2a39 s SER 208 N -1.96 0.99 0.04 0.00 0.15 -1.26 -1.81 113.70 109.84 2a39 s SER 208 Ca -0.06 -0.00 0.07 0.00 0.70 0.00 0.00 55.95 56.66 2a39 s SER 208 Cb -0.02 -0.25 -0.02 0.00 -1.71 0.00 0.00 66.02 64.02 2a39 s SER 208 CO -0.02 -0.18 -0.21 -2.28 1.20 0.00 0.00 173.24 171.74 2a39 s HIS 209 N 1.68 1.87 -0.02 3.44 5.04 -0.46 -4.42 115.29 122.43 2a39 s HIS 209 Ca -0.01 -0.38 0.04 0.00 -1.54 0.00 0.00 55.06 53.18 2a39 s HIS 209 Cb -0.13 -1.12 -0.01 0.00 0.04 0.00 0.00 32.58 31.36 2a39 s HIS 209 CO -0.03 0.08 -0.13 0.08 -2.34 0.00 0.00 174.74 172.40 2a39 s VAL 210 N -0.77 1.01 -0.30 0.89 1.01 -0.69 -2.27 120.40 119.28 2a39 s VAL 210 Ca 0.08 -0.53 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 2a39 s VAL 210 Cb -0.09 -0.85 0.15 0.00 0.00 0.00 0.00 36.38 35.59 2a39 s VAL 210 CO 0.02 0.29 0.84 0.00 0.00 0.00 0.00 175.10 176.25 2a39 s ALA 211 N -0.20 -2.39 0.32 5.51 0.00 -0.00 -0.98 121.76 124.02 2a39 s ALA 211 Ca 0.03 2.19 -0.27 0.00 0.00 0.00 0.00 51.96 53.92 2a39 s ALA 211 Cb -0.06 -1.91 -0.09 0.00 0.00 0.00 0.00 23.12 21.06 2a39 s ALA 211 CO -0.00 -0.90 1.00 -1.25 0.00 0.00 0.00 175.76 174.60 2a39 s PRO 212 N 2.57 4.53 -0.16 0.00 0.04 -1.26 -0.69 135.00 140.04 2a39 s PRO 212 Ca -0.04 1.48 -0.02 0.00 0.04 0.00 0.00 61.00 62.45 2a39 s PRO 212 Cb -0.08 -2.87 0.05 0.00 0.04 0.00 0.00 34.50 31.63 2a39 s PRO 212 CO -0.18 0.20 0.01 -1.01 0.04 0.00 0.00 177.00 176.06 2a39 s HIS 213 N -1.49 1.10 0.37 0.56 3.76 0.31 -1.94 115.29 117.97 2a39 s HIS 213 Ca 0.50 -0.74 -0.04 0.00 -0.15 0.00 0.00 55.06 54.62 2a39 s HIS 213 Cb -0.23 -1.04 -0.04 0.00 1.11 0.00 0.00 32.58 32.38 2a39 s HIS 213 CO 0.29 -0.54 0.64 0.95 -0.85 0.00 0.00 174.74 175.23 2a39 s THR 214 N 1.83 4.99 0.06 1.30 -4.23 -1.26 -2.12 115.64 116.20 2a39 s THR 214 Ca 0.01 0.02 0.04 0.00 -1.18 0.00 0.00 61.69 60.58 2a39 s THR 214 Cb -0.15 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 69.85 2a39 s THR 214 CO -0.07 -0.56 -0.12 0.00 -0.54 0.00 0.00 174.62 173.32 2a39 n ASN 216 N 1.41 3.21 -4.24 0.00 0.23 -0.30 -4.83 115.26 110.74 2a39 n ASN 216 Ca -0.21 -2.57 -0.18 0.00 -0.53 0.00 0.00 54.58 51.08 2a39 n ASN 216 Cb 0.54 -0.62 -0.11 0.00 -2.08 0.00 0.00 39.78 37.51 2a39 n ASN 216 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2a39 s LYS 217 N -1.53 1.00 -0.10 -3.83 -0.14 -1.26 -5.13 119.74 108.76 2a39 s LYS 217 Ca 0.24 -1.20 -0.10 0.00 -1.36 0.00 0.00 55.97 53.55 2a39 s LYS 217 Cb 0.19 -0.92 -0.05 0.00 -1.68 0.00 0.00 37.83 35.38 2a39 s LYS 217 CO 0.05 0.18 0.21 0.15 -0.76 0.00 0.00 175.35 175.19 2a39 s LYS 218 N -2.53 3.67 1.86 1.68 1.02 -1.26 -4.72 119.74 119.45 2a39 s LYS 218 Ca 0.08 0.01 0.00 0.00 0.02 0.00 0.00 55.97 56.08 2a39 s LYS 218 Cb -0.06 -3.23 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 2a39 s LYS 218 CO 0.03 0.69 0.00 0.41 -0.92 0.00 0.00 175.35 175.56 2a39 n GLY 219 N 2.15 -1.07 3.69 -3.33 0.00 -1.26 -4.70 105.19 100.67 2a39 n GLY 219 Ca -0.18 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 2a39 n GLY 219 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2a39 s LEU 220 N 0.00 4.29 -0.10 0.99 0.20 -1.24 -4.54 118.68 118.28 2a39 s LEU 220 Ca 0.00 1.82 0.04 0.00 0.69 0.00 0.00 54.13 56.68 2a39 s LEU 220 Cb 0.00 -3.56 -0.00 0.00 -0.43 0.00 0.00 46.19 42.20 2a39 s LEU 220 CO 0.00 -0.55 -0.23 -0.47 -0.29 0.00 0.00 176.35 174.81 2a39 s TYR 221 N 2.02 2.57 -0.45 5.38 5.04 0.68 -4.96 117.35 127.63 2a39 s TYR 221 Ca 0.56 -0.98 -0.23 0.00 -2.44 0.00 0.00 57.07 53.97 2a39 s TYR 221 Cb -0.25 -1.71 0.03 0.00 0.35 0.00 0.00 41.96 40.38 2a39 s TYR 221 CO 0.23 -0.38 0.78 -0.51 -1.34 0.00 0.00 175.55 174.33 2a39 s LEU 222 N 0.29 4.26 0.33 6.97 1.43 -1.26 -1.82 118.68 128.88 2a39 s LEU 222 Ca -0.17 -0.12 -0.05 0.00 -1.03 0.00 0.00 54.13 52.76 2a39 s LEU 222 Cb -0.17 -2.96 -0.05 0.00 0.03 0.00 0.00 46.19 43.04 2a39 s LEU 222 CO 0.08 -0.91 0.60 0.00 0.23 0.00 0.00 176.35 176.35 2a39 s GLU 224 N -3.84 0.52 6.34 0.00 2.56 -1.26 -1.47 118.70 121.54 2a39 s GLU 224 Ca 0.44 -0.74 0.00 0.00 0.00 0.00 0.00 54.97 54.68 2a39 s GLU 224 Cb -0.10 -0.28 0.00 0.00 2.00 0.00 0.00 34.13 35.74 2a39 s GLU 224 CO 0.33 0.05 0.00 0.41 -0.56 0.00 0.00 175.26 175.49 2a39 n GLY 225 N 1.51 3.55 0.20 -1.50 0.00 -1.26 -1.93 105.19 105.75 2a39 n GLY 225 Ca -0.23 -0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.94 2a39 n GLY 225 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2a39 h GLU 226 N 0.00 0.00 0.00 1.61 4.39 -1.98 -2.34 114.58 116.26 2a39 h GLU 226 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2a39 h GLU 226 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2a39 h GLU 226 CO 0.00 0.00 -0.03 0.93 -1.16 0.00 0.00 179.01 178.75 2a39 h GLU 227 N 0.00 0.00 0.00 2.33 5.08 -1.74 -1.09 114.58 119.17 2a39 h GLU 227 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2a39 h GLU 227 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2a39 h GLU 227 CO 0.00 0.03 -0.25 0.00 -1.00 0.00 0.00 179.01 177.79 2a39 n ALA 229 N -1.71 -0.70 -0.31 0.00 0.00 -0.41 -4.82 120.51 112.56 2a39 n ALA 229 Ca 0.05 -1.53 0.08 0.00 0.00 0.00 0.00 53.44 52.05 2a39 n ALA 229 Cb 0.40 0.07 0.24 0.00 0.00 0.00 0.00 19.45 20.16 2a39 n ALA 229 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2a39 h PHE 230 N -1.21 0.87 -0.39 0.00 3.04 -1.91 0.32 116.94 117.66 2a39 h PHE 230 Ca -0.33 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.58 2a39 h PHE 230 Cb 1.00 -0.25 -0.05 0.00 2.56 0.00 0.00 35.95 39.21 2a39 h PHE 230 CO 0.00 0.22 0.10 0.39 -2.02 0.00 0.00 178.31 177.01 2a39 n GLU 231 N -4.82 2.83 0.00 1.11 -0.58 -1.26 -4.83 120.64 113.09 2a39 n GLU 231 Ca 0.18 -1.78 0.00 0.00 -0.42 0.00 0.00 57.16 55.14 2a39 n GLU 231 Cb 0.45 -1.87 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 2a39 n GLU 231 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2a39 n GLY 232 N 0.14 1.55 0.00 0.62 0.00 0.11 -4.91 105.19 102.70 2a39 n GLY 232 Ca 0.21 -1.74 0.14 0.00 0.00 0.00 0.00 46.02 44.62 2a39 n GLY 232 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2a39 n VAL 233 N 0.00 0.10 -4.12 1.61 0.24 -0.54 -4.85 118.33 110.77 2a39 n VAL 233 Ca 0.00 0.03 -0.16 0.00 -2.04 0.00 0.00 64.34 62.17 2a39 n VAL 233 Cb 0.00 -0.57 -0.12 0.00 -1.47 0.00 0.00 33.84 31.69 2a39 n VAL 233 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2a39 s