#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q42 s GLN 2 N 0.00 3.59 -0.18 2.12 -0.21 0.91 -4.89 119.66 121.00 2q42 s GLN 2 Ca 0.00 -0.42 -0.13 0.00 0.02 0.00 0.00 55.36 54.83 2q42 s GLN 2 Cb 0.00 -3.79 -0.05 0.00 1.00 0.00 0.00 33.01 30.17 2q42 s GLN 2 CO 0.00 -0.49 0.26 0.42 -2.12 0.00 0.00 175.29 173.36 2q42 s ILE 3 N 1.97 5.32 -0.20 1.08 1.01 -1.26 0.50 121.20 129.63 2q42 s ILE 3 Ca 0.11 0.46 0.01 0.00 0.00 0.00 0.00 60.65 61.23 2q42 s ILE 3 Cb -0.17 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.73 2q42 s ILE 3 CO 0.11 0.38 -0.17 -0.70 0.00 0.00 0.00 174.94 174.56 2q42 s GLU 4 N 0.62 2.92 0.15 2.79 2.12 0.66 -4.97 118.70 122.99 2q42 s GLU 4 Ca 0.14 -0.89 -0.30 0.00 0.36 0.00 0.00 54.97 54.29 2q42 s GLU 4 Cb -0.13 -2.67 -0.07 0.00 0.26 0.00 0.00 34.13 31.53 2q42 s GLU 4 CO 0.03 -0.26 1.05 -0.51 -0.54 0.00 0.00 175.26 175.03 2q42 s LEU 5 N 1.28 4.49 -0.30 2.70 1.02 -1.26 -0.83 118.68 125.79 2q42 s LEU 5 Ca 0.03 1.99 0.02 0.00 0.02 0.00 0.00 54.13 56.19 2q42 s LEU 5 Cb -0.14 -3.60 0.09 0.00 0.02 0.00 0.00 46.19 42.56 2q42 s LEU 5 CO -0.11 -0.17 0.03 -0.69 0.02 0.00 0.00 176.35 175.43 2q42 s VAL 6 N -0.14 1.67 0.29 -1.59 1.01 -0.36 -4.94 120.40 116.33 2q42 s VAL 6 Ca 0.49 -1.75 -0.30 0.00 0.00 0.00 0.00 61.98 60.42 2q42 s VAL 6 Cb -0.27 -2.14 -0.11 0.00 0.00 0.00 0.00 36.38 33.86 2q42 s VAL 6 CO 0.33 -0.47 1.47 -2.84 0.00 0.00 0.00 175.10 173.59 2q42 s PRO 7 N 1.25 4.22 0.06 2.72 0.02 -1.26 -1.54 135.00 140.46 2q42 s PRO 7 Ca 0.05 2.40 0.01 0.00 0.02 0.00 0.00 61.00 63.48 2q42 s PRO 7 Cb -0.18 -3.06 -0.03 0.00 0.02 0.00 0.00 34.50 31.24 2q42 s PRO 7 CO -0.12 -0.46 -0.05 0.00 -0.33 0.00 0.00 177.00 176.03 2q42 n LEU 9 N 0.68 0.00 -0.08 0.00 4.77 -1.26 -1.29 117.00 119.82 2q42 n LEU 9 Ca -0.18 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.66 2q42 n LEU 9 Cb 0.58 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.57 2q42 n LEU 9 CO 0.25 0.00 0.04 0.50 -1.33 0.00 0.00 177.39 176.85 2q42 h LYS 10 N 0.00 0.00 0.00 3.23 3.64 -2.02 -3.43 116.57 117.99 2q42 h LYS 10 Ca 0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2q42 h LYS 10 Cb 0.00 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 2q42 h LYS 10 CO 0.00 0.83 -0.49 -0.40 -2.27 0.00 0.00 179.45 177.12 2q42 n ASP 11 N -4.58 0.11 -4.86 4.20 5.68 -1.23 -5.03 116.55 110.84 2q42 n ASP 11 Ca -0.15 -1.84 -0.31 0.00 -0.50 0.00 0.00 54.79 51.98 2q42 n ASP 11 Cb 0.47 -0.16 -0.05 0.00 -1.14 0.00 0.00 41.12 40.24 2q42 n ASP 11 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 2q42 s ASN 12 N -0.98 6.64 -0.13 -1.12 -0.87 -0.41 0.24 114.94 118.31 2q42 s ASN 12 Ca 0.05 1.23 0.02 0.00 -1.57 0.00 0.00 52.86 52.59 2q42 s ASN 12 Cb 0.06 -2.36 0.01 0.00 -0.02 0.00 0.00 41.25 38.94 2q42 s ASN 12 CO -0.02 -0.32 -0.20 -0.31 -2.57 0.00 0.00 177.10 173.67 2q42 s TYR 13 N -2.21 2.48 0.32 2.20 2.02 0.14 -1.08 117.35 121.22 2q42 s TYR 13 Ca 0.53 -1.24 0.05 0.00 -0.37 0.00 0.00 57.07 56.05 2q42 s TYR 13 Cb -0.10 -1.71 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 2q42 s TYR 13 CO 0.25 -0.58 0.47 0.00 -1.57 0.00 0.00 175.55 174.11 2q42 s ALA 14 N 0.88 4.12 -0.08 3.71 0.00 -0.59 -4.70 121.76 125.10 2q42 s ALA 14 Ca -0.06 -1.36 -0.01 0.00 0.00 0.00 0.00 51.96 50.53 2q42 s ALA 14 Cb -0.15 -1.74 0.03 0.00 0.00 0.00 0.00 23.12 21.25 2q42 s ALA 14 CO -0.02 -0.00 -0.03 0.71 0.00 0.00 0.00 175.76 176.42 2q42 s TYR 15 N -2.17 0.96 -0.26 0.00 2.02 -0.77 -1.23 117.35 115.91 2q42 s TYR 15 Ca 0.43 -0.37 -0.16 0.00 -0.37 0.00 0.00 57.07 56.60 2q42 s TYR 15 Cb -0.09 -0.95 -0.04 0.00 -0.40 0.00 0.00 41.96 40.48 2q42 s TYR 15 CO 0.31 -0.39 0.41 0.42 -1.57 0.00 0.00 175.55 174.73 2q42 s ILE 16 N 1.82 5.15 -0.22 2.71 1.01 -0.01 -0.40 121.20 131.27 2q42 s ILE 16 Ca 0.04 0.65 -0.15 0.00 0.00 0.00 0.00 60.65 61.20 2q42 s ILE 16 Cb -0.12 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 2q42 s ILE 16 CO -0.06 0.15 0.36 -0.76 0.00 0.00 0.00 174.94 174.63 2q42 s LEU 17 N 2.04 4.13 -0.21 2.97 1.43 0.15 -0.25 118.68 128.94 2q42 s LEU 17 Ca 0.17 0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 53.66 2q42 s LEU 17 Cb -0.16 -2.44 -0.01 0.00 0.03 0.00 0.00 46.19 43.62 2q42 s LEU 17 CO 0.09 -0.07 -0.06 -1.00 0.23 0.00 0.00 176.35 175.55 2q42 s HIS 18 N 1.38 2.94 0.28 0.29 3.76 0.18 -1.65 115.29 122.46 2q42 s HIS 18 Ca 0.17 -0.93 -0.26 0.00 -0.15 0.00 0.00 55.06 53.89 2q42 s HIS 18 Cb -0.15 -2.07 -0.09 0.00 1.11 0.00 0.00 32.58 31.38 2q42 s HIS 18 CO 0.08 -0.51 0.89 0.34 -0.85 0.00 0.00 174.74 174.68 2q42 s ASP 19 N 1.33 7.35 -0.12 1.40 2.15 -0.50 -0.06 116.67 128.22 2q42 s ASP 19 Ca 0.04 1.77 -0.28 0.00 0.43 0.00 0.00 52.55 54.51 2q42 s ASP 19 Cb -0.14 -2.55 -0.26 0.00 -0.30 0.00 0.00 42.92 39.67 2q42 s ASP 19 CO -0.03 0.02 0.82 -0.33 -0.17 0.00 0.00 175.17 175.48 2q42 h GLU 20 N 3.50 0.04 0.08 4.34 3.07 -1.93 -0.98 114.58 122.70 2q42 h GLU 20 Ca -0.47 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.33 2q42 h GLU 20 Cb 1.19 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.13 2q42 h GLU 20 CO 0.66 0.99 -0.04 0.22 -1.40 0.00 0.00 179.01 179.44 2q42 h ASP 21 N -0.89 -0.09 0.11 1.42 3.58 -1.98 -3.30 116.42 115.27 2q42 h ASP 21 Ca -0.02 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2q42 h ASP 21 Cb 1.03 0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.11 2q42 h ASP 21 CO 0.02 0.19 -1.07 0.35 -2.88 0.00 0.00 179.24 175.85 2q42 n THR 22 N -5.01 0.02 0.00 2.25 -2.24 -1.26 -4.94 114.28 103.10 2q42 n THR 22 Ca -0.08 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2q42 n THR 22 Cb 0.18 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 2q42 n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q42 n GLY 23 N 1.45 2.32 3.39 3.38 0.00 -0.37 -4.92 105.19 110.43 2q42 n GLY 23 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2q42 n GLY 23 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2q42 n THR 24 N -1.92 1.31 -5.08 2.61 -1.04 -1.26 -4.41 114.28 104.49 2q42 n THR 24 Ca 0.00 -0.50 -0.28 0.00 -2.04 0.00 0.00 64.05 61.23 2q42 n THR 24 Cb 0.00 -0.33 -0.16 0.00 -1.82 0.00 0.00 70.33 68.02 2q42 n THR 24 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2q42 s VAL 25 N -1.61 1.75 0.14 12.58 1.01 -1.26 -1.41 120.40 131.59 2q42 s VAL 25 Ca 0.62 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.73 2q42 s VAL 25 Cb -0.59 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2q42 s VAL 25 CO 0.60 0.49 -0.13 -0.83 0.00 0.00 0.00 175.10 175.23 2q42 s GLY 26 N -0.34 1.14 -0.04 4.51 0.00 -0.66 -0.14 107.32 111.80 2q42 s GLY 26 Ca 0.04 -1.39 0.03 0.00 0.00 0.00 0.00 44.72 43.39 2q42 s GLY 26 CO 0.01 -1.47 -0.12 0.54 0.00 0.00 0.00 173.10 172.06 2q42 s VAL 27 N -2.51 1.06 -0.20 1.40 0.11 0.18 0.29 120.40 120.73 2q42 s VAL 27 Ca 0.13 -0.50 -0.11 0.00 -2.93 0.00 0.00 61.98 58.57 2q42 s VAL 27 Cb -0.03 -0.93 -0.05 0.00 -1.53 0.00 0.00 36.38 33.84 2q42 s VAL 27 CO 0.03 0.32 0.16 -0.69 -3.33 0.00 0.00 175.10 171.59 2q42 s VAL 28 N 0.21 5.39 -1.20 2.04 1.01 0.46 -0.74 120.40 127.56 2q42 s VAL 28 Ca -0.05 0.24 -0.15 0.00 0.00 0.00 0.00 61.98 62.02 2q42 s VAL 28 Cb -0.11 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 2q42 s VAL 28 CO 0.01 