ASP 235 N -1.70 6.20 0.15 0.00 2.15 0.29 -4.89 116.67 118.86 2a39 s ASP 235 Ca -0.05 -0.90 -0.12 0.00 0.43 0.00 0.00 52.55 51.91 2a39 s ASP 235 Cb -0.10 -2.41 0.01 0.00 -0.30 0.00 0.00 42.92 40.12 2a39 s ASP 235 CO 0.01 -1.38 1.60 0.11 -0.17 0.00 0.00 175.17 175.34 2a39 h LYS 236 N 9.50 0.86 0.08 4.34 1.57 -1.88 -3.24 116.57 127.79 2a39 h LYS 236 Ca -0.28 -0.27 -0.25 0.00 -1.87 0.00 0.00 60.65 57.97 2a39 h LYS 236 Cb 1.07 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 2a39 h LYS 236 CO 1.16 0.90 -1.19 -0.91 -0.57 0.00 0.00 179.45 178.84 2a39 h ASN 237 N 0.72 0.26 -3.91 0.86 2.35 -1.93 -3.48 115.58 110.44 2a39 h ASN 237 Ca 0.14 -0.28 0.07 0.00 -0.55 0.00 0.00 56.30 55.67 2a39 h ASN 237 Cb 0.51 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.77 2a39 h ASN 237 CO 0.02 1.22 -0.19 0.61 -1.65 0.00 0.00 177.43 177.45 2a39 n GLY 238 N 1.48 -2.29 3.32 2.83 0.00 -1.22 -4.67 105.19 104.63 2a39 n GLY 238 Ca -0.06 -1.41 -0.46 0.00 0.00 0.00 0.00 46.02 44.09 2a39 n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 s GLY 240 N 3.36 2.66 -0.19 0.00 0.00 -1.26 -4.02 107.32 107.87 2a39 s GLY 240 Ca 0.06 0.52 -0.02 0.00 0.00 0.00 0.00 44.72 45.28 2a39 s GLY 240 CO 0.01 0.91 0.02 0.86 0.00 0.00 0.00 173.10 174.90 2a39 s TRP 241 N -1.80 1.17 -0.13 1.90 -0.11 -0.15 -4.98 118.94 114.85 2a39 s TRP 241 Ca 0.55 -0.91 -0.06 0.00 1.22 0.00 0.00 56.10 56.90 2a39 s TRP 241 Cb -0.16 -1.08 0.05 0.00 -1.50 0.00 0.00 33.47 30.78 2a39 s TRP 241 CO 0.21 -0.61 0.29 1.21 -4.62 0.00 0.00 176.95 173.44 2a39 s ASN 242 N 1.81 -0.28 0.26 5.86 3.84 -1.26 -1.71 114.94 123.46 2a39 s ASN 242 Ca -0.01 0.63 -0.01 0.00 0.21 0.00 0.00 52.86 53.68 2a39 s ASN 242 Cb -0.17 0.54 0.55 0.00 -0.55 0.00 0.00 41.25 41.63 2a39 s ASN 242 CO -0.08 -0.18 1.73 -0.55 -2.79 0.00 0.00 177.10 175.23 2a39 h ASN 243 N 7.28 0.36 -0.88 -4.21 -1.07 -1.84 -0.72 115.58 114.50 2a39 h ASN 243 Ca -0.37 0.12 -0.02 0.00 0.07 0.00 0.00 56.30 56.09 2a39 h ASN 243 Cb 1.16 0.08 -0.04 0.00 -2.07 0.00 0.00 38.32 37.45 2a39 h ASN 243 CO 0.33 0.11 0.47 1.88 0.07 0.00 0.00 177.43 180.29 2a39 h TYR 244 N 0.48 1.22 0.00 4.14 0.05 -1.82 -1.15 116.97 119.90 2a39 h TYR 244 Ca 0.47 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.21 2a39 h TYR 244 Cb 0.75 -0.39 0.00 0.00 1.01 0.00 0.00 36.73 38.10 2a39 h TYR 244 CO -0.14 0.85 0.00 0.00 -1.05 0.00 0.00 178.16 177.82 2a39 h ARG 245 N 1.24 0.00 -0.27 4.88 3.08 -0.99 -2.11 114.38 120.21 2a39 h ARG 245 Ca 0.31 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.34 2a39 h ARG 245 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2a39 h ARG 245 CO -0.05 0.00 -0.00 1.33 -1.07 0.00 0.00 179.97 180.18 2a39 n VAL 246 N -2.69 2.31 -2.63 2.04 0.24 -0.87 -4.98 118.33 111.75 2a39 n VAL 246 Ca -0.00 -1.98 -0.12 0.00 -2.04 0.00 0.00 64.34 60.19 2a39 n VAL 246 Cb 0.19 -0.27 0.02 0.00 -1.47 0.00 0.00 33.84 32.31 2a39 n VAL 246 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2a39 n ASN 247 N -0.61 -4.06 -4.11 -1.34 5.15 -0.79 -1.49 115.26 108.00 2a39 n ASN 247 Ca 0.23 -0.14 -0.34 0.00 -0.60 0.00 0.00 54.58 53.72 2a39 n ASN 247 Cb 0.91 -2.98 -0.13 0.00 -0.53 0.00 0.00 39.78 37.04 2a39 n ASN 247 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2a39 s VAL 248 N -2.86 2.88 -2.20 3.44 1.01 -0.49 -4.73 120.40 117.45 2a39 s VAL 248 Ca 0.15 -1.89 0.22 0.00 0.00 0.00 0.00 61.98 60.46 2a39 s VAL 248 Cb -0.07 -2.89 0.05 0.00 0.00 0.00 0.00 36.38 33.47 2a39 s VAL 248 CO 0.19 -0.44 1.09 0.35 0.00 0.00 0.00 175.10 176.29 2a39 n THR 249 N 4.51 0.00 -0.82 3.92 -2.24 -1.26 -3.51 114.28 114.87 2a39 n THR 249 Ca -0.05 -0.34 0.08 0.00 -2.27 0.00 0.00 64.05 61.47 2a39 n THR 249 Cb 0.42 1.31 0.20 0.00 -2.10 0.00 0.00 70.33 70.16 2a39 n THR 249 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2a39 n ASP 250 N 0.35 3.27 0.10 3.42 5.75 -1.26 -4.69 116.55 123.49 2a39 n ASP 250 Ca 0.10 -2.82 -0.23 0.00 -0.01 0.00 0.00 54.79 51.84 2a39 n ASP 250 Cb 0.48 -0.44 -0.13 0.00 -1.03 0.00 0.00 41.12 40.00 2a39 n ASP 250 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 2a39 h TYR 251 N 1.30 1.02 -3.38 2.11 3.20 -1.91 -2.43 116.97 116.88 2a39 h TYR 251 Ca 0.00 -0.66 -0.35 0.00 3.14 0.00 0.00 58.73 60.86 2a39 h TYR 251 Cb 1.17 -0.08 -0.37 0.00 1.54 0.00 0.00 36.73 39.00 2a39 h TYR 251 CO 0.31 1.50 -0.74 -0.47 -1.64 0.00 0.00 178.16 177.12 2a39 s TYR 252 N -2.92 0.10 0.00 -3.82 6.14 -1.26 0.47 117.35 116.05 2a39 s TYR 252 Ca -0.09 0.18 0.00 0.00 0.64 0.00 0.00 57.07 57.80 2a39 s TYR 252 Cb 0.05 -0.42 0.00 0.00 0.42 0.00 0.00 41.96 42.01 2a39 s TYR 252 CO 0.94 -0.16 0.00 0.41 0.64 0.00 0.00 175.55 177.37 2a39 n GLY 253 N 4.89 -0.62 3.57 8.97 0.00 -0.83 -4.80 105.19 116.37 2a39 n GLY 253 Ca -0.12 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.47 2a39 n GLY 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a39 s ARG 254 N -2.00 3.50 0.00 1.61 0.52 -1.24 -1.24 118.95 120.10 2a39 s ARG 254 Ca 0.00 0.19 0.00 0.00 -0.52 0.00 0.00 55.73 55.40 2a39 s ARG 254 Cb 0.00 -4.01 0.00 0.00 0.52 0.00 0.00 34.95 31.46 2a39 s ARG 254 CO 0.00 -1.64 0.00 0.41 0.02 0.00 0.00 175.30 174.09 2a39 n GLY 255 N 5.06 3.78 0.34 -3.53 0.00 -1.26 -4.90 105.19 104.67 2a39 n GLY 255 Ca 0.08 -1.68 0.18 0.00 0.00 0.00 0.00 46.02 44.59 2a39 n GLY 255 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2a39 h GLU 256 N 0.00 0.00 0.00 1.61 4.39 -1.97 -2.11 114.58 116.50 2a39 h GLU 256 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2a39 h GLU 256 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2a39 h GLU 256 CO 0.00 0.00 0.00 -0.85 -1.16 0.00 0.00 179.01 177.00 2a39 n GLU 257 N -3.44 0.61 -4.04 2.33 0.00 -1.26 -4.75 120.64 110.09 2a39 n GLU 257 Ca -0.00 0.01 -0.33 0.00 0.00 0.00 0.00 57.16 56.84 2a39 n GLU 257 Cb 0.28 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.16 2a39 n GLU 257 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2a39 s PHE 258 N -2.34 3.34 0.20 -1.84 0.08 -0.79 -4.90 117.98 111.72 2a39 s PHE 258 Ca 0.34 0.22 -0.11 0.00 0.12 0.00 0.00 56.93 57.50 2a39 s PHE 258 Cb 0.19 -1.74 0.13 0.00 -0.57 0.00 0.00 43.02 41.03 2a39 s PHE 258 CO 0.39 0.57 1.81 0.87 -0.10 0.00 0.00 175.22 178.76 2a39 h LYS 259 N 3.88 0.98 -4.74 0.44 1.57 -0.96 -3.34 116.57 114.40 2a39 h LYS 259 Ca -0.49 -0.11 -0.68 0.00 -1.87 0.00 0.00 60.65 57.50 