0.42 0.72 0.47 0.00 0.00 0.00 175.10 176.72 2q42 n ASP 29 N 3.66 -4.05 -4.56 3.32 8.00 0.46 -1.85 116.55 121.53 2q42 n ASP 29 Ca -0.15 -1.00 -0.30 0.00 0.71 0.00 0.00 54.79 54.05 2q42 n ASP 29 Cb 0.52 -3.39 -0.04 0.00 -0.02 0.00 0.00 41.12 38.18 2q42 n ASP 29 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2q42 s PRO 30 N -6.07 2.50 0.32 -0.24 0.04 -1.20 -4.34 135.00 126.01 2q42 s PRO 30 Ca 0.35 0.10 0.06 0.00 0.04 0.00 0.00 61.00 61.54 2q42 s PRO 30 Cb -0.12 -4.82 0.70 0.00 0.04 0.00 0.00 34.50 30.30 2q42 s PRO 30 CO 0.86 -3.24 1.84 0.77 0.04 0.00 0.00 177.00 177.27 2q42 h SER 31 N 12.81 0.78 -5.08 6.66 0.02 -1.78 0.12 113.55 127.08 2q42 h SER 31 Ca -0.03 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.88 2q42 h SER 31 Cb 1.06 -0.10 -0.16 0.00 0.14 0.00 0.00 62.40 63.34 2q42 h SER 31 CO 1.20 0.39 -0.29 -1.83 -1.14 0.00 0.00 176.83 175.16 2q42 s GLU 32 N -5.82 0.82 0.00 3.45 -1.05 -1.26 -2.87 118.70 111.97 2q42 s GLU 32 Ca -0.11 -0.65 -0.19 0.00 -0.15 0.00 0.00 54.97 53.87 2q42 s GLU 32 Cb 0.23 0.35 -0.28 0.00 -0.44 0.00 0.00 34.13 33.98 2q42 s GLU 32 CO 0.80 -0.26 1.03 0.00 0.95 0.00 0.00 175.26 177.78 2q42 h ALA 33 N 3.09 -0.01 -0.56 -0.84 0.00 -1.84 -3.39 119.26 115.70 2q42 h ALA 33 Ca -0.32 -0.67 0.09 0.00 0.00 0.00 0.00 54.91 54.00 2q42 h ALA 33 Cb 1.20 0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.97 2q42 h ALA 33 CO 0.49 0.46 -0.39 1.49 0.00 0.00 0.00 179.25 181.30 2q42 h GLU 34 N -0.07 -0.20 -0.94 0.00 4.57 -1.98 -0.80 114.58 115.16 2q42 h GLU 34 Ca -0.13 0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.16 2q42 h GLU 34 Cb 1.61 0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 30.18 2q42 h GLU 34 CO 0.17 -0.14 0.60 -1.35 -1.18 0.00 0.00 179.01 177.12 2q42 h PRO 35 N -0.21 0.94 -0.07 0.92 0.11 -1.94 0.51 132.00 132.26 2q42 h PRO 35 Ca 0.20 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.24 2q42 h PRO 35 Cb 0.56 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.46 2q42 h PRO 35 CO -0.67 0.62 -0.01 0.82 -0.21 0.00 0.00 178.00 178.55 2q42 h ILE 36 N 0.97 1.27 -0.33 4.15 1.08 -1.45 -1.43 117.51 121.77 2q42 h ILE 36 Ca 0.44 -0.84 0.05 0.00 -0.39 0.00 0.00 64.86 64.11 2q42 h ILE 36 Cb 0.38 1.70 -0.04 0.00 -3.07 0.00 0.00 36.82 35.78 2q42 h ILE 36 CO -0.19 0.23 0.07 0.40 -0.69 0.00 0.00 178.15 177.97 2q42 h ILE 37 N -0.19 0.85 -0.79 -0.67 2.04 -0.57 0.21 117.51 118.39 2q42 h ILE 37 Ca 0.02 -0.07 0.09 0.00 1.00 0.00 0.00 64.86 65.90 2q42 h ILE 37 Cb 0.37 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 2q42 h ILE 37 CO 0.00 0.04 0.45 0.44 0.00 0.00 0.00 178.15 179.08 2q42 h ASP 38 N 0.19 0.64 -0.21 1.72 3.32 0.14 0.70 116.42 122.92 2q42 h ASP 38 Ca 0.15 0.05 -0.16 0.00 0.02 0.00 0.00 57.03 57.09 2q42 h ASP 38 Cb 0.16 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2q42 h ASP 38 CO -0.19 0.37 -0.46 -1.28 -1.72 0.00 0.00 179.24 175.96 2q42 h SER 39 N 0.76 0.84 0.12 6.45 0.87 -0.53 -2.14 113.55 119.94 2q42 h SER 39 Ca 0.38 -0.41 -0.10 0.00 -1.23 0.00 0.00 61.79 60.43 2q42 h SER 39 Cb 0.33 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2q42 h SER 39 CO -0.24 1.17 -0.33 -0.07 -0.53 0.00 0.00 176.83 176.83 2q42 h LEU 40 N 0.62 0.32 -0.14 2.23 3.38 0.37 -1.98 115.31 120.12 2q42 h LEU 40 Ca 0.04 -0.12 -0.18 0.00 0.09 0.00 0.00 57.88 57.71 2q42 h LEU 40 Cb 1.03 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.70 2q42 h LEU 40 CO 0.10 0.64 -0.61 0.11 0.09 0.00 0.00 178.44 178.77 2q42 h LYS 41 N 0.27 0.65 0.00 1.13 1.79 -0.87 0.72 116.57 120.26 2q42 h LYS 41 Ca 0.03 -0.52 -0.03 0.00 -2.18 0.00 0.00 60.65 57.96 2q42 h LYS 41 Cb 0.72 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2q42 h LYS 41 CO 0.06 1.14 -0.13 -0.09 -1.08 0.00 0.00 179.45 179.34 2q42 h ARG 42 N 0.32 0.00 -0.01 3.15 2.43 -1.21 0.02 114.38 119.09 2q42 h ARG 42 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2q42 h ARG 42 Cb 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 2q42 h ARG 42 CO 0.13 0.13 -0.70 -1.13 -1.51 0.00 0.00 179.97 176.89 2q42 n SER 43 N -3.82 1.37 -3.08 -3.80 3.41 -0.76 -5.04 113.62 101.90 2q42 n SER 43 Ca -0.02 -1.18 -0.11 0.00 -0.26 0.00 0.00 58.87 57.29 2q42 n SER 43 Cb 0.23 0.76 0.01 0.00 -0.26 0.00 0.00 64.21 64.95 2q42 n SER 43 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q42 n GLY 44 N 1.40 -1.09 3.53 5.00 0.00 0.24 -5.05 105.19 109.21 2q42 n GLY 44 Ca 0.06 0.96 -0.08 0.00 0.00 0.00 0.00 46.02 46.96 2q42 n GLY 44 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2q42 s ARG 45 N -2.91 0.73 0.26 1.61 3.52 -0.52 -5.01 118.95 116.65 2q42 s ARG 45 Ca 0.17 -0.27 -0.01 0.00 -0.13 0.00 0.00 55.73 55.48 2q42 s ARG 45 Cb -0.04 0.33 -0.04 0.00 -1.56 0.00 0.00 34.95 33.64 2q42 s ARG 45 CO 0.79 -0.32 0.47 1.21 -0.81 0.00 0.00 175.30 176.64 2q42 s ASN 46 N -2.44 6.38 -0.13 -2.12 3.84 -1.26 -4.61 114.94 114.59 2q42 s ASN 46 Ca 0.06 0.48 -0.23 0.00 0.21 0.00 0.00 52.86 53.38 2q42 s ASN 46 Cb -0.01 -2.04 -0.03 0.00 -0.55 0.00 0.00 41.25 38.62 2q42 s ASN 46 CO -0.08 -0.15 0.73 -0.22 -2.79 0.00 0.00 177.10 174.59 2q42 s LEU 47 N -3.67 4.23 -0.18 3.21 2.96 -1.26 -4.41 118.68 119.56 2q42 s LEU 47 Ca 0.40 1.10 -0.22 0.00 -0.22 0.00 0.00 54.13 55.19 2q42 s LEU 47 Cb -0.10 -3.08 -0.22 0.00 0.50 0.00 0.00 46.19 43.28 2q42 s LEU 47 CO 0.31 -0.24 0.37 0.74 -1.32 0.00 0.00 176.35 176.20 2q42 h THR 48 N 5.00 1.08 -3.83 3.68 2.02 -0.91 -3.36 112.91 116.59 2q42 h THR 48 Ca -0.35 -2.25 -0.36 0.00 0.77 0.00 0.00 66.41 64.23 2q42 h THR 48 Cb 1.16 2.51 -0.20 0.00 -1.74 0.00 0.00 68.15 69.89 2q42 h THR 48 CO 0.78 0.44 -0.75 -0.31 0.37 0.00 0.00 175.52 176.06 2q42 s TYR 49 N -2.36 1.09 -0.09 3.16 2.02 -0.83 -1.12 117.35 119.23 2q42 s TYR 49 Ca -0.26 -0.55 0.02 0.00 -0.37 0.00 0.00 57.07 55.92 2q42 s TYR 49 Cb 0.04 -0.61 0.01 0.00 -0.40 0.00 0.00 41.96 41.01 2q42 s TYR 49 CO 0.64 0.02 -0.14 0.42 -1.57 0.00 0.00 175.55 174.93 2q42 s ILE 50 N -1.80 1.30 -0.07 2.71 1.01 -0.07 -0.64 121.20 123.65 2q42 s ILE 50 Ca 0.00 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.13 2q42 s ILE 50 Cb -0.07 -1.20 0.01 0.00 0.01 0.00 0.00 42.46 41.21 2q42 s ILE 50 CO 0.01 0.40 -0.15 -0.76 0.00 0.00 0.00 174.94 174.44 2q42 s LEU 51 N 0.85 1.77 -0.06 2.97 1.02 0.08 0.11 118.68 125.42 2q42 s LEU 51 Ca -0.10 -0.35 0.04 0.00 0.02 0.00 0.00 54.13 53.73 2q42 s LEU 51 Cb -0.15 -0.95 -0.02 0.00 0.02 0.00 0.00 46.19 45.08 2q42 s LEU 51 CO 0.01 0.08 -0.19 0.20 0.02 0.00 0.00 176.35 176.47 2q42 s ASN 52 N 0.50 3.64 0.10 2.29 -0.87 -0.94 -0.40 114.94 119.25 2q42 s ASN 52 Ca -0.14 -0.34 0.01 0.00 -1.57 0.00 0.00 52.86 50.83 2q42 s ASN 52 Cb -0.15 -0.90 -0.25 0.00 -0.02 0.00 0.00 41.25 39.93 2q42 s ASN 52 CO 0.04 0.29 1.21 0.71 -2.57 0.00 0.00 177.10 176.78 2q42 h THR 53 N 4.72 1.61 -2.97 1.60 1.35 -1.89 -3.41 112.91 113.92 2q42 h THR 53 Ca -0.39 -3.24 0.03 0.00 -0.55 0.00 0.00 66.41 62.26 2q42 h THR 53 Cb 1.16 2.90 -0.02 0.00 -1.73 0.00 0.00 68.15 70.46 2q42 h THR 53 CO 0.50 0.94 0.27 -1.38 -0.25 0.00 0.00 175.52 175.59 2q42 s HIS 54 N -2.68 -0.02 -0.52 4.73 -3.43 -1.26 0.67 115.29 112.78 2q42 s HIS 54 Ca -0.02 -0.55 0.24 0.00 -0.80 0.00 0.00 55.06 53.93 2q42 s HIS 54 Cb 0.09 0.78 0.43 0.00 -1.43 0.00 0.00 32.58 32.44 2q42 s HIS 54 CO 0.85 -1.40 1.55 1.12 -2.00 0.00 0.00 174.74 174.87 2q42 h HIS 55 N 2.00 0.00 -2.32 0.38 -0.00 -1.88 -3.42 115.15 109.91 2q42 h HIS 55 Ca -0.26 0.00 -0.61 0.00 -0.00 0.00 0.00 60.37 59.49 2q42 h HIS 55 Cb 1.25 0.00 0.11 0.00 -0.00 0.00 0.00 27.41 28.76 2q42 h HIS 55 CO 0.96 0.00 0.11 0.72 -0.00 0.00 0.00 177.93 179.72 2q42 n HIS 56 N -2.71 1.17 -0.26 6.12 8.25 -1.26 -4.60 115.22 121.93 2q42 n HIS 56 Ca 0.04 0.72 0.21 0.00 -0.26 0.00 0.00 57.72 58.42 2q42 n HIS 56 Cb 0.50 -2.24 0.53 0.00 1.12 0.00 0.00 29.99 29.89 2q42 n HIS 56 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2q42 h TYR 57 N 2.12 0.53 0.00 4.41 3.20 -1.95 0.16 116.97 125.44 2q42 h TYR 57 Ca -0.39 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.49 2q42 h TYR 57 Cb 1.35 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2q42 h TYR 57 CO 0.48 0.11 0.00 -0.40 -1.64 0.00 0.00 178.16 176.71 2q42 n ASP 58 N -4.52 0.00 0.00 -2.11 5.75 -1.26 -0.84 116.55 113.57 2q42 n ASP 58 Ca 0.21 -0.69 0.00 0.00 -0.01 0.00 0.00 54.79 54.30 2q42 n ASP 58 Cb 0.77 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.86 2q42 n ASP 58 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2q42 n HIS 59 N -0.93 0.00 -0.47 2.11 8.25 0.54 -4.01 115.22 120.70 2q42 n HIS 59 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2q42 n HIS 59 Cb 0.06 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.17 2q42 n HIS 59 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2q42 n THR 60 N -0.81 0.07 0.04 1.59 -2.24 -1.06 -3.22 114.28 108.66 2q42 n THR 60 Ca 0.00 -0.30 0.11 0.00 -2.27 0.00 0.00 64.05 61.59 2q42 n THR 60 Cb 0.00 1.37 0.56 0.00 -2.10 0.00 0.00 70.33 70.16 2q42 n THR 60 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2q42 h GLY 61 N 0.00 0.31 -0.04 3.38 0.00 -1.01 -2.15 103.07 103.56 2q42 h GLY 61 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2q42 h GLY 61 CO 0.00 0.08 -0.25 0.61 0.00 0.00 0.00 176.54 176.97 2q42 n GLY 62 N -1.54 -0.43 0.23 4.60 0.00 0.40 -4.66 105.19 103.79 2q42 n GLY 62 Ca 0.05 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 2q42 n GLY 62 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2q42 h ASN 63 N 1.56 -0.79 -0.92 1.61 4.21 -1.54 -1.29 115.58 118.41 2q42 h ASN 63 Ca 0.00 0.09 0.01 0.00 1.21 0.00 0.00 56.30 57.60 2q42 h ASN 63 Cb 0.55 0.30 -0.05 0.00 -1.12 0.00 0.00 38.32 38.00 2q42 h ASN 63 CO 0.00 -0.26 0.60 -0.07 -1.29 0.00 0.00 177.43 176.42 2q42 h LEU 64 N -0.33 1.06 -0.34 1.61 3.38 -1.83 0.16 115.31 119.03 2q42 h LEU 64 Ca 0.00 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2q42 h LEU 64 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2q42 h LEU 64 CO -0.16 0.78 -0.15 -0.08 0.09 0.00 0.00 178.44 178.92 2q42 h GLU 65 N 1.25 0.70 -0.44 1.13 4.81 -1.86 -1.71 114.58 118.47 2q42 h GLU 65 Ca 0.34 -0.30 -0.12 0.00 -0.13 0.00 0.00 59.36 59.15 2q42 h GLU 65 Cb -0.13 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 2q42 h GLU 65 CO -0.07 0.90 -0.20 -0.07 -0.73 0.00 0.00 179.01 178.84 2q42 h LEU 66 N 0.48 0.93 -0.29 1.64 3.38 -0.52 -0.95 115.31 119.98 2q42 h LEU 66 Ca 0.08 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.66 2q42 h LEU 66 Cb 0.68 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2q42 h LEU 66 CO 0.05 1.12 0.18 0.50 0.09 0.00 0.00 178.44 180.38 2q42 h LYS 67 N 0.74 0.36 -0.11 1.13 3.64 -0.65 -1.22 116.57 120.46 2q42 h LYS 67 Ca 0.10 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.35 2q42 h LYS 67 Cb 0.77 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 2q42 h LYS 67 CO 0.06 0.24 -0.43 0.22 -2.27 0.00 0.00 179.45 177.26 2q42 h ASP 68 N 0.37 0.26 -0.05 4.20 1.82 -1.24 0.32 116.42 122.10 2q42 h ASP 68 Ca 0.11 -0.11 -0.18 0.00 -0.39 0.00 0.00 57.03 56.46 2q42 h ASP 68 Cb -0.02 -0.07 -0.00 0.00 0.68 0.00 0.00 39.33 39.91 2q42 h ASP 68 CO -0.04 0.66 -0.59 -0.09 -1.61 0.00 0.00 179.24 177.57 2q42 h ARG 69 N 0.20 0.65 0.00 0.28 2.43 -0.83 -3.36 114.38 113.75 2q42 h ARG 69 Ca 0.02 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 2q42 h ARG 69 Cb 0.85 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2q42 h ARG 69 CO 0.07 1.05 -0.74 0.66 -1.51 0.00 0.00 179.97 179.50 2q42 n TYR 70 N -3.95 0.00 -1.89 2.20 4.01 -0.49 -5.00 117.16 112.04 2q42 n TYR 70 Ca -0.04 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.63 2q42 n TYR 70 Cb 0.64 -0.07 -0.01 0.00 -0.31 0.00 0.00 39.34 39.59 2q42 n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2q42 n GLY 71 N 1.50 0.30 3.78 2.72 0.00 0.11 -4.79 105.19 108.81 2q42 n GLY 71 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 2q42 n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q42 s ALA 72 N -2.31 2.17 -0.18 4.61 0.00 -1.18 -5.00 121.76 119.87 2q42 s ALA 72 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.87 2q42 s ALA 72 Cb 0.00 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 2q42 s ALA 72 CO 0.00 -1.78 0.09 0.15 0.00 0.00 0.00 175.76 174.22 2q42 s LYS 73 N -5.02 4.00 -0.28 0.00 -0.14 -0.27 -4.80 119.74 113.23 2q42 s LYS 73 Ca 0.61 -0.29 -0.14 0.00 -1.36 0.00 0.00 55.97 54.79 2q42 s LYS 73 Cb -0.16 -3.28 -0.04 0.00 -1.68 0.00 0.00 37.83 32.68 2q42 s LYS 73 CO 0.55 0.32 0.33 0.08 -0.76 0.00 0.00 175.35 175.88 2q42 s VAL 74 N 0.25 5.21 -0.17 3.17 1.01 -1.26 -0.89 120.40 127.72 2q42 s VAL 74 Ca 0.06 0.44 -0.07 0.00 0.00 0.00 0.00 61.98 62.41 2q42 s VAL 74 Cb -0.12 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2q42 s VAL 74 CO -0.00 0.16 0.06 -0.63 0.00 0.00 0.00 175.10 174.69 2q42 s ILE 75 N 1.99 4.81 0.32 2.22 -1.09 0.31 -0.26 121.20 129.50 2q42 s ILE 75 Ca 0.13 -0.03 -0.10 0.00 -2.23 0.00 0.00 60.65 58.41 2q42 s ILE 75 Cb -0.16 -3.15 0.04 0.00 -1.58 0.00 0.00 42.46 37.61 2q42 s ILE 75 CO 0.10 0.49 0.61 0.61 -1.23 0.00 0.00 174.94 175.52 2q42 n GLY 76 N 3.30 1.36 3.70 6.18 0.00 -0.09 -2.22 105.19 117.42 2q42 n GLY 76 Ca -0.17 -1.28 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 2q42 n GLY 76 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2q42 s SER 77 N -2.74 7.28 0.30 1.61 0.15 -1.26 -1.12 113.70 117.92 2q42 s SER 77 Ca 0.15 1.68 0.00 0.00 0.70 0.00 0.00 55.95 58.49 2q42 s SER 77 Cb -0.03 -2.57 0.51 0.00 -1.71 0.00 0.00 66.02 62.21 2q42 s SER 77 CO 0.11 -0.35 1.91 0.00 1.20 0.00 0.00 173.24 176.11 2q42 h ALA 78 N 6.92 1.49 -0.25 5.45 0.00 -1.81 0.26 119.26 131.31 2q42 h ALA 78 Ca -0.38 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.58 2q42 h ALA 78 Cb 1.20 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2q42 h ALA 78 CO 0.79 0.37 0.29 0.52 0.00 0.00 0.00 179.25 181.22 2q42 h MET 79 N 1.06 0.00 -0.13 0.00 2.86 -1.91 -0.81 114.93 116.00 2q42 h MET 79 Ca 0.40 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.04 2q42 h MET 79 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2q42 h MET 79 CO -0.15 0.00 0.00 -0.25 1.06 0.00 0.00 176.91 177.57 2q42 n ASP 80 N -3.73 2.75 -0.31 1.22 8.00 -0.03 -4.78 116.55 119.68 2q42 n ASP 80 Ca 0.03 -2.62 0.27 0.00 0.71 0.00 0.00 54.79 53.19 2q42 n ASP 80 Cb 0.42 -0.32 0.61 0.00 -0.02 0.00 0.00 41.12 41.81 2q42 n ASP 80 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2q42 h LYS 81 N 0.80 