2a39 h LYS 259 Cb 1.18 -0.19 -0.23 0.00 0.08 0.00 0.00 32.23 33.07 2a39 h LYS 259 CO 0.65 0.73 -0.55 0.08 -0.57 0.00 0.00 179.45 179.79 2a39 s VAL 260 N -5.85 4.60 -0.39 0.50 1.01 0.18 -5.01 120.40 115.43 2a39 s VAL 260 Ca -0.13 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.15 2a39 s VAL 260 Cb 0.14 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 33.14 2a39 s VAL 260 CO 0.79 -0.00 0.49 0.21 0.00 0.00 0.00 175.10 176.59 2a39 s ASN 261 N 1.60 6.25 0.00 3.32 2.47 -1.26 -1.97 114.94 125.36 2a39 s ASN 261 Ca 0.04 -0.36 0.17 0.00 0.42 0.00 0.00 52.86 53.13 2a39 s ASN 261 Cb -0.18 -2.25 1.02 0.00 -1.45 0.00 0.00 41.25 38.39 2a39 s ASN 261 CO 0.06 -0.56 1.56 0.35 -3.72 0.00 0.00 177.10 174.79 2a39 n THR 262 N 5.50 0.00 0.99 -5.21 -2.24 -0.37 -2.34 114.28 110.61 2a39 n THR 262 Ca -0.06 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.86 2a39 n THR 262 Cb 0.48 -0.38 0.60 0.00 -2.10 0.00 0.00 70.33 68.93 2a39 n THR 262 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2a39 n LEU 263 N -0.81 0.05 -4.23 3.22 4.32 -1.26 -3.70 117.00 114.59 2a39 n LEU 263 Ca 0.13 0.48 -0.13 0.00 -0.02 0.00 0.00 56.01 56.46 2a39 n LEU 263 Cb 0.06 -0.48 -0.10 0.00 -1.62 0.00 0.00 43.42 41.28 2a39 n LEU 263 CO 0.10 0.00 -0.37 -0.54 -1.22 0.00 0.00 177.39 175.35 2a39 s LYS 264 N -3.00 1.03 0.70 3.23 1.02 -0.99 -4.93 119.74 116.80 2a39 s LYS 264 Ca 0.14 -1.46 -0.16 0.00 0.02 0.00 0.00 55.97 54.51 2a39 s LYS 264 Cb 0.19 -0.40 0.02 0.00 -0.52 0.00 0.00 37.83 37.12 2a39 s LYS 264 CO 0.54 -0.02 1.20 -2.14 -0.92 0.00 0.00 175.35 174.01 2a39 s PRO 265 N -3.83 2.33 0.31 -1.68 0.02 -1.26 -4.81 135.00 126.09 2a39 s PRO 265 Ca 0.18 1.75 -0.15 0.00 0.02 0.00 0.00 61.00 62.80 2a39 s PRO 265 Cb 0.05 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.73 2a39 s PRO 265 CO 0.01 -1.68 0.64 -0.59 -0.33 0.00 0.00 177.00 175.04 2a39 s PHE 266 N -1.94 0.23 -0.07 6.54 -0.71 -0.95 -4.70 117.98 116.38 2a39 s PHE 266 Ca 0.74 -0.69 0.04 0.00 -1.04 0.00 0.00 56.93 55.98 2a39 s PHE 266 Cb -0.29 0.49 -0.02 0.00 -1.21 0.00 0.00 43.02 41.99 2a39 s PHE 266 CO 0.43 -1.25 -0.17 0.99 -1.34 0.00 0.00 175.22 173.88 2a39 s THR 267 N -3.37 2.80 -0.17 -4.49 2.01 0.22 -1.02 115.64 111.61 2a39 s THR 267 Ca 0.18 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 2a39 s THR 267 Cb -0.03 -2.09 0.00 0.00 0.01 0.00 0.00 72.50 70.38 2a39 s THR 267 CO 0.11 0.57 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.78 2a39 s VAL 268 N -0.38 2.72 -0.06 3.82 1.01 -0.08 -0.85 120.40 126.58 2a39 s VAL 268 Ca 0.04 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.31 2a39 s VAL 268 Cb -0.12 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2a39 s VAL 268 CO 0.02 0.50 -0.13 -0.69 0.00 0.00 0.00 175.10 174.80 2a39 s VAL 269 N 1.05 3.16 -0.04 2.92 1.01 -0.40 -2.21 120.40 125.89 2a39 s VAL 269 Ca -0.01 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 2a39 s VAL 269 Cb -0.15 -2.25 0.03 0.00 0.00 0.00 0.00 36.38 34.01 2a39 s VAL 269 CO -0.03 0.59 0.02 -0.89 0.00 0.00 0.00 175.10 174.79 2a39 s THR 270 N -0.68 0.12 -0.06 3.92 2.01 -0.47 -2.17 115.64 118.31 2a39 s THR 270 Ca 0.10 0.21 0.03 0.00 0.31 0.00 0.00 61.69 62.34 2a39 s THR 270 Cb -0.11 -0.29 -0.03 0.00 0.01 0.00 0.00 72.50 72.09 2a39 s THR 270 CO 0.01 0.18 -0.12 -1.10 -0.69 0.00 0.00 174.62 172.90 2a39 s GLN 271 N 1.61 2.64 -0.64 4.92 -0.21 -0.02 -1.18 119.66 126.79 2a39 s GLN 271 Ca -0.02 -0.66 -0.03 0.00 0.02 0.00 0.00 55.36 54.67 2a39 s GLN 271 Cb -0.13 -2.45 0.17 0.00 1.00 0.00 0.00 33.01 31.60 2a39 s GLN 271 CO -0.03 0.59 0.46 -0.06 -2.12 0.00 0.00 175.29 174.14 2a39 s PHE 272 N -0.65 3.42 -0.32 0.91 0.08 -0.45 -1.53 117.98 119.45 2a39 s PHE 272 Ca 0.10 -2.70 -0.28 0.00 0.12 0.00 0.00 56.93 54.17 2a39 s PHE 272 Cb -0.11 -3.22 0.02 0.00 -0.57 0.00 0.00 43.02 39.13 2a39 s PHE 272 CO 0.01 -0.84 1.04 -0.51 -0.10 0.00 0.00 175.22 174.82 2a39 s LEU 273 N -0.09 3.95 0.39 -0.37 1.43 -0.37 0.46 118.68 124.08 2a39 s LEU 273 Ca 0.17 1.01 0.08 0.00 -1.03 0.00 0.00 54.13 54.35 2a39 s LEU 273 Cb -0.20 -3.49 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 2a39 s LEU 273 CO -0.04 -0.85 0.35 0.00 0.23 0.00 0.00 176.35 176.04 2a39 s ALA 274 N 3.57 3.98 0.85 4.21 0.00 -1.26 -0.85 121.76 132.25 2a39 s ALA 274 Ca 0.44 -1.80 -0.07 0.00 0.00 0.00 0.00 51.96 50.54 2a39 s ALA 274 Cb -0.12 -1.08 0.18 0.00 0.00 0.00 0.00 23.12 22.09 2a39 s ALA 274 CO 0.15 -0.13 1.14 0.27 0.00 0.00 0.00 175.76 177.18 2a39 n ASN 275 N -1.48 0.87 0.21 0.00 0.23 0.31 -4.87 115.26 110.52 2a39 n ASN 275 Ca 0.02 -1.89 0.07 0.00 -0.53 0.00 0.00 54.58 52.25 2a39 n ASN 275 Cb 0.61 -0.80 0.48 0.00 -2.08 0.00 0.00 39.78 37.99 2a39 n ASN 275 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 2a39 h ARG 276 N 0.00 0.00 0.00 -3.83 3.08 -2.01 -0.36 114.38 111.27 2a39 h ARG 276 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2a39 h ARG 276 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2a39 h ARG 276 CO 0.34 0.28 0.00 0.54 -1.07 0.00 0.00 179.97 180.06 2a39 n ARG 277 N -3.76 0.57 -0.53 0.04 1.74 -1.26 -4.89 116.66 108.57 2a39 n ARG 277 Ca -0.01 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 2a39 n ARG 277 Cb 0.38 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 2a39 n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2a39 n GLY 278 N 0.35 0.74 3.80 -0.13 0.00 -0.14 -5.05 105.19 104.76 2a39 n GLY 278 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2a39 n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a39 s LYS 279 N -0.47 3.99 0.20 1.61 -0.14 -1.26 -4.83 119.74 118.84 2a39 s LYS 279 Ca 0.00 0.24 -0.31 0.00 -1.36 0.00 0.00 55.97 54.54 2a39 s LYS 279 Cb 0.00 -3.30 -0.10 0.00 -1.68 0.00 0.00 37.83 32.75 2a39 s LYS 279 CO 0.00 0.51 1.50 -1.17 -0.76 0.00 0.00 175.35 175.43 2a39 s LEU 280 N -0.43 4.38 -0.03 3.17 2.96 -1.26 -0.53 118.68 126.93 2a39 s LEU 280 Ca 0.20 2.62 -0.01 0.00 -0.22 0.00 0.00 54.13 56.72 2a39 s LEU 280 Cb -0.15 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 42.92 2a39 s LEU 280 CO 0.09 -0.76 -0.03 -0.62 -1.32 0.00 0.00 176.35 173.71 2a39 n GLU 281 N 3.23 0.06 -4.15 1.98 1.02 -0.03 -3.95 120.64 118.80 2a39 n GLU 281 Ca 0.10 0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.15 2a39 n GLU 281 Cb 0.40 -0.81 -0.10 0.00 -0.02 0.00 0.00 31.44 30.91 2a39 n GLU 281 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2a39 s LYS 282 N -2.05 0.78 -0.10 3.49 1.02 -1.05 -4.52 119.74 117.31 2a39 s LYS 282 Ca -0.04 -1.18 0.02 0.00 0.02 0.00 0.00 55.97 54.79 2a39 s LYS 282 Cb 0.01 -0.29 0.01 0.00 -0.52 0.00 0.00 37.83 37.04 2a39 s LYS 282 CO 0.05 0.02 -0.17 0.42 -0.92 0.00 0.00 175.35 174.75 2a39 s ILE 283 N -2.93 1.63 -0.11 2.17 1.01 -0.83 -1.24 121.20 120.90 2a39 s ILE 283 Ca 0.06 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 60.01 2a39 s ILE 283 Cb 0.01 -1.46 0.00 0.00 0.01 0.00 0.00 42.46 41.02 2a39 s ILE 283 CO -0.03 0.47 -0.23 -2.28 0.00 0.00 0.00 174.94 172.87 2a39 s HIS 284 N 0.79 2.60 -0.13 3.97 2.46 -0.58 -1.05 115.29 123.35 2a39 s HIS 284 Ca -0.10 -1.07 0.01 0.00 0.47 0.00 0.00 55.06 54.37 2a39 s HIS 284 Cb -0.16 -1.74 -0.01 0.00 -0.13 0.00 0.00 32.58 30.55 2a39 s HIS 284 CO 0.01 -0.44 -0.17 0.50 -2.47 0.00 0.00 174.74 172.17 2a39 s ARG 285 N 0.43 3.24 0.15 2.88 6.06 -1.26 -0.84 118.95 129.60 2a39 s ARG 285 Ca -0.16 -0.76 -0.06 0.00 -2.50 0.00 0.00 55.73 52.24 2a39 s ARG 285 Cb -0.17 -2.53 -0.02 0.00 0.06 0.00 0.00 34.95 32.29 2a39 s ARG 285 CO 0.07 0.15 0.20 -0.59 -2.50 0.00 0.00 175.30 172.62 2a39 s PHE 286 N 0.47 0.54 0.35 5.12 -0.12 -0.92 -4.29 117.98 119.14 2a39 s PHE 286 Ca -0.12 -0.92 0.09 0.00 -0.05 0.00 0.00 56.93 55.93 2a39 s PHE 286 Cb -0.16 -0.21 -0.07 0.00 -0.63 0.00 0.00 43.02 41.95 2a39 s PHE 286 CO 0.05 -0.64 -0.07 0.71 -0.05 0.00 0.00 175.22 175.23 2a39 s TYR 287 N -3.99 2.44 -0.07 3.49 1.51 -0.66 -1.27 117.35 118.80 2a39 s TYR 287 Ca 0.19 -0.52 0.01 0.00 -1.01 0.00 0.00 57.07 55.74 2a39 s TYR 287 Cb 0.05 -1.45 0.02 0.00 -0.11 0.00 0.00 41.96 40.47 2a39 s TYR 287 CO -0.00 0.55 -0.08 0.08 -1.11 0.00 0.00 175.55 174.99 2a39 s VAL 288 N -2.61 0.86 -0.03 0.71 1.01 -0.03 -0.44 120.40 119.87 2a39 s VAL 288 Ca 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 2a39 s VAL 288 Cb 0.03 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.59 2a39 s VAL 288 CO 0.17 0.31 0.06 -1.58 0.00 0.00 0.00 175.10 174.05 2a39 s GLN 289 N 1.04 0.04 -1.55 2.72 0.74 -0.70 -0.61 119.66 121.34 2a39 s GLN 289 Ca -0.08 0.14 -0.14 0.00 0.05 0.00 0.00 55.36 55.33 2a39 s GLN 289 Cb -0.14 -0.08 0.10 0.00 1.10 0.00 0.00 33.01 33.99 2a39 s GLN 289 CO -0.00 -0.07 0.85 -0.25 -0.55 0.00 0.00 175.29 175.27 2a39 n ASP 290 N 3.53 -4.31 0.00 6.67 8.00 -1.26 -1.35 116.55 127.83 2a39 n ASP 290 Ca -0.19 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.54 2a39 n ASP 290 Cb 0.56 -3.47 0.00 0.00 -0.02 0.00 0.00 41.12 38.19 2a39 n ASP 290 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a39 n GLY 291 N -1.53 0.49 3.37 0.44 0.00 -1.26 -5.02 105.19 101.68 2a39 n GLY 291 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2a39 n GLY 291 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a39 s LYS 292 N -0.32 2.87 0.16 1.61 1.02 -0.46 -5.10 119.74 119.51 2a39 s LYS 292 Ca 0.00 -0.76 -0.30 0.00 0.02 0.00 0.00 55.97 54.93 2a39 s LYS 292 Cb 0.00 -2.41 -0.08 0.00 -0.52 0.00 0.00 37.83 34.83 2a39 s LYS 292 CO 0.00 0.39 1.19 0.08 -0.92 0.00 0.00 175.35 176.08 2a39 s VAL 293 N -0.13 3.70 -0.35 3.17 1.01 -1.26 -1.72 120.40 124.82 2a39 s VAL 293 Ca -0.02 1.38 0.00 0.00 0.00 0.00 0.00 61.98 63.34 2a39 s VAL 293 Cb -0.14 -3.88 0.09 0.00 0.00 0.00 0.00 36.38 32.45 2a39 s VAL 293 CO 0.04 0.20 0.08 -0.63 0.00 0.00 0.00 175.10 174.79 2a39 s ILE 294 N 0.15 2.81 0.88 2.22 1.01 0.42 -4.96 121.20 123.73 2a39 s ILE 294 Ca 0.54 -1.97 -0.10 0.00 0.00 0.00 0.00 60.65 59.12 2a39 s ILE 294 Cb -0.32 -2.88 0.12 0.00 0.01 0.00 0.00 42.46 39.40 2a39 s ILE 294 CO 0.35 -0.48 1.13 -1.61 0.00 0.00 0.00 174.94 174.33 2a39 s GLU 295 N 1.09 1.32 0.73 2.79 0.41 -1.26 -1.66 118.70 122.11 2a39 s GLU 295 Ca 0.05 1.43 -0.13 0.00 -0.41 0.00 0.00 54.97 55.91 2a39 s GLU 295 Cb -0.21 -1.77 0.03 0.00 -1.78 0.00 0.00 34.13 30.41 2a39 s GLU 295 CO -0.05 -2.38 1.11 0.45 -0.49 0.00 0.00 175.26 173.89 2a39 s SER 296 N -2.87 4.69 0.81 -0.19 0.15 -1.26 -4.82 113.70 110.21 2a39 s SER 296 Ca 0.65 1.93 -0.12 0.00 0.70 0.00 0.00 55.95 59.12 2a39 s SER 296 Cb -0.21 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.64 2a39 s SER 296 CO 0.58 -1.91 1.16 0.72 1.20 0.00 0.00 173.24 174.98 2a39 s PHE 297 N -2.62 2.93 0.11 3.44 -0.12 -1.26 -5.01 117.98 115.45 2a39 s PHE 297 Ca 0.64 0.83 0.05 0.00 -0.05 0.00 0.00 56.93 58.41 2a39 s PHE 297 Cb -0.19 -3.39 -0.04 0.00 -0.63 0.00 0.00 43.02 38.76 2a39 s PHE 297 CO 0.49 -1.79 0.02 0.71 -0.05 0.00 0.00 175.22 174.60 2a39 s TYR 298 N -3.47 2.99 0.99 3.49 2.02 -1.26 -4.42 117.35 117.69 2a39 s TYR 298 Ca 0.62 -0.04 -0.11 0.00 -0.37 0.00 0.00 57.07 57.17 2a39 s TYR 298 Cb -0.12 -1.51 0.19 0.00 -0.40 0.00 0.00 41.96 40.12 2a39 s TYR 298 CO 0.50 0.49 1.11 0.95 -1.57 0.00 0.00 175.55 177.04 2a39 s THR 299 N -1.43 2.04 -0.30 -0.71 -4.23 0.06 -4.91 115.64 106.15 2a39 s THR 299 Ca 0.27 0.01 0.18 0.00 -1.18 0.00 0.00 61.69 60.97 2a39 s THR 299 Cb -0.11 -2.03 0.46 0.00 1.34 0.00 0.00 72.50 72.16 2a39 s THR 299 CO 0.19 -0.02 1.27 -3.20 -0.54 0.00 0.00 174.62 172.33 2a39 n ASN 300 N -4.44 0.25 -3.85 3.99 5.15 -0.56 -4.71 115.26 111.09 2a39 n ASN 300 Ca 0.09 -2.18 -0.15 0.00 -0.60 0.00 0.00 54.58 51.75 2a39 n ASN 300 Cb 0.53 0.03 -0.15 0.00 -0.53 0.00 0.00 39.78 39.65 2a39 n ASN 300 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2a39 s LYS 301 N -2.09 0.13 0.25 1.20 2.20 -1.23 -4.63 119.74 115.57 2a39 s LYS 301 Ca 0.20 0.03 -0.31 0.00 -0.36 0.00 0.00 55.97 55.54 2a39 s LYS 301 Cb 0.38 -0.24 -0.12 0.00 -1.51 0.00 0.00 37.83 36.34 2a39 s LYS 301 CO -0.07 -0.06 1.63 -0.85 -0.36 0.00 0.00 175.35 175.64 2a39 n GLU 302 N 3.58 2.65 -0.02 4.03 -0.00 -1.26 -1.39 120.64 128.24 2a39 n GLU 302 Ca -0.20 0.95 0.00 0.00 -0.00 0.00 0.00 57.16 57.91 2a39 n GLU 302 Cb 0.55 -2.74 0.00 0.00 -0.00 0.00 0.00 31.44 29.25 2a39 n GLU 302 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2a39 n GLY 303 N 2.85 1.03 3.31 -1.84 0.00 -1.26 -5.04 105.19 104.24 2a39 n GLY 303 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2a39 n GLY 303 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a39 s VAL 304 N -2.37 2.67 0.29 1.61 1.01 -0.48 -4.88 120.40 118.24 2a39 s VAL 304 Ca 0.00 -0.80 -0.27 0.00 0.00 0.00 0.00 61.98 60.91 2a39 s VAL 304 Cb 0.00 -2.09 -0.15 0.00 0.00 0.00 0.00 