0.22 0.00 -1.24 3.64 0.01 1.05 116.57 121.06 2q42 h LYS 81 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2q42 h LYS 81 Cb 0.95 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2q42 h LYS 81 CO 0.06 0.14 0.00 -0.25 -2.27 0.00 0.00 179.45 177.13 2q42 n ASP 82 N -4.44 0.37 -0.05 4.20 8.00 -1.26 -3.74 116.55 119.63 2q42 n ASP 82 Ca 0.25 0.54 0.04 0.00 0.71 0.00 0.00 54.79 56.33 2q42 n ASP 82 Cb 1.01 -0.64 -0.04 0.00 -0.02 0.00 0.00 41.12 41.43 2q42 n ASP 82 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2q42 n ARG 83 N -1.86 3.65 -3.08 -1.24 1.74 0.35 -4.90 116.66 111.32 2q42 n ARG 83 Ca 0.06 -0.14 -0.44 0.00 -0.77 0.00 0.00 57.85 56.57 2q42 n ARG 83 Cb 0.36 -0.95 -0.06 0.00 -1.02 0.00 0.00 32.46 30.80 2q42 n ARG 83 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2q42 s ILE 84 N -1.70 4.76 -0.06 0.55 -1.09 -0.51 -4.83 121.20 118.32 2q42 s ILE 84 Ca 0.04 -0.40 -0.38 0.00 -2.23 0.00 0.00 60.65 57.68 2q42 s ILE 84 Cb 0.07 -4.38 -0.16 0.00 -1.58 0.00 0.00 42.46 36.41 2q42 s ILE 84 CO 0.33 -0.92 1.51 -2.65 -1.23 0.00 0.00 174.94 171.98 2q42 n PRO 85 N 6.48 1.19 -1.30 2.79 -0.02 -1.26 -2.09 135.00 140.79 2q42 n PRO 85 Ca -0.05 0.43 -0.10 0.00 -2.02 0.00 0.00 63.50 61.76 2q42 n PRO 85 Cb 0.45 -2.10 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2q42 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q42 n GLY 86 N 3.22 1.04 3.66 -1.23 0.00 -1.26 -4.77 105.19 105.85 2q42 n GLY 86 Ca 0.22 -0.11 -0.48 0.00 0.00 0.00 0.00 46.02 45.64 2q42 n GLY 86 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2q42 n ILE 87 N -2.37 0.11 -0.05 -0.61 3.06 -0.89 -4.48 119.36 114.13 2q42 n ILE 87 Ca -0.10 -0.02 -0.05 0.00 -2.50 0.00 0.00 62.75 60.08 2q42 n ILE 87 Cb 0.50 -1.42 -0.08 0.00 0.54 0.00 0.00 39.64 39.18 2q42 n ILE 87 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 2q42 n ASP 88 N 3.83 2.36 -3.88 9.51 8.00 0.65 -4.96 116.55 132.05 2q42 n ASP 88 Ca 0.19 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.42 2q42 n ASP 88 Cb 0.26 0.81 -0.17 0.00 -0.02 0.00 0.00 41.12 42.00 2q42 n ASP 88 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2q42 s MET 89 N -2.29 1.36 -0.17 -1.24 1.75 -0.87 -5.01 119.30 112.83 2q42 s MET 89 Ca -0.05 -0.25 -0.12 0.00 -1.25 0.00 0.00 55.69 54.02 2q42 s MET 89 Cb 0.03 -1.58 -0.05 0.00 2.84 0.00 0.00 34.83 36.08 2q42 s MET 89 CO 0.44 -0.31 0.21 0.00 -0.65 0.00 0.00 175.02 174.71 2q42 s ALA 90 N 1.74 3.65 0.07 4.11 0.00 -1.26 -0.91 121.76 129.16 2q42 s ALA 90 Ca 0.04 -0.57 0.07 0.00 0.00 0.00 0.00 51.96 51.50 2q42 s ALA 90 Cb -0.13 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.70 2q42 s ALA 90 CO -0.08 0.16 -0.18 -0.51 0.00 0.00 0.00 175.76 175.14 2q42 s LEU 91 N 0.32 2.23 0.49 0.00 1.43 -0.27 -4.67 118.68 118.20 2q42 s LEU 91 Ca 0.12 -0.58 0.05 0.00 -1.03 0.00 0.00 54.13 52.70 2q42 s LEU 91 Cb -0.12 -0.80 0.00 0.00 0.03 0.00 0.00 46.19 45.30 2q42 s LEU 91 CO 0.01 0.07 0.28 -0.54 0.23 0.00 0.00 176.35 176.39 2q42 s LYS 92 N -1.49 2.26 0.07 1.70 3.01 -1.26 -3.07 119.74 120.95 2q42 s LYS 92 Ca 0.05 -2.00 -0.34 0.00 -1.01 0.00 0.00 55.97 52.67 2q42 s LYS 92 Cb -0.09 -1.99 -0.13 0.00 -1.01 0.00 0.00 37.83 34.61 2q42 s LYS 92 CO 0.03 -0.41 1.71 -3.47 0.51 0.00 0.00 175.35 173.71 2q42 n ASP 93 N -1.52 3.29 0.00 2.83 2.03 -1.26 -1.26 116.55 120.66 2q42 n ASP 93 Ca -0.04 1.04 0.00 0.00 0.52 0.00 0.00 54.79 56.31 2q42 n ASP 93 Cb 0.65 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.63 2q42 n ASP 93 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q42 n GLY 94 N 3.83 0.56 3.61 0.27 0.00 0.37 -4.99 105.19 108.84 2q42 n GLY 94 Ca 0.19 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2q42 n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2q42 s ASP 95 N -2.00 6.45 0.29 1.61 1.11 -0.39 -4.76 116.67 118.98 2q42 s ASP 95 Ca 0.00 0.81 -0.29 0.00 0.18 0.00 0.00 52.55 53.25 2q42 s ASP 95 Cb 0.00 -2.54 -0.09 0.00 1.07 0.00 0.00 42.92 41.35 2q42 s ASP 95 CO 0.00 -1.34 1.07 -0.54 1.18 0.00 0.00 175.17 175.54 2q42 s LYS 96 N 4.71 4.60 -0.04 8.23 1.02 -1.26 -2.42 119.74 134.59 2q42 s LYS 96 Ca 0.58 1.73 -0.01 0.00 0.02 0.00 0.00 55.97 58.28 2q42 s LYS 96 Cb -0.13 -3.12 0.03 0.00 -0.52 0.00 0.00 37.83 34.10 2q42 s LYS 96 CO 0.31 0.20 0.08 -0.46 -0.92 0.00 0.00 175.35 174.56 2q42 s TRP 97 N -1.23 -0.03 -0.48 3.18 -0.00 -0.34 -4.97 118.94 115.07 2q42 s TRP 97 Ca 0.46 0.29 -0.19 0.00 -0.00 0.00 0.00 56.10 56.65 2q42 s TRP 97 Cb -0.30 -0.24 0.04 0.00 -0.00 0.00 0.00 33.47 32.97 2q42 s TRP 97 CO 0.38 -0.14 0.62 -1.64 -0.00 0.00 0.00 176.95 176.17 2q42 s MET 98 N 1.39 3.16 -0.94 5.86 -1.94 -1.26 -1.53 119.30 124.04 2q42 s MET 98 Ca -0.06 -0.72 -0.24 0.00 -1.71 0.00 0.00 55.69 52.96 2q42 s MET 98 Cb -0.12 -4.04 0.04 0.00 2.01 0.00 0.00 34.83 32.71 2q42 s MET 98 CO -0.04 -1.13 1.46 0.12 -0.01 0.00 0.00 175.02 175.42 2q42 s PHE 99 N 2.66 2.40 -1.52 -0.03 5.36 -1.12 -3.78 117.98 121.95 2q42 s PHE 99 Ca 0.17 -0.52 -0.13 0.00 -0.96 0.00 0.00 56.93 55.48 2q42 s PHE 99 Cb -0.17 -4.62 0.09 0.00 -0.34 0.00 0.00 43.02 37.97 2q42 s PHE 99 CO 0.14 -1.96 0.90 0.00 -1.46 0.00 0.00 175.22 172.84 2q42 n ALA 100 N 9.47 -1.23 0.00 11.12 0.00 -1.26 -3.84 120.51 134.76 2q42 n ALA 100 Ca 0.27 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2q42 n ALA 100 Cb 0.50 -4.24 0.00 0.00 0.00 0.00 0.00 19.45 15.71 2q42 n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q42 n GLY 101 N -1.61 1.33 0.69 0.00 0.00 -1.25 -4.96 105.19 99.40 2q42 n GLY 101 Ca 0.03 -0.83 -0.11 0.00 0.00 0.00 0.00 46.02 45.12 2q42 n GLY 101 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2q42 n HIS 102 N 0.00 0.04 -2.38 1.61 -0.00 -1.25 -4.48 115.22 108.77 2q42 n HIS 102 Ca 0.00 0.21 -0.40 0.00 -0.00 0.00 0.00 57.72 57.52 2q42 n HIS 102 Cb 0.00 -0.41 -0.04 0.00 -0.00 0.00 0.00 29.99 29.55 2q42 n HIS 102 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.34 174.34 2q42 s GLU 103 N -0.08 4.52 -0.12 -0.41 2.12 -1.26 -2.79 118.70 120.68 2q42 s GLU 103 Ca 0.16 1.90 0.02 0.00 0.36 0.00 0.00 54.97 57.42 2q42 s GLU 103 Cb -0.23 -3.11 0.01 0.00 0.26 0.00 0.00 34.13 31.06 2q42 s GLU 103 CO 0.11 0.07 -0.19 0.08 -0.54 0.00 0.00 175.26 174.79 2q42 s VAL 104 N -1.19 1.82 -0.22 3.70 1.01 -0.58 -3.97 120.40 120.96 2q42 s VAL 104 Ca 0.47 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.52 2q42 s VAL 104 Cb -0.34 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2q42 s VAL 104 CO 0.44 0.50 0.10 -1.00 0.00 0.00 0.00 175.10 175.13 2q42 s HIS 105 N 0.81 3.20 -0.13 5.22 3.76 0.96 -1.19 115.29 127.92 2q42 s HIS 105 Ca -0.09 -0.06 -0.21 0.00 -0.15 0.00 0.00 55.06 54.56 2q42 s HIS 105 Cb -0.16 -2.20 -0.03 0.00 1.11 0.00 0.00 32.58 31.30 2q42 s HIS 105 CO -0.00 -0.07 0.61 0.08 -0.85 0.00 0.00 174.74 174.51 2q42 s VAL 106 N 1.06 5.08 -0.18 -0.90 1.01 -1.02 -0.24 120.40 125.21 2q42 s VAL 106 Ca 0.05 1.21 0.01 0.00 0.00 0.00 0.00 61.98 63.25 2q42 s VAL 106 Cb -0.14 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.33 2q42 s VAL 106 CO 0.04 0.22 -0.14 -0.04 0.00 0.00 0.00 175.10 175.18 2q42 s MET 107 N 1.15 2.32 0.21 2.72 -1.94 0.15 0.14 119.30 124.06 2q42 s MET 107 Ca 0.31 -0.74 -0.30 0.00 -1.71 0.00 0.00 55.69 53.25 2q42 s MET 107 Cb -0.16 -2.33 -0.09 0.00 2.01 0.00 0.00 34.83 34.26 2q42 s MET 107 CO 0.13 -0.31 1.40 -0.51 -0.01 0.00 0.00 175.02 175.72 2q42 s ASP 108 N 1.41 6.75 -0.45 3.03 1.01 -1.26 -0.23 116.67 126.92 2q42 s ASP 108 Ca 0.02 2.54 0.06 0.00 0.71 0.00 0.00 52.55 55.89 2q42 s ASP 108 Cb -0.14 -2.61 0.22 0.00 1.01 0.00 0.00 42.92 41.40 2q42 s ASP 108 CO -0.10 -0.65 0.50 0.35 0.21 0.00 0.00 175.17 175.49 2q42 n THR 109 N 2.72 -0.27 -1.21 -1.27 -2.24 -0.96 -4.87 114.28 106.19 2q42 n THR 109 Ca 0.08 -4.08 -0.33 0.00 -2.27 0.00 0.00 64.05 57.45 2q42 n THR 109 Cb 0.41 -1.91 0.11 0.00 -2.10 0.00 0.00 70.33 66.84 2q42 n THR 109 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2q42 s PRO 110 N -1.05 1.86 0.00 -0.78 0.04 -1.26 -4.59 135.00 129.21 2q42 s PRO 110 Ca 0.34 1.59 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2q42 s PRO 110 Cb 0.12 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.84 2q42 s PRO 110 CO -0.12 -2.01 0.00 0.41 0.04 0.00 0.00 177.00 175.31 2q42 n GLY 111 N 0.06 0.83 0.40 0.56 0.00 -1.26 -3.26 105.19 102.50 2q42 n GLY 111 Ca 0.12 -0.11 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 2q42 n GLY 111 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2q42 h HIS 112 N 0.00 -0.92 -2.57 1.61 -0.00 -1.81 -2.04 115.15 109.43 2q42 h HIS 112 Ca 0.00 -0.02 -0.51 0.00 -0.00 0.00 0.00 60.37 59.84 2q42 h HIS 112 Cb 0.00 0.30 -0.14 0.00 -0.00 0.00 0.00 27.41 27.57 2q42 h HIS 112 CO 0.00 -0.57 -0.70 0.95 -0.00 0.00 0.00 177.93 177.61 2q42 s THR 113 N -4.96 1.85 0.20 6.26 -4.23 -1.26 -1.77 115.64 111.73 2q42 s THR 113 Ca -0.14 -2.20 0.06 0.00 -1.18 0.00 0.00 61.69 58.23 2q42 s THR 113 Cb 0.01 -2.35 -0.11 0.00 1.34 0.00 0.00 72.50 71.40 2q42 s THR 113 CO 0.43 -0.38 1.45 0.11 -0.54 0.00 0.00 174.62 175.70 2q42 h LYS 114 N 2.32 0.10 -0.47 3.99 1.57 -1.85 -3.12 116.57 119.11 2q42 h LYS 114 Ca -0.40 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2q42 h LYS 114 Cb 1.24 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2q42 h LYS 114 CO 0.65 0.83 0.00 0.41 -0.57 0.00 0.00 179.45 180.78 2q42 n GLY 115 N 0.70 1.14 3.77 3.86 0.00 -1.26 -4.59 105.19 108.80 2q42 n GLY 115 Ca -0.02 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.16 2q42 n GLY 115 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2q42 s HIS 116 N -1.55 3.25 0.13 1.61 5.04 -1.18 -4.67 115.29 117.92 2q42 s HIS 116 Ca 0.27 1.58 0.04 0.00 -1.54 0.00 0.00 55.06 55.42 2q42 s HIS 116 Cb 0.16 -3.40 -0.04 0.00 0.04 0.00 0.00 32.58 29.34 2q42 s HIS 116 CO 0.17 -1.12 -0.10 0.96 -2.34 0.00 0.00 174.74 172.31 2q42 s ILE 117 N -1.29 1.10 0.13 0.89 -4.36 0.21 -2.27 121.20 115.62 2q42 s ILE 117 Ca 0.51 -1.97 0.09 0.00 -0.26 0.00 0.00 60.65 59.03 2q42 s ILE 117 Cb -0.32 -1.74 -0.04 0.00 1.25 0.00 0.00 42.46 41.61 2q42 s ILE 117 CO 0.42 -0.71 -0.22 -0.44 0.24 0.00 0.00 174.94 174.22 2q42 s SER 118 N -3.00 2.89 -0.19 4.36 0.01 0.68 -4.64 113.70 113.80 2q42 s SER 118 Ca 0.14 -0.76 0.01 0.00 1.31 0.00 0.00 55.95 56.65 2q42 s SER 118 Cb 0.01 -0.18 0.04 0.00 0.21 0.00 0.00 66.02 66.10 2q42 s SER 118 CO 0.00 0.08 -0.11 -0.76 0.41 0.00 0.00 173.24 172.87 2q42 s LEU 119 N -2.19 2.13 -0.19 2.44 1.43 -0.95 -0.67 118.68 120.68 2q42 s LEU 119 Ca 0.12 -0.80 -0.11 0.00 -1.03 0.00 0.00 54.13 52.31 2q42 s LEU 119 Cb -0.09 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.88 2q42 s LEU 119 CO 0.06 -0.13 0.18 -0.47 0.23 0.00 0.00 176.35 176.22 2q42 s TYR 120 N 1.43 3.42 -0.62 0.29 5.04 0.66 -1.97 117.35 125.60 2q42 s TYR 120 Ca 0.00 0.40 -0.05 0.00 -2.44 0.00 0.00 57.07 54.98 2q42 s TYR 120 Cb -0.15 -2.22 0.16 0.00 0.35 0.00 0.00 41.96 40.09 2q42 s TYR 120 CO -0.09 0.26 0.46 -0.06 -1.34 0.00 0.00 175.55 174.78 2q42 s PHE 121 N 0.45 3.48 0.24 4.97 0.08 0.13 -0.03 117.98 127.31 2q42 s PHE 121 Ca 0.11 -2.48 -0.06 0.00 0.12 0.00 0.00 56.93 54.61 2q42 s PHE 121 Cb -0.12 -3.33 0.28 0.00 -0.57 0.00 0.00 43.02 39.28 2q42 s PHE 121 CO 0.00 -0.89 1.88 -1.00 -0.10 0.00 0.00 175.22 175.11 2q42 h PRO 122 N 7.40 1.09 0.00 0.24 0.13 -1.81 -1.27 132.00 137.79 2q42 h PRO 122 Ca -0.03 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2q42 h PRO 122 Cb 0.99 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2q42 h PRO 122 CO 0.73 0.72 0.00 0.41 -0.23 0.00 0.00 178.00 179.64 2q42 n GLY 123 N -1.34 -0.82 0.00 1.56 0.00 -1.26 -1.13 105.19 102.20 2q42 n GLY 123 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2q42 n GLY 123 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2q42 n SER 124 N -2.06 1.51 -4.20 1.61 7.64 -0.58 -4.92 113.62 112.63 2q42 n SER 124 Ca -0.01 -1.61 -0.34 0.00 1.01 0.00 0.00 58.87 57.93 2q42 n SER 124 Cb 0.05 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.21 2q42 n SER 124 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2q42 n ARG 125 N -0.30 -2.84 -4.83 1.43 1.74 -0.28 -4.85 116.66 106.72 2q42 n ARG 125 Ca 0.00 0.34 -0.25 0.00 -0.77 0.00 0.00 57.85 57.17 2q42 n ARG 125 Cb 0.19 -4.83 -0.15 0.00 -1.02 0.00 0.00 32.46 26.65 2q42 n ARG 125 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2q42 s ALA 126 N -3.52 1.45 -0.04 7.54 0.00 -0.91 -0.41 121.76 125.87 2q42 s ALA 126 Ca 0.53 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.76 2q42 s ALA 126 Cb -0.29 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.46 2q42 s ALA 126 CO 0.93 0.35 -0.06 -1.50 0.00 0.00 0.00 175.76 175.48 2q42 s ILE 127 N -0.36 0.62 -0.43 0.00 2.07 -0.19 0.21 121.20 123.12 2q42 s ILE 127 Ca 0.06 -0.20 -0.17 0.00 -1.41 0.00 0.00 60.65 58.93 2q42 s ILE 127 Cb -0.07 -0.61 0.03 0.00 0.13 0.00 0.00 42.46 41.94 2q42 s ILE 127 CO -0.00 0.23 0.42 -0.36 -1.91 0.00 0.00 174.94 173.32 2q42 s PHE 128 N 0.69 3.18 -2.56 3.50 0.08 -0.83 -1.34 117.98 120.70 2q42 s PHE 128 Ca -0.10 -0.47 0.23 0.00 0.12 0.00 0.00 56.93 56.72 2q42 s PHE 128 Cb -0.13 -2.89 0.41 0.00 -0.57 0.00 0.00 43.02 39.84 2q42 s PHE 128 CO 0.01 -0.71 1.39 0.25 -0.10 0.00 0.00 175.22 176.06 2q42 n THR 129 N 5.38 0.42 0.00 0.64 -2.24 -1.19 -2.23 114.28 115.05 2q42 n THR 129 Ca -0.08 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 2q42 n THR 129 Cb 0.47 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 2q42 n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q42 n GLY 130 N 1.48 3.31 1.48 3.38 0.00 -1.26 -1.11 105.19 112.47 2q42 n GLY 130 Ca 0.19 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 2q42 n GLY 130 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q42 n ASP 131 N 4.01 3.31 -0.07 1.61 9.92 -1.26 -0.78 116.55 133.29 2q42 n ASP 131 Ca 0.00 -3.55 -0.07 0.00 -0.53 0.00 0.00 54.79 50.64 2q42 n ASP 131 Cb 0.00 -0.68 -0.04 0.00 -0.64 0.00 0.00 41.12 39.76 2q42 n ASP 131 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2q42 h THR 132 N 1.36 0.28 -3.27 -3.53 2.02 -1.46 -2.34 112.91 105.97 2q42 h THR 132 Ca 0.29 -1.29 -0.64 0.00 0.77 0.00 0.00 66.41 65.53 2q42 h THR 132 Cb 2.00 0.62 -0.34 0.00 -1.74 0.00 0.00 68.15 68.69 2q42 h THR 132 CO 0.58 0.10 -0.86 -0.32 0.37 0.00 0.00 175.52 175.38 2q42 s MET 133 N -2.09 2.75 0.45 6.66 -2.45 -1.24 -1.68 119.30 121.69 2q42 s MET 133 Ca -0.14 -0.76 0.05 0.00 -1.25 0.00 0.00 55.69 53.59 2q42 s MET 133 Cb 0.02 -2.20 0.05 0.00 