36.38 34.14 2a39 s VAL 304 CO 0.00 0.54 0.83 -2.65 0.00 0.00 0.00 175.10 173.81 2a39 n PRO 305 N 3.59 0.91 -2.52 2.72 -0.02 -1.26 -4.66 135.00 133.75 2a39 n PRO 305 Ca -0.19 0.32 -0.43 0.00 -2.02 0.00 0.00 63.50 61.19 2a39 n PRO 305 Cb 0.53 -1.59 -0.02 0.00 -0.02 0.00 0.00 33.50 32.39 2a39 n PRO 305 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2a39 s TYR 306 N -1.10 2.80 0.00 6.00 5.04 -1.26 -4.62 117.35 124.22 2a39 s TYR 306 Ca 0.61 0.88 -0.28 0.00 -2.44 0.00 0.00 57.07 55.83 2a39 s TYR 306 Cb -0.74 -4.08 0.08 0.00 0.35 0.00 0.00 41.96 37.57 2a39 s TYR 306 CO 0.59 -1.37 0.74 -0.08 -1.34 0.00 0.00 175.55 174.09 2a39 s THR 307 N 4.37 0.00 -0.23 4.34 -1.32 -1.26 -4.95 115.64 116.60 2a39 s THR 307 Ca 0.52 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 61.12 2a39 s THR 307 Cb -0.12 -1.00 0.28 0.00 -1.51 0.00 0.00 72.50 70.15 2a39 s THR 307 CO 0.25 0.00 1.19 -0.46 -2.21 0.00 0.00 174.62 173.40 2a39 n ASN 308 N 0.28 2.72 -3.86 8.08 6.94 -1.26 -0.76 115.26 127.40 2a39 n ASN 308 Ca -0.15 -2.65 -0.10 0.00 -0.02 0.00 0.00 54.58 51.66 2a39 n ASN 308 Cb 0.60 -0.33 -0.08 0.00 -2.36 0.00 0.00 39.78 37.62 2a39 n ASN 308 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 2a39 s MET 309 N -2.14 0.77 0.13 -3.83 -1.94 -1.26 -4.70 119.30 106.32 2a39 s MET 309 Ca 0.26 -0.81 -0.27 0.00 -1.71 0.00 0.00 55.69 53.16 2a39 s MET 309 Cb 0.20 0.31 -0.07 0.00 2.01 0.00 0.00 34.83 37.29 2a39 s MET 309 CO 0.06 -0.23 0.84 0.42 -0.01 0.00 0.00 175.02 176.09 2a39 s ILE 310 N -3.24 4.45 0.36 2.53 1.01 -0.21 -4.90 121.20 121.19 2a39 s ILE 310 Ca 0.00 1.82 -0.17 0.00 0.00 0.00 0.00 60.65 62.30 2a39 s ILE 310 Cb 0.02 -4.20 0.05 0.00 0.01 0.00 0.00 42.46 38.34 2a39 s ILE 310 CO -0.08 0.43 0.78 1.51 0.00 0.00 0.00 174.94 177.58 2a39 s ASP 311 N -0.61 -0.06 0.32 3.58 1.47 -1.26 -1.97 116.67 118.14 2a39 s ASP 311 Ca 0.40 -1.00 0.02 0.00 1.18 0.00 0.00 52.55 53.14 2a39 s ASP 311 Cb -0.23 0.82 0.57 0.00 -0.34 0.00 0.00 42.92 43.74 2a39 s ASP 311 CO 0.27 -1.59 1.93 0.44 0.68 0.00 0.00 175.17 176.89 2a39 h ASP 312 N 2.00 0.85 0.04 2.11 3.32 -1.97 -0.26 116.42 122.51 2a39 h ASP 312 Ca -0.29 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 2a39 h ASP 312 Cb 1.25 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.62 2a39 h ASP 312 CO 0.36 0.55 -0.02 -0.08 -1.72 0.00 0.00 179.24 178.34 2a39 h GLU 313 N 0.97 -0.05 -0.61 3.56 4.81 -1.97 0.11 114.58 121.41 2a39 h GLU 313 Ca 0.36 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.61 2a39 h GLU 313 Cb 0.18 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 2a39 h GLU 313 CO -0.13 0.07 0.40 0.35 -0.73 0.00 0.00 179.01 178.97 2a39 h PHE 314 N -0.15 0.75 -0.40 0.92 3.57 -1.84 -1.45 116.94 118.35 2a39 h PHE 314 Ca -0.00 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2a39 h PHE 314 Cb 0.13 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2a39 h PHE 314 CO -0.04 0.46 -0.08 0.00 -2.23 0.00 0.00 178.31 176.42 2a39 h GLU 316 N 0.57 0.63 -0.45 0.00 4.81 -0.71 -1.13 114.58 118.31 2a39 h GLU 316 Ca 0.10 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2a39 h GLU 316 Cb 0.60 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 2a39 h GLU 316 CO 0.04 0.66 0.29 0.00 -0.73 0.00 0.00 179.01 179.27 2a39 h ALA 317 N 0.94 1.67 -0.37 2.92 0.00 -1.10 -2.32 119.26 121.00 2a39 h ALA 317 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2a39 h ALA 317 Cb 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2a39 h ALA 317 CO 0.00 0.30 0.00 0.25 0.00 0.00 0.00 179.25 179.81 2a39 n THR 318 N -4.46 0.74 -0.77 0.00 -2.24 -0.72 -4.91 114.28 101.92 2a39 n THR 318 Ca 0.04 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 2a39 n THR 318 Cb 0.06 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2a39 n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a39 n GLY 319 N 0.94 0.58 2.55 3.38 0.00 -0.87 -4.96 105.19 106.81 2a39 n GLY 319 Ca 0.13 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2a39 n GLY 319 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2a39 n SER 320 N 0.49 6.17 0.16 1.61 7.64 -0.44 -4.67 113.62 124.59 2a39 n SER 320 Ca 0.00 -2.64 -0.14 0.00 1.01 0.00 0.00 58.87 57.10 2a39 n SER 320 Cb 0.00 -1.50 -0.07 0.00 -1.01 0.00 0.00 64.21 61.63 2a39 n SER 320 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2a39 h ARG 321 N 5.72 -0.39 -0.55 1.43 2.43 -1.90 -1.63 114.38 119.48 2a39 h ARG 321 Ca 0.69 0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.80 2a39 h ARG 321 Cb 0.42 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 2a39 h ARG 321 CO 1.80 -0.26 0.00 0.87 -1.51 0.00 0.00 179.97 180.87 2a39 h LYS 322 N -0.41 0.95 -0.24 0.20 1.79 -1.96 -0.88 116.57 116.01 2a39 h LYS 322 Ca -0.01 -0.28 0.06 0.00 -2.18 0.00 0.00 60.65 58.23 2a39 h LYS 322 Cb 0.36 -0.10 -0.08 0.00 -1.58 0.00 0.00 32.23 30.83 2a39 h LYS 322 CO -0.01 0.93 -0.40 -0.92 -1.08 0.00 0.00 179.45 177.98 2a39 h TYR 323 N 0.87 -1.14 -0.68 -1.35 3.20 -1.83 0.13 116.97 116.18 2a39 h TYR 323 Ca 0.16 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 2a39 h TYR 323 Cb 0.51 0.53 -0.03 0.00 1.54 0.00 0.00 36.73 39.28 2a39 h TYR 323 CO 0.03 -0.44 0.40 0.52 -1.64 0.00 0.00 178.16 177.03 2a39 h MET 324 N -0.40 0.93 -0.05 1.82 2.86 -1.06 0.11 114.93 119.14 2a39 h MET 324 Ca 0.11 -0.09 -0.13 0.00 -2.06 0.00 0.00 59.70 57.53 2a39 h MET 324 Cb 0.59 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 2a39 h MET 324 CO -0.46 0.67 -0.56 0.93 1.06 0.00 0.00 176.91 178.56 2a39 h GLU 325 N 0.93 0.15 -0.35 1.72 5.08 -0.52 -3.14 114.58 118.44 2a39 h GLU 325 Ca 0.24 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2a39 h GLU 325 Cb -0.01 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2a39 h GLU 325 CO -0.04 0.67 0.00 1.28 -1.00 0.00 0.00 179.01 179.92 2a39 n LEU 326 N -3.90 1.92 0.00 1.33 4.77 0.39 -4.85 117.00 116.66 2a39 n LEU 326 Ca -0.02 -0.96 0.00 0.00 -0.03 0.00 0.00 56.01 55.01 2a39 n LEU 326 Cb 0.58 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2a39 n LEU 326 CO 0.43 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 2a39 n GLY 327 N 1.08 0.84 7.00 -0.72 0.00 -1.14 -3.62 105.19 108.63 2a39 n GLY 327 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2a39 n GLY 327 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 n ALA 328 N 0.00 0.00 -0.22 4.61 