1.25 0.00 0.00 34.83 33.96 2q42 s MET 133 CO 0.26 0.03 0.45 1.19 1.05 0.00 0.00 175.02 178.00 2q42 n PHE 134 N 3.92 -1.42 -2.73 4.11 3.72 -0.48 -4.66 117.46 119.93 2q42 n PHE 134 Ca -0.20 -1.78 -0.43 0.00 -0.05 0.00 0.00 57.45 54.99 2q42 n PHE 134 Cb 0.52 -0.39 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 2q42 n PHE 134 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2q42 s SER 135 N -3.68 6.92 0.00 4.37 0.15 -1.26 -3.61 113.70 116.59 2q42 s SER 135 Ca 0.34 1.07 0.00 0.00 0.70 0.00 0.00 55.95 58.06 2q42 s SER 135 Cb -0.03 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2q42 s SER 135 CO 0.22 -0.74 0.00 0.18 1.20 0.00 0.00 173.24 174.10 2q42 n LEU 136 N 6.51 0.07 0.00 3.45 4.77 -1.26 -4.41 117.00 126.13 2q42 n LEU 136 Ca 0.10 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 2q42 n LEU 136 Cb 0.47 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.39 2q42 n LEU 136 CO 0.54 -0.04 0.06 -1.54 -1.33 0.00 0.00 177.39 175.08 2q42 n SER 137 N -0.01 -0.61 -4.35 -1.43 3.41 -1.24 -4.21 113.62 105.19 2q42 n SER 137 Ca 0.00 -1.98 -0.20 0.00 -0.26 0.00 0.00 58.87 56.43 2q42 n SER 137 Cb 0.00 1.18 -0.10 0.00 -0.26 0.00 0.00 64.21 65.03 2q42 n SER 137 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2q42 s GLY 139 N -3.42 2.14 0.52 0.00 0.00 -0.67 -4.80 107.32 101.08 2q42 s GLY 139 Ca 0.36 0.56 -0.22 0.00 0.00 0.00 0.00 44.72 45.42 2q42 s GLY 139 CO 0.15 0.91 1.29 0.54 0.00 0.00 0.00 173.10 175.99 2q42 s LYS 140 N -4.13 3.35 -0.70 2.90 1.02 -1.26 -4.74 119.74 116.19 2q42 s LYS 140 Ca 0.67 2.08 -0.21 0.00 0.02 0.00 0.00 55.97 58.53 2q42 s LYS 140 Cb -0.21 -2.31 0.09 0.00 -0.52 0.00 0.00 37.83 34.88 2q42 s LYS 140 CO 0.43 -0.97 0.94 -0.51 -0.92 0.00 0.00 175.35 174.31 2q42 s LEU 141 N -3.35 4.73 -0.16 3.17 1.43 -1.26 -4.16 118.68 119.08 2q42 s LEU 141 Ca 0.69 -1.28 -0.03 0.00 -1.03 0.00 0.00 54.13 52.47 2q42 s LEU 141 Cb -0.36 -2.39 -0.23 0.00 0.03 0.00 0.00 46.19 43.23 2q42 s LEU 141 CO 0.43 -1.30 0.19 0.49 0.23 0.00 0.00 176.35 176.39 2q42 n PHE 142 N 7.20 0.86 0.00 0.29 3.72 -0.95 -4.74 117.46 123.84 2q42 n PHE 142 Ca 0.00 0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 2q42 n PHE 142 Cb 0.45 -1.11 0.00 0.00 -0.94 0.00 0.00 39.48 37.88 2q42 n PHE 142 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2q42 n GLU 143 N -3.39 1.32 -3.52 -1.08 1.02 -0.73 -5.03 120.64 109.23 2q42 n GLU 143 Ca -0.36 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.55 2q42 n GLU 143 Cb 1.03 -0.88 0.02 0.00 -0.02 0.00 0.00 31.44 31.59 2q42 n GLU 143 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2q42 n GLY 144 N 2.05 2.52 3.89 0.62 0.00 -0.77 -4.68 105.19 108.82 2q42 n GLY 144 Ca 0.00 -2.28 -0.20 0.00 0.00 0.00 0.00 46.02 43.54 2q42 n GLY 144 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2q42 s THR 145 N -2.62 3.28 0.32 2.61 -4.23 -1.26 -4.87 115.64 108.88 2q42 s THR 145 Ca 0.39 -1.29 0.01 0.00 -1.18 0.00 0.00 61.69 59.62 2q42 s THR 145 Cb -0.03 -3.14 0.20 0.00 1.34 0.00 0.00 72.50 70.87 2q42 s THR 145 CO 0.25 -0.11 1.91 -0.65 -0.54 0.00 0.00 174.62 175.48 2q42 h PRO 146 N 1.10 0.75 -0.46 3.99 0.11 -1.95 -1.54 132.00 134.00 2q42 h PRO 146 Ca -0.43 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2q42 h PRO 146 Cb 1.26 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2q42 h PRO 146 CO 0.56 0.62 0.29 -0.22 -0.21 0.00 0.00 178.00 179.04 2q42 h LYS 147 N 0.74 0.61 -0.37 1.05 3.64 -1.95 0.12 116.57 120.42 2q42 h LYS 147 Ca 0.18 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 2q42 h LYS 147 Cb 0.16 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2q42 h LYS 147 CO -0.02 0.43 0.15 1.96 -2.27 0.00 0.00 179.45 179.71 2q42 h GLN 148 N 0.61 0.54 -0.79 1.90 4.20 -1.78 -2.19 115.11 117.60 2q42 h GLN 148 Ca 0.16 -0.09 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 2q42 h GLN 148 Cb -0.03 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.62 2q42 h GLN 148 CO -0.03 0.52 0.35 1.98 -0.67 0.00 0.00 178.83 180.98 2q42 h MET 149 N 0.45 1.16 0.18 1.46 4.05 -1.03 0.12 114.93 121.32 2q42 h MET 149 Ca 0.12 -0.18 -0.01 0.00 -0.28 0.00 0.00 59.70 59.35 2q42 h MET 149 Cb 0.17 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.77 2q42 h MET 149 CO -0.01 0.91 -0.09 1.25 0.23 0.00 0.00 176.91 179.20 2q42 h LEU 150 N 1.14 -0.21 -1.35 3.39 5.85 -0.53 0.63 115.31 124.23 2q42 h LEU 150 Ca 0.27 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 59.02 2q42 h LEU 150 Cb 0.16 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 2q42 h LEU 150 CO -0.03 -0.06 0.52 0.00 -0.34 0.00 0.00 178.44 178.52 2q42 h ALA 151 N 0.46 1.76 -0.27 1.25 0.00 -1.14 0.30 119.26 121.63 2q42 h ALA 151 Ca -0.03 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2q42 h ALA 151 Cb 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2q42 h ALA 151 CO 0.04 0.08 -0.10 0.77 0.00 0.00 0.00 179.25 180.04 2q42 h SER 152 N 0.73 0.55 0.07 0.00 0.02 -0.05 -0.23 113.55 114.64 2q42 h SER 152 Ca 0.36 -0.39 -0.10 0.00 -0.84 0.00 0.00 61.79 60.82 2q42 h SER 152 Cb 0.44 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2q42 h SER 152 CO -0.14 0.82 -0.34 -0.07 -1.14 0.00 0.00 176.83 175.96 2q42 h LEU 153 N 0.28 0.40 -0.72 5.07 3.38 0.09 -1.49 115.31 122.32 2q42 h LEU 153 Ca 0.06 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.75 2q42 h LEU 153 Cb 0.60 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2q42 h LEU 153 CO 0.03 0.71 -0.40 1.56 0.09 0.00 0.00 178.44 180.44 2q42 h GLN 154 N 0.33 0.51 -0.27 1.13 4.20 -0.26 -0.08 115.11 120.67 2q42 h GLN 154 Ca 0.04 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.48 2q42 h GLN 154 Cb 0.76 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2q42 h GLN 154 CO 0.06 0.83 0.10 0.87 -0.67 0.00 0.00 178.83 180.02 2q42 h LYS 155 N 0.42 0.41 -0.45 1.46 1.57 -0.59 -1.57 116.57 117.83 2q42 h LYS 155 Ca 0.04 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 2q42 h LYS 155 Cb 0.88 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.11 2q42 h LYS 155 CO 0.08 0.45 -0.08 0.82 -0.57 0.00 0.00 179.45 180.14 2q42 h ILE 156 N 0.29 1.25 -0.00 1.86 2.04 -1.17 -3.06 117.51 118.72 2q42 h ILE 156 Ca 0.09 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.82 2q42 h ILE 156 Cb 0.19 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2q42 h ILE 156 CO -0.01 0.39 -0.03 0.35 0.00 0.00 0.00 178.15 178.85 2q42 n THR 157 N -4.18 0.00 1.26 -0.27 -2.24 -0.05 -2.82 114.28 105.98 2q42 n THR 157 Ca 0.02 -0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.94 2q42 n THR 157 Cb 0.35 -0.45 0.62 0.00 -2.10 0.00 0.00 70.33 68.75 2q42 n THR 157 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2q42 n SER 158 N -1.46 0.21 -4.71 3.42 3.41 -0.61 -4.82 113.62 109.06 2q42 n SER 158 Ca 0.08 -0.12 -0.29 0.00 -0.26 0.00 0.00 58.87 58.28 2q42 n SER 158 Cb 0.32 -0.22 0.15 0.00 -0.26 0.00 0.00 64.21 64.21 2q42 n SER 158 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2q42 s LEU 159 N -2.71 2.10 0.41 1.04 1.43 -1.13 -4.94 118.68 114.88 2q42 s LEU 159 Ca 0.23 1.41 -0.24 0.00 -1.03 0.00 0.00 54.13 54.49 2q42 s LEU 159 Cb 0.20 -3.77 -0.11 0.00 0.03 0.00 0.00 46.19 42.53 2q42 s LEU 159 CO 0.51 -2.76 0.99 -2.65 0.23 0.00 0.00 176.35 172.67 2q42 n PRO 160 N -3.95 1.31 0.23 1.29 -0.02 -1.26 -4.82 135.00 127.78 2q42 n PRO 160 Ca 0.07 0.47 0.15 0.00 -2.02 0.00 0.00 63.50 62.17 2q42 n PRO 160 Cb 0.56 -2.00 0.82 0.00 -0.02 0.00 0.00 33.50 32.86 2q42 n PRO 160 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2q42 h ASP 161 N 1.54 0.00 -0.03 2.55 5.19 -1.92 -0.48 116.42 123.27 2q42 h ASP 161 Ca -0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 2q42 h ASP 161 Cb 1.34 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.85 2q42 h ASP 161 CO 0.57 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.79 2q42 n ASP 162 N -3.96 1.07 -4.69 6.45 5.68 -1.26 -2.32 116.55 117.52 2q42 n ASP 162 Ca -0.00 -1.41 -0.42 0.00 -0.50 0.00 0.00 54.79 52.46 2q42 n ASP 162 Cb 0.22 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.16 2q42 n ASP 162 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2q42 s THR 163 N -1.97 2.77 0.09 2.12 2.01 -0.19 -4.85 115.64 115.63 2q42 s THR 163 Ca 0.39 0.31 -0.24 0.00 0.31 0.00 0.00 61.69 62.46 2q42 s THR 163 Cb 0.20 -3.20 -0.07 0.00 0.01 0.00 0.00 72.50 69.44 2q42 s THR 163 CO 0.33 0.00 0.74 -0.44 -0.69 0.00 0.00 174.62 174.56 2q42 s SER 164 N 2.29 7.25 -0.18 3.53 0.01 0.45 -1.67 113.70 125.38 2q42 s SER 164 Ca 0.76 1.49 -0.04 0.00 1.31 0.00 0.00 55.95 59.47 2q42 s SER 164 Cb -0.43 -2.46 -0.02 0.00 0.21 0.00 0.00 66.02 63.32 2q42 s SER 164 CO 0.33 0.12 -0.04 -0.63 0.41 0.00 0.00 173.24 173.43 2q42 s ILE 165 N -0.59 3.63 -0.52 1.44 1.01 0.14 -1.02 121.20 125.28 2q42 s ILE 165 Ca 0.36 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 2q42 s ILE 165 Cb -0.21 -2.61 0.14 0.00 0.01 0.00 0.00 42.46 39.78 2q42 s ILE 165 CO 0.23 0.46 0.32 -0.31 0.00 0.00 0.00 174.94 175.65 2q42 s TYR 166 N 0.84 3.48 0.76 3.97 2.02 -0.45 -1.14 117.35 126.83 2q42 s TYR 166 Ca -0.01 -2.60 -0.15 0.00 -0.37 0.00 0.00 57.07 53.94 2q42 s TYR 166 Cb -0.15 -3.19 0.05 0.00 -0.40 0.00 0.00 41.96 38.27 2q42 s TYR 166 CO 0.01 -0.90 1.17 0.00 -1.57 0.00 0.00 175.55 174.27 2q42 h GLY 168 N -0.45 0.12 0.00 0.00 0.00 -1.23 -3.42 103.07 98.08 2q42 h GLY 168 Ca -0.48 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.71 2q42 h GLY 168 CO 0.48 0.13 0.00 1.42 0.00 0.00 0.00 176.54 178.57 2q42 n HIS 169 N -3.83 0.00 -3.68 5.60 8.25 -1.26 0.24 115.22 120.54 2q42 n HIS 169 Ca -0.02 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.16 2q42 n HIS 169 Cb 0.62 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.61 2q42 n HIS 169 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2q42 s GLU 170 N 0.43 1.57 0.00 -0.41 2.56 0.14 -4.63 118.70 118.37 2q42 s GLU 170 Ca 0.00 -2.49 0.01 0.00 0.00 0.00 0.00 54.97 52.49 2q42 s GLU 170 Cb 0.00 -2.43 0.02 0.00 2.00 0.00 0.00 34.13 33.72 2q42 s GLU 170 CO 0.00 -1.27 0.97 0.66 -0.56 0.00 0.00 175.26 175.06 2q42 n TYR 171 N 2.80 0.03 -0.29 5.30 4.01 -1.26 -4.82 117.16 122.92 2q42 n TYR 171 Ca 0.19 -0.45 0.03 0.00 -0.16 0.00 0.00 57.90 57.51 2q42 n TYR 171 Cb 0.39 -0.04 0.24 0.00 -0.31 0.00 0.00 39.34 39.61 2q42 n TYR 171 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2q42 h THR 172 N 0.16 1.09 0.00 -0.72 2.02 -1.92 0.38 112.91 113.91 2q42 h THR 172 Ca 0.00 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 2q42 h THR 172 Cb 0.47 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2q42 h THR 172 CO 0.00 0.19 -0.00 0.25 0.37 0.00 0.00 175.52 176.33 2q42 h LEU 173 N 1.04 -0.01 -1.26 2.58 5.85 -1.90 0.55 115.31 122.16 2q42 h LEU 173 Ca 0.38 -0.49 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 2q42 h LEU 173 Cb 0.15 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2q42 h LEU 173 CO -0.13 0.49 0.09 0.77 -0.34 0.00 0.00 178.44 179.32 2q42 h SER 174 N -0.50 0.55 -0.43 1.25 4.64 -1.85 -2.18 113.55 115.03 2q42 h SER 174 Ca -0.00 -0.08 -0.06 0.00 -0.47 0.00 0.00 61.79 61.18 2q42 h SER 174 Cb 0.50 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 2q42 h SER 174 CO 0.00 0.56 0.03 0.78 -0.87 0.00 0.00 176.83 177.32 2q42 h ASN 175 N 0.58 0.72 0.15 4.97 2.35 -0.10 -2.85 115.58 121.40 2q42 h ASN 175 Ca 0.13 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 55.57 2q42 h ASN 175 Cb 0.23 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 2q42 h ASN 175 CO -0.00 0.83 -0.12 0.77 -1.65 0.00 0.00 177.43 177.26 2q42 h SER 176 N 0.59 0.00 0.34 5.81 4.64 -0.24 -1.74 113.55 122.95 2q42 h SER 176 Ca 0.13 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.32 2q42 h SER 176 Cb 0.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 2q42 h SER 176 CO 0.02 0.12 -0.51 0.11 -0.87 0.00 0.00 176.83 175.70 2q42 h LYS 177 N 0.00 0.19 0.07 4.77 1.57 -1.26 -1.72 116.57 120.19 2q42 h LYS 177 Ca -0.00 -0.11 -0.27 0.00 -1.87 0.00 0.00 60.65 58.40 2q42 h LYS 177 Cb 0.22 0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.57 2q42 h LYS 177 CO 0.02 0.65 -1.10 0.35 -0.57 0.00 0.00 179.45 178.80 2q42 h PHE 178 N 0.15 0.98 -0.68 -1.35 3.57 -1.34 -2.92 116.94 115.36 2q42 h PHE 178 Ca 0.00 -0.58 0.01 0.00 3.53 0.00 0.00 57.97 60.93 2q42 h PHE 178 Cb 0.95 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 2q42 h PHE 178 CO 0.01 1.42 0.44 0.00 -2.23 0.00 0.00 178.31 177.96 2q42 h ALA 179 N 0.32 0.86 0.00 2.41 0.00 -1.21 -2.10 119.26 119.54 2q42 h ALA 179 Ca -0.16 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2q42 h ALA 179 Cb 1.78 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2q42 h ALA 179 CO 0.21 0.29 -0.27 -0.07 0.00 0.00 0.00 179.25 179.42 2q42 h LEU 180 N 0.92 0.00 0.00 0.00 3.38 -1.38 0.72 115.31 118.95 2q42 h LEU 180 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2q42 h LEU 180 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2q42 h LEU 180 CO -0.05 0.27 0.00 -1.54 0.09 0.00 0.00 178.44 177.21 2q42 n SER 181 N -3.80 0.00 -0.03 -0.43 3.41 -0.80 -2.59 113.62 109.38 2q42 n SER 181 Ca -0.01 0.46 -0.03 0.00 -0.26 0.00 0.00 58.87 59.03 2q42 n SER 181 Cb 0.36 -0.48 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 2q42 n SER 181 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2q42 n LEU 182 N -1.48 0.03 -3.12 1.04 4.77 -0.40 -4.84 117.00 112.99 2q42 n LEU 182 Ca 0.05 -0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.86 2q42 n LEU 182 Cb 0.20 0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.42 2q42 n LEU 182 CO 0.16 0.16 -0.21 1.21 -1.33 0.00 0.00 177.39 177.38 2q42 n GLU 183 N -2.24 0.99 0.29 3.23 2.13 0.11 -3.62 120.64 121.54 2q42 n GLU 183 Ca -0.10 -3.35 0.20 0.00 0.66 0.00 0.00 57.16 54.56 2q42 n GLU 183 Cb 0.70 -1.65 0.97 0.00 0.27 0.00 0.00 31.44 31.74 2q42 n GLU 183 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 2q42 h PRO 184 N 3.00 0.00 -0.03 5.31 0.13 -1.72 -2.17 132.00 136.52 2q42 h PRO 184 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2q42 h PRO 184 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2q42 h PRO 184 CO 0.50 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.36 2q42 n ASN 185 N -2.95 1.12 -4.54 1.44 5.03 -1.26 -4.70 115.26 109.39 2q42 n ASN 185 Ca -0.02 -1.40 -0.43 0.00 0.87 0.00 0.00 54.58 53.60 2q42 n ASN 185 Cb 0.14 -0.01 -0.04 0.00 -1.02 0.00 0.00 39.78 38.85 2q42 n ASN 185 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2q42 s ASN 186 N -1.94 6.40 0.52 6.41 3.84 -0.82 -4.88 114.94 124.47 2q42 s ASN 186 Ca 0.39 -0.17 0.31 0.00 0.21 0.00 0.00 52.86 53.60 2q42 s ASN 186 Cb 0.21 -2.45 1.11 0.00 -0.55 0.00 0.00 41.25 39.57 2q42 s ASN 186 CO 0.33 -1.20 1.89 -0.33 -2.79 0.00 0.00 177.10 175.00 2q42 h GLU 187 N 9.27 0.00 -0.30 0.43 5.08 -1.89 -1.74 114.58 125.42 2q42 h GLU 187 Ca -0.25 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 57.95 2q42 h GLU 187 Cb 1.