0.00 0.01 -1.24 120.51 123.68 2a39 n ALA 328 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2a39 n ALA 328 Cb 0.00 0.00 0.28 0.00 0.00 0.00 0.00 19.45 19.73 2a39 n ALA 328 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2a39 h THR 329 N 0.00 1.12 -0.39 0.00 2.02 -1.89 -1.92 112.91 111.85 2a39 h THR 329 Ca 0.00 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 2a39 h THR 329 Cb 0.00 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.50 2a39 h THR 329 CO 0.00 0.17 0.10 -0.61 0.37 0.00 0.00 175.52 175.55 2a39 h GLN 330 N 0.93 0.62 -0.63 6.66 4.15 -1.69 -1.11 115.11 124.04 2a39 h GLN 330 Ca 0.30 -0.15 -0.04 0.00 0.77 0.00 0.00 58.65 59.54 2a39 h GLN 330 Cb 0.05 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.63 2a39 h GLN 330 CO -0.09 0.64 0.24 0.78 -1.93 0.00 0.00 178.83 178.48 2a39 h GLY 331 N 0.49 1.02 0.77 2.39 0.00 -0.47 -1.23 103.07 106.04 2a39 h GLY 331 Ca 0.12 -0.57 0.05 0.00 0.00 0.00 0.00 47.33 46.94 2a39 h GLY 331 CO 0.00 0.53 0.53 1.98 0.00 0.00 0.00 176.54 179.58 2a39 h MET 332 N 0.89 0.95 0.00 4.80 1.85 -1.22 -2.03 114.93 120.18 2a39 h MET 332 Ca 0.21 -0.06 -0.08 0.00 -0.61 0.00 0.00 59.70 59.16 2a39 h MET 332 Cb 0.22 -0.21 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 2a39 h MET 332 CO -0.02 0.63 -0.38 0.78 -0.40 0.00 0.00 176.91 177.52 2a39 h GLY 333 N 0.98 0.00 1.69 1.39 0.00 -0.63 -1.60 103.07 104.91 2a39 h GLY 333 Ca 0.36 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.55 2a39 h GLY 333 CO -0.15 0.00 -0.50 0.83 0.00 0.00 0.00 176.54 176.72 2a39 h GLU 334 N 0.00 0.33 -0.25 4.80 5.08 -0.52 -0.28 114.58 123.74 2a39 h GLU 334 Ca -0.00 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.04 2a39 h GLU 334 Cb 0.69 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 2a39 h GLU 334 CO 0.05 0.75 -0.36 0.00 -1.00 0.00 0.00 179.01 178.46 2a39 h ALA 335 N 1.21 0.38 -0.89 3.43 0.00 -1.06 -0.33 119.26 122.00 2a39 h ALA 335 Ca 0.01 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.50 2a39 h ALA 335 Cb 0.97 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 2a39 h ALA 335 CO 0.08 0.44 0.59 -0.07 0.00 0.00 0.00 179.25 180.29 2a39 h LEU 336 N 0.40 1.03 -0.43 0.00 3.38 -1.18 -1.81 115.31 116.71 2a39 h LEU 336 Ca 0.03 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2a39 h LEU 336 Cb 0.94 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2a39 h LEU 336 CO 0.08 0.75 -0.26 0.74 0.09 0.00 0.00 178.44 179.85 2a39 h THR 337 N 1.21 1.27 -0.13 0.22 2.02 -0.91 -3.07 112.91 113.52 2a39 h THR 337 Ca 0.33 -1.42 -0.03 0.00 0.77 0.00 0.00 66.41 66.05 2a39 h THR 337 Cb -0.13 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2a39 h THR 337 CO -0.07 0.48 -0.06 0.03 0.37 0.00 0.00 175.52 176.27 2a39 h ARG 338 N 0.76 0.19 0.00 6.66 3.08 -0.50 -3.46 114.38 121.10 2a39 h ARG 338 Ca 0.09 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2a39 h ARG 338 Cb 0.84 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.86 2a39 h ARG 338 CO 0.07 0.26 0.00 0.41 -1.07 0.00 0.00 179.97 179.65 2a39 n GLY 339 N -1.11 3.97 3.20 0.04 0.00 -0.73 -5.02 105.19 105.54 2a39 n GLY 339 Ca -0.01 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 2a39 n GLY 339 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2a39 s MET 340 N -5.43 0.91 -0.12 1.61 1.00 -0.60 -4.75 119.30 111.92 2a39 s MET 340 Ca 0.00 -1.36 -0.07 0.00 0.00 0.00 0.00 55.69 54.26 2a39 s MET 340 Cb 0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 34.83 34.41 2a39 s MET 340 CO 0.00 0.02 0.12 0.08 0.00 0.00 0.00 175.02 175.25 2a39 s VAL 341 N -3.41 5.36 -0.13 -6.03 1.01 -0.31 -0.82 120.40 116.07 2a39 s VAL 341 Ca 0.13 0.15 -0.22 0.00 0.00 0.00 0.00 61.98 62.04 2a39 s VAL 341 Cb 0.04 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 2a39 s VAL 341 CO -0.02 0.61 0.67 -0.22 0.00 0.00 0.00 175.10 176.14 2a39 s LEU 342 N -0.91 4.23 0.02 3.92 2.96 -1.26 -1.63 118.68 126.00 2a39 s LEU 342 Ca 0.14 1.02 0.08 0.00 -0.22 0.00 0.00 54.13 55.16 2a39 s LEU 342 Cb -0.12 -3.00 -0.02 0.00 0.50 0.00 0.00 46.19 43.55 2a39 s LEU 342 CO 0.03 -0.21 -0.25 0.00 -1.32 0.00 0.00 176.35 174.61 2a39 s ALA 343 N 1.39 2.12 -0.02 5.97 0.00 0.76 -2.01 121.76 129.97 2a39 s ALA 343 Ca 0.33 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2a39 s ALA 343 Cb -0.17 -0.49 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2a39 s ALA 343 CO 0.14 0.51 -0.02 -1.64 0.00 0.00 0.00 175.76 174.74 2a39 s MET 344 N -0.93 0.40 0.27 0.00 -1.94 -0.24 -0.72 119.30 116.14 2a39 s MET 344 Ca 0.10 -0.03 -0.13 0.00 -1.71 0.00 0.00 55.69 53.92 2a39 s MET 344 Cb -0.10 -0.48 0.00 0.00 2.01 0.00 0.00 34.83 36.27 2a39 s MET 344 CO 0.01 -0.05 0.53 -1.54 -0.01 0.00 0.00 175.02 173.96 2a39 s SER 345 N 0.61 -0.00 -0.06 3.03 1.04 -0.43 -0.50 113.70 117.40 2a39 s SER 345 Ca -0.06 -0.96 -0.02 0.00 0.48 0.00 0.00 55.95 55.38 2a39 s SER 345 Cb -0.10 0.63 0.04 0.00 0.10 0.00 0.00 66.02 66.69 2a39 s SER 345 CO -0.01 -1.23 0.12 -0.51 0.98 0.00 0.00 173.24 172.59 2a39 s ILE 346 N -3.78 -0.07 0.20 -1.02 2.07 -0.97 0.39 121.20 118.03 2a39 s ILE 346 Ca 0.21 0.21 -0.17 0.00 -1.41 0.00 0.00 60.65 59.49 2a39 s ILE 346 Cb -0.02 -0.20 0.02 0.00 0.13 0.00 0.00 42.46 42.39 2a39 s ILE 346 CO 0.10 0.09 0.53 -1.66 -1.91 0.00 0.00 174.94 172.09 2a39 s TRP 347 N 1.26 -0.08 0.43 3.50 1.48 -0.66 -4.10 118.94 120.77 2a39 s TRP 347 Ca -0.08 -0.27 0.03 0.00 -1.06 0.00 0.00 56.10 54.73 2a39 s TRP 347 Cb -0.12 0.39 -0.03 0.00 -1.16 0.00 0.00 33.47 32.56 2a39 s TRP 347 CO -0.05 -0.94 0.09 1.67 -4.06 0.00 0.00 176.95 173.66 2a39 s TRP 348 N -3.89 1.84 -0.35 1.66 -2.14 -1.26 -1.17 118.94 113.63 2a39 s TRP 348 Ca 0.10 -1.16 -0.01 0.00 2.66 0.00 0.00 56.10 57.70 2a39 s TRP 348 Cb -0.01 -1.30 0.12 0.00 -3.10 0.00 0.00 33.47 29.18 2a39 s TRP 348 CO -0.01 -0.12 0.17 0.34 -2.66 0.00 0.00 176.95 174.67 2a39 s ASP 349 N -3.67 3.49 0.15 -2.66 2.15 -1.26 -5.00 116.67 109.88 2a39 s ASP 349 Ca 0.21 -1.97 -0.16 0.00 0.43 0.00 0.00 52.55 51.05 2a39 s ASP 349 Cb 0.03 -0.64 0.05 0.00 -0.30 0.00 0.00 42.92 42.06 2a39 s ASP 349 CO 0.12 -0.35 1.77 -0.61 -0.17 0.00 0.00 175.17 175.92 2a39 h GLN 350 N 7.49 0.32 -0.33 4.34 5.75 -1.97 -0.19 115.11 130.52 2a39 h GLN 350 Ca -0.06 -0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.34 2a39 h GLN 350 Cb 0.98 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.45 2a39 h GLN 350 CO 0.40 0.21 -0.14 0.78 -2.65 0.00 0.00 178.83 177.43 2a39 h GLY 351 N 0.33 0.74 -0.04 2.39 0.00 -2.00 -3.39 103.07 101.10 2a39 h GLY 351 Ca 0.16 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2a39 h GLY 351 CO -0.13 0.59 0.00 0.61 0.00 0.00 0.00 176.54 177.61 2a39 n GLY 352 N -0.08 -0.73 2.50 4.60 0.00 -1.23 -5.02 105.19 105.24 2a39 n GLY 352 Ca -0.03 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 2a39 n GLY 352 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2a39 n ASN 353 N -0.05 -5.11 -2.69 1.61 5.03 -0.08 -2.58 115.26 111.39 2a39 n ASN 353 Ca 0.00 0.46 -0.22 0.00 0.87 0.00 0.00 54.58 55.70 2a39 n ASN 353 Cb 0.05 -4.49 0.01 0.00 -1.02 0.00 0.00 39.78 34.34 2a39 n ASN 353 CO 0.00 0.00 0.00 0.80 -1.83 0.00 0.00 177.26 176.23 2a39 n MET 354 N -2.16 -3.17 0.22 3.52 1.56 -1.26 -4.34 117.12 111.48 2a39 n MET 354 Ca -0.19 0.96 0.05 0.00 -0.27 0.00 0.00 57.70 58.26 2a39 n MET 354 Cb 0.63 -5.72 0.49 0.00 2.15 0.00 0.00 33.22 30.76 2a39 n MET 354 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 2a39 h GLU 355 N -0.64 0.00 0.00 2.12 5.08 -1.89 -2.00 114.58 117.26 2a39 h GLU 355 Ca -0.51 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2a39 h GLU 355 Cb 1.37 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 2a39 h GLU 355 CO 0.58 0.20 0.00 0.11 -1.00 0.00 0.00 179.01 178.90 2a39 h TRP 356 N 0.00 0.00 0.02 4.33 5.08 -1.87 -2.68 115.95 120.84 2a39 h TRP 356 Ca -0.00 0.00 -0.24 0.00 1.08 0.00 0.00 58.89 59.73 2a39 h TRP 356 Cb 0.36 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.49 2a39 h TRP 356 CO 0.00 0.00 -1.31 1.25 -1.28 0.00 0.00 178.44 177.10 2a39 h LEU 357 N 0.00 0.06 -2.04 0.11 5.85 -1.71 -3.46 115.31 114.12 2a39 h LEU 357 Ca 0.00 -0.58 0.00 0.00 0.84 0.00 0.00 57.88 58.14 2a39 h LEU 357 Cb 0.22 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2a39 h LEU 357 CO 0.00 1.52 -0.26 -0.90 -0.34 0.00 0.00 178.44 178.47 2a39 n ASP 358 N -4.32 0.59 -4.34 1.25 5.68 -1.20 -4.59 116.55 109.61 2a39 n ASP 358 Ca -0.31 -1.97 -0.25 0.00 -0.50 0.00 0.00 54.79 51.75 2a39 n ASP 358 Cb 0.72 -0.18 -0.12 0.00 -1.14 0.00 0.00 41.12 40.40 2a39 n ASP 358 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 2a39 s HIS 359 N -0.61 2.01 0.00 2.11 5.04 -1.01 -1.43 115.29 121.41 2a39 s HIS 359 Ca 0.06 -0.41 0.00 0.00 -1.54 0.00 0.00 55.06 53.17 2a39 s HIS 359 Cb 0.05 -1.07 0.00 0.00 0.04 0.00 0.00 32.58 31.61 2a39 s HIS 359 CO 0.01 0.31 0.00 0.41 -2.34 0.00 0.00 174.74 173.13 2a39 n GLY 360 N 0.77 2.53 0.22 1.59 0.00 -1.18 -1.67 105.19 107.45 2a39 n GLY 360 Ca -0.17 -0.09 0.15 0.00 0.00 0.00 0.00 46.02 45.91 2a39 n GLY 360 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2a39 h GLU 361 N 0.00 0.00 -0.01 1.61 5.08 -1.94 -3.25 114.58 116.07 2a39 h GLU 361 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2a39 h GLU 361 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2a39 h GLU 361 CO 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 179.01 177.54 2a39 n ALA 362 N -2.00 3.56 0.00 3.43 0.00 -0.67 -2.89 120.51 121.94 2a39 n ALA 362 Ca 0.02 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2a39 n ALA 362 Cb 0.35 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2a39 n ALA 362 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a39 n GLY 363 N 1.41 -1.55 0.49 0.00 0.00 -1.21 -4.31 105.19 100.02 2a39 n GLY 363 Ca 0.09 -1.05 0.09 0.00 0.00 0.00 0.00 46.02 45.15 2a39 n GLY 363 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2a39 n PRO 364 N -0.18 1.64 -2.67 1.61 -0.04 -1.10 -3.13 135.00 131.14 2a39 n PRO 364 Ca 0.00 -0.97 -0.41 0.00 -0.04 0.00 0.00 63.50 62.07 2a39 n PRO 364 Cb 0.00 -1.35 -0.04 0.00 -0.04 0.00 0.00 33.50 32.07 2a39 n PRO 364 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a39 s ALA 366 N 0.22 2.26 0.19 0.00 0.00 -1.26 -4.11 121.76 119.05 2a39 s ALA 366 Ca 0.49 -0.02 -0.33 0.00 0.00 0.00 0.00 51.96 52.10 2a39 s ALA 366 Cb -0.24 -3.17 -0.13 0.00 0.00 0.00 0.00 23.12 19.58 2a39 s ALA 366 CO 0.30 -1.69 1.69 1.17 0.00 0.00 0.00 175.76 177.23 2a39 n LYS 367 N -3.44 2.58 0.00 0.00 3.00 -1.26 -1.19 118.16 117.86 2a39 n LYS 367 Ca 0.07 0.93 0.00 0.00 -0.00 0.00 0.00 58.31 59.32 2a39 n LYS 367 Cb 0.55 -2.76 0.00 0.00 0.00 0.00 0.00 35.03 32.82 2a39 n LYS 367 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2a39 n GLY 368 N 3.82 2.87 0.20 3.14 0.00 -1.26 -4.86 105.19 109.09 2a39 n GLY 368 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 2a39 n GLY 368 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2a39 h GLU 369 N 2.09 0.00 -0.49 1.61 4.81 -1.51 -2.83 114.58 118.25 2a39 h GLU 369 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2a39 h GLU 369 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2a39 h GLU 369 CO 0.00 0.33 0.00 0.41 -0.73 0.00 0.00 179.01 179.02 2a39 n GLY 370 N -0.27 1.11 3.77 1.92 0.00 -1.26 -4.22 105.19 106.24 2a39 n GLY 370 Ca -0.01 -0.39 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 2a39 n GLY 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a39 s ALA 371 N -1.63 3.28 0.32 4.61 0.00 -1.07 -4.40 121.76 122.87 2a39 s ALA 371 Ca 0.24 0.79 0.10 0.00 0.00 0.00 0.00 51.96 53.09 2a39 s ALA 371 Cb 0.14 -3.29 0.90 0.00 0.00 0.00 0.00 23.12 20.87 2a39 s ALA 371 CO 0.13 -0.14 1.72 -1.35 0.00 0.00 0.00 175.76 176.12 2a39 h PRO 372 N 3.34 0.53 0.00 0.00 0.11 -1.90 0.42 132.00 134.49 2a39 h PRO 372 Ca -0.47 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2a39 h PRO 372 Cb 1.21 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2a39 h PRO 372 CO 0.65 0.35 -0.18 0.66 -0.21 0.00 0.00 178.00 179.27 2a39 h SER 373 N 0.54 0.00 0.20 -2.05 4.64 -1.96 -2.46 113.55 112.46 2a39 h SER 373 Ca 0.65 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.62 2a39 h SER 373 Cb 1.27 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2a39 h SER 373 CO -0.49 0.18 -1.73 0.78 -0.87 0.00 0.00 176.83 174.69 2a39 h ASN 374 N 0.00 0.64 -0.59 4.97 2.35 -0.58 -3.35 115.58 119.03 2a39 h ASN 374 Ca -0.00 -0.93 0.12 0.00 -0.55 0.00 0.00 56.30 54.93 2a39 h ASN 374 Cb 0.54 -0.21 -0.10 0.00 0.05 0.00 0.00 38.32 38.59 2a39 h ASN 374 CO 0.02 1.78 -0.07 0.40 -1.65 0.00 0.00 177.43 177.92 2a39 h ILE 375 N 0.11 0.47 0.00 2.81 2.04 -0.36 0.13 117.51 122.71 2a39 h ILE 375 Ca -0.34 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2a39 h ILE 375 Cb 2.11 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2a39 h ILE 375 CO 0.19 0.01 0.00 1.33 0.00 0.00 0.00 178.15 179.68 2a39 n VAL 376 N -5.34 0.86 0.11 1.67 0.24 -1.04 -0.44 118.33 114.39 2a39 n VAL 376 Ca 0.07 0.22 -0.01 0.00 -2.04 0.00 0.00 64.34 62.58 2a39 n VAL 376 Cb 0.32 -1.10 0.00 0.00 -1.47 0.00 0.00 33.84 31.60 2a39 n VAL 376 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2a39 h GLN 377 N 0.00 0.00 0.00 7.34 4.20 -1.10 -3.10 115.11 122.45 2a39 h GLN 377 Ca 0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2a39 h GLN 377 Cb 0.35 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2a39 h GLN 377 CO 0.00 0.67 -0.50 0.28 -0.67 0.00 0.00 178.83 178.61 2a39 h VAL 378 N 0.00 1.10 -2.86 -0.54 2.07 -0.89 -3.45 116.25 111.69 2a39 h VAL 378 Ca -0.01 -2.00 -0.48 0.00 0.82 0.00 0.00 66.70 65.03 2a39 h VAL 378 Cb 1.48 2.26 -0.40 0.00 -1.52 0.00 0.00 31.29 33.10 2a39 h VAL 378 CO 0.09 0.37 -0.75 -0.70 0.02 0.00 0.00 177.57 176.60 2a39 s GLU 379 N -2.19 0.14 0.47 1.57 2.56 0.41 -5.02 118.70 116.64 2a39 s GLU 379 Ca -0.20 -0.29 0.20 0.00 0.00 0.00 0.00 54.97 54.68 2a39 s GLU 379 Cb 0.01 -1.42 1.16 0.00 2.00 0.00 0.00 34.13 35.88 2a39 s GLU 379 CO 0.53 -0.86 2.00 -1.00 -0.56 0.00 0.00 175.26 175.37 2a39 h PRO 380 N 8.40 0.00 -2.26 4.30 0.13 -1.74 -3.36 132.00 137.48 2a39 h PRO 380 Ca -0.17 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.37 2a39 h PRO 380 Cb 1.08 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.81 2a39 h PRO 380 CO 0.37 0.19 -0.89 1.19 -0.23 0.00 0.00 178.00 178.62 2a39 n PHE 381 N -3.95 0.94 -1.89 1.56 3.72 -1.26 -4.89 117.46 111.70 2a39 n PHE 381 Ca -0.02 -3.74 -0.40 0.00 -0.05 0.00 0.00 57.45 53.24 2a39 n PHE 381 Cb 0.27 -0.30 0.01 0.00 -0.94 0.00 0.00 39.48 38.52 2a39 n PHE 381 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2a39 s PRO 382 N -1.27 3.85 0.20 -1.08 0.02 -1.26 -4.90 135.00 130.56 2a39 s PRO 382 Ca 0.35 2.36 -0.22 0.00 0.02 0.00 0.00 61.00 63.51 2a39 s PRO 382 Cb 0.11 -2.75 0.05 0.00 0.02 0.00 0.00 34.50 31.94 2a39 s PRO 382 CO -0.11 -0.66 0.62 -1.83 -0.33 0.00 0.00 177.00 174.69 2a39 s GLU 383 N -2.31 1.43 0.02 5.54 -1.05 -1.20 -1.70 118.70 119.42 2a39 s GLU 383 Ca 0.58 -0.67 0.01 0.00 -0.15 0.00 0.00 54.97 54.75 2a39 s GLU 383 Cb -0.42 0.58 -0.02 0.00 -0.44 0.00 0.00 34.13 33.83 2a39 s GLU 383 CO 0.55 -0.63 -0.06 0.54 0.95 0.00 0.00 175.26 176.61 2a39 s VAL 384 N -3.81 0.37 -0.10 1.83 0.11 -0.55 -4.40 120.40 113.85 2a39 s VAL 384 Ca 0.05 -0.78 0.03 0.00 -2.93 0.00 0.00 61.98 58.34 2a39 s VAL 384 Cb -0.02 -0.43 0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2a39 s VAL 384 CO -0.06 -0.28 -0.19 -0.89 -3.33 0.00 0.00 175.10 170.34 2a39 s THR 385 N -1.04 1.74 -0.18 5.04 2.01 -1.20 -1.26 115.64 120.75 2a39 s THR 385 Ca -0.08 -0.82 -0.03 0.00 0.31 0.00 0.00 61.69 61.07 2a39 s THR 385 Cb -0.08 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.88 2a39 s THR 385 CO -0.00 0.49 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.05 2a39 s TYR 386 N 0.57 2.95 0.06 4.92 2.02 -0.15 -1.92 117.35 125.80 2a39 s TYR 386 Ca -0.15 -0.63 0.06 0.00 -0.37 0.00 0.00 57.07 55.97 2a39 s TYR 386 Cb -0.17 -2.00 -0.03 0.00 -0.40 0.00 0.00 41.96 39.37 2a39 s TYR 386 CO 0.05 -0.29 -0.15 0.99 -1.57 0.00 0.00 175.55 174.58 2a39 s THR 387 N 0.84 1.22 -1.18 -0.71 2.01 0.05 -0.13 115.64 117.74 2a39 s THR 387 Ca -0.02 -1.20 -0.14 0.00 0.31 0.00 0.00 61.69 60.65 2a39 s THR 387 Cb -0.15 -1.13 -0.02 0.00 0.01 0.00 0.00 72.50 71.22 2a39 s THR 387 CO 0.01 -0.08 0.76 0.59 -0.69 0.00 0.00 174.62 175.21 2a39 n ASN 388 N 1.55 -4.33 -4.73 3.53 3.02 -0.61 -1.00 115.26 112.68 2a39 n ASN 388 Ca -0.19 -0.94 -0.42 0.00 -0.03 0.00 0.00 54.58 52.99 2a39 n ASN 388 Cb 0.54 -3.70 -0.03 0.00 -0.61 0.00 0.00 39.78 35.98 2a39 n ASN 388 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2a39 s LEU 389 N -6.41 4.37 -0.21 3.41 1.02 -1.26 -4.36 118.68 115.24 2a39 s LEU 389 Ca 0.35 2.73 -0.21 0.00 0.02 0.00 0.00 54.13 57.02 2a39 s LEU 389 Cb -0.11 -3.61 0.06 0.00 0.02 0.00 0.00 46.19 42.55 2a39 s LEU 389 CO 0.84 -0.84 0.59 0.00 0.02 0.00 0.00 176.35 176.96 2a39 s ARG 390 N 0.55 0.71 0.12 1.70 1.70 -0.12 -1.25 118.95 122.35 2a39 s ARG 390 Ca 0.67 0.77 -0.07 0.00 -0.47 0.00 0.00 55.73 56.63 2a39 s ARG 390 Cb -0.45 0.34 -0.01 0.00 -0.57 0.00 0.00 34.95 34.26 2a39 s ARG 390 CO 0.37 -0.10 0.19 1.67 -1.08 0.00 0.00 175.30 176.35 2a39 s TRP 391 N 0.20 0.34 -3.47 5.89 -2.14 -0.97 -0.60 118.94 118.19 2a39 s TRP 391 Ca -0.01 -0.75 0.00 0.00 2.66 0.00 0.00 56.10 58.00 2a39 s TRP 391 Cb -0.04 -0.13 0.00 0.00 -3.10 0.00 0.00 33.47 30.20 2a39 s TRP 391 CO 0.01 -0.59 0.00 0.41 -2.66 0.00 0.00 176.95 174.12 2a39 n GLY 392 N -0.11 -0.16 3.78 3.67 0.00 -0.49 -0.88 105.19 111.00 2a39 n GLY 392 Ca -0.11 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 2a39 n GLY 392 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a39 s GLU 393 N -2.00 4.02 0.17 1.61 2.02 -0.97 -0.47 118.70 123.08 2a39 s GLU 393 Ca 0.00 2.55 -0.33 0.00 0.02 0.00 0.00 54.97 57.21 2a39 s GLU 393 Cb 0.00 -2.90 -0.15 0.00 0.10 0.00 0.00 34.13 31.17 2a39 s GLU 393 CO 0.00 -0.60 1.30 -0.89 0.02 0.00 0.00 175.26 175.09 2a39 n ILE 394 N 0.32 0.62 -0.80 -1.63 2.08 -1.26 -1.24 119.36 117.44 2a39 n ILE 394 Ca 0.02 -0.15 0.00 0.00 0.56 0.00 0.00 62.75 63.17 2a39 n ILE 394 Cb 0.40 -1.04 0.00 0.00 -0.75 0.00 0.00 39.64 38.24 2a39 n ILE 394 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2a39 n GLY 395 N 2.30 1.25 0.55 7.39 0.00 -1.26 -4.90 105.19 110.51 2a39 n GLY 395 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2a39 n GLY 395 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2a39 n SER 396 N 0.00 2.10 0.02 1.61 3.41 -0.38 -4.50 113.62 115.88 2a39 n SER 396 Ca 0.00 -1.54 0.11 0.00 -0.26 0.00 0.00 58.87 57.18 2a39 n SER 396 Cb 0.00 0.37 0.02 0.00 -0.26 0.00 0.00 64.21 64.34 2a39 n SER 396 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2a39 n THR 397 N 0.14 0.10 -0.29 6.66 -2.24 -1.26 -4.69 114.28 112.71 2a39 n THR 397 Ca 0.10 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2a39 n THR 397 Cb 0.48 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 2a39 n THR 397 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50