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 2q42 h GLU 187 CO 1.08 0.01 -0.44 0.28 -1.00 0.00 0.00 179.01 178.94 2q42 h VAL 188 N 0.00 1.28 -0.72 3.13 2.07 -1.91 0.19 116.25 120.30 2q42 h VAL 188 Ca -0.00 -1.62 -0.06 0.00 0.82 0.00 0.00 66.70 65.84 2q42 h VAL 188 Cb 0.63 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 2q42 h VAL 188 CO 0.00 0.53 0.23 0.25 0.02 0.00 0.00 177.57 178.60 2q42 h LEU 189 N 0.61 1.04 -0.87 2.57 5.85 -1.66 0.54 115.31 123.39 2q42 h LEU 189 Ca 0.03 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 2q42 h LEU 189 Cb 1.04 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 2q42 h LEU 189 CO 0.10 0.97 0.43 1.56 -0.34 0.00 0.00 178.44 181.16 2q42 h GLN 190 N 1.06 1.24 0.39 1.25 4.20 -1.19 0.28 115.11 122.34 2q42 h GLN 190 Ca 0.23 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 2q42 h GLN 190 Cb 0.30 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 2q42 h GLN 190 CO -0.01 0.94 -0.22 1.03 -0.67 0.00 0.00 178.83 179.91 2q42 h SER 191 N 1.23 -0.53 -0.44 1.46 0.87 -0.24 -1.86 113.55 114.05 2q42 h SER 191 Ca 0.30 0.03 -0.14 0.00 -1.23 0.00 0.00 61.79 60.74 2q42 h SER 191 Cb 0.10 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 2q42 h SER 191 CO -0.04 -0.35 -0.29 0.22 -0.53 0.00 0.00 176.83 175.84 2q42 h TYR 192 N -0.57 1.14 -0.94 2.24 3.20 -0.70 -2.89 116.97 118.45 2q42 h TYR 192 Ca -0.05 -0.30 0.06 0.00 3.14 0.00 0.00 58.73 61.58 2q42 h TYR 192 Cb 0.45 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 38.41 2q42 h TYR 192 CO -0.07 1.13 0.60 0.00 -1.64 0.00 0.00 178.16 178.18 2q42 h ALA 193 N 0.84 1.28 -0.58 1.82 0.00 -0.36 0.12 119.26 122.38 2q42 h ALA 193 Ca 0.09 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2q42 h ALA 193 Cb 0.87 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2q42 h ALA 193 CO 0.08 0.39 -0.03 0.00 0.00 0.00 0.00 179.25 179.70 2q42 h ALA 194 N 1.42 0.79 -0.61 0.00 0.00 -1.21 -1.70 119.26 117.95 2q42 h ALA 194 Ca 0.40 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2q42 h ALA 194 Cb 0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2q42 h ALA 194 CO -0.16 0.65 0.26 1.25 0.00 0.00 0.00 179.25 181.25 2q42 h HIS 195 N 0.94 0.87 -0.38 0.00 6.17 -1.16 -1.80 115.15 119.79 2q42 h HIS 195 Ca 0.16 -0.04 -0.03 0.00 0.71 0.00 0.00 60.37 61.17 2q42 h HIS 195 Cb 0.59 -0.27 -0.02 0.00 2.52 0.00 0.00 27.41 30.23 2q42 h HIS 195 CO 0.04 0.65 0.10 0.28 0.71 0.00 0.00 177.93 179.72 2q42 h VAL 196 N 0.86 1.22 -0.85 5.26 2.07 -0.62 -0.74 116.25 123.45 2q42 h VAL 196 Ca 0.21 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 2q42 h VAL 196 Cb 0.13 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2q42 h VAL 196 CO -0.02 0.26 0.49 0.00 0.02 0.00 0.00 177.57 178.32 2q42 h ALA 197 N 0.95 1.08 -0.66 1.67 0.00 -0.94 0.28 119.26 121.64 2q42 h ALA 197 Ca 0.12 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2q42 h ALA 197 Cb 0.29 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2q42 h ALA 197 CO -0.00 0.57 0.09 0.93 0.00 0.00 0.00 179.25 180.83 2q42 h GLU 198 N 1.17 1.09 -0.40 0.00 5.08 -1.08 0.12 114.58 120.57 2q42 h GLU 198 Ca 0.30 -0.30 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2q42 h GLU 198 Cb -0.01 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2q42 h GLU 198 CO -0.05 1.01 0.01 -0.07 -1.00 0.00 0.00 179.01 178.91 2q42 h LEU 199 N 1.02 0.68 -0.69 1.33 3.38 -0.50 -3.00 115.31 117.53 2q42 h LEU 199 Ca 0.20 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 2q42 h LEU 199 Cb 0.46 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2q42 h LEU 199 CO 0.02 0.81 -0.63 0.03 0.09 0.00 0.00 178.44 178.76 2q42 h ARG 200 N 0.53 0.00 -0.90 1.13 2.47 -0.81 -0.62 114.38 116.18 2q42 h ARG 200 Ca 0.12 0.00 0.10 0.00 -1.26 0.00 0.00 59.98 58.93 2q42 h ARG 200 Cb 0.45 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.71 2q42 h ARG 200 CO 0.02 0.63 0.58 0.66 0.56 0.00 0.00 179.97 182.42 2q42 h SER 201 N 0.00 0.81 -0.78 7.04 4.64 -0.61 0.12 113.55 124.76 2q42 h SER 201 Ca -0.01 0.02 -0.27 0.00 -0.47 0.00 0.00 61.79 61.07 2q42 h SER 201 Cb 1.15 -0.14 -0.16 0.00 -0.31 0.00 0.00 62.40 62.94 2q42 h SER 201 CO 0.08 0.47 0.34 2.29 -0.87 0.00 0.00 176.83 179.15 2q42 n LYS 202 N -4.53 3.41 -3.68 4.77 2.85 -1.11 -4.96 118.16 114.90 2q42 n LYS 202 Ca 0.15 -2.98 -0.28 0.00 -1.05 0.00 0.00 58.31 54.16 2q42 n LYS 202 Cb 0.31 -2.19 -0.00 0.00 -0.65 0.00 0.00 35.03 32.50 2q42 n LYS 202 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2q42 n LYS 203 N -0.31 -3.93 -3.98 -1.58 5.02 0.03 -4.98 118.16 108.44 2q42 n LYS 203 Ca 0.44 0.50 -0.29 0.00 -2.02 0.00 0.00 58.31 56.94 2q42 n LYS 203 Cb 1.42 -5.27 -0.04 0.00 -0.02 0.00 0.00 35.03 31.13 2q42 n LYS 203 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2q42 s LEU 204 N -6.87 4.17 0.75 -0.35 1.43 -0.26 -5.00 118.68 112.55 2q42 s LEU 204 Ca 0.54 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.63 2q42 s LEU 204 Cb -0.28 -2.78 0.05 0.00 0.03 0.00 0.00 46.19 43.21 2q42 s LEU 204 CO 0.67 0.12 1.18 -2.84 0.23 0.00 0.00 176.35 175.71 2q42 s PRO 205 N -2.80 2.03 0.00 1.29 0.02 -1.26 -4.10 135.00 130.18 2q42 s PRO 205 Ca 0.33 1.67 0.09 0.00 0.02 0.00 0.00 61.00 63.11 2q42 s PRO 205 Cb -0.12 -1.83 0.20 0.00 0.02 0.00 0.00 34.50 32.77 2q42 s PRO 205 CO 0.26 -1.90 1.09 0.25 -0.33 0.00 0.00 177.00 176.38 2q42 n THR 206 N -2.95 0.71 -4.38 0.99 -2.24 -1.26 -4.93 114.28 100.22 2q42 n THR 206 Ca 0.13 -0.86 -0.31 0.00 -2.27 0.00 0.00 64.05 60.74 2q42 n THR 206 Cb 0.51 0.70 -0.10 0.00 -2.10 0.00 0.00 70.33 69.34 2q42 n THR 206 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2q42 s ILE 207 N -0.93 3.59 0.61 2.28 1.09 -1.26 -4.31 121.20 122.26 2q42 s ILE 207 Ca 0.17 -0.93 -0.15 0.00 -1.10 0.00 0.00 60.65 58.64 2q42 s ILE 207 Cb 0.09 -2.60 -0.03 0.00 -1.06 0.00 0.00 42.46 38.86 2q42 s ILE 207 CO 0.13 0.30 1.06 -2.16 -0.10 0.00 0.00 174.94 174.16 2q42 s PRO 208 N -1.70 3.23 0.14 2.79 0.04 -1.26 -5.08 135.00 133.16 2q42 s PRO 208 Ca 0.19 1.18 0.01 0.00 0.04 0.00 0.00 61.00 62.42 2q42 s PRO 208 Cb -0.11 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.42 2q42 s PRO 208 CO 0.10 -0.88 0.12 -2.37 0.04 0.00 0.00 177.00 174.01 2q42 n THR 209 N -2.21 0.00 -4.38 1.26 5.66 -0.29 -4.86 114.28 109.45 2q42 n THR 209 Ca 0.09 -0.52 -0.19 0.00 -3.05 0.00 0.00 64.05 60.37 2q42 n THR 209 Cb 0.53 -0.47 -0.10 0.00 -1.55 0.00 0.00 70.33 68.74 2q42 n THR 209 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2q42 s THR 210 N -0.53 1.28 0.19 1.09 -4.23 -1.26 0.23 115.64 112.42 2q42 s THR 210 Ca 0.09 -2.06 -0.10 0.00 -1.18 0.00 0.00 61.69 58.44 2q42 s THR 210 Cb -0.01 -2.42 0.12 0.00 1.34 0.00 0.00 72.50 71.53 2q42 s THR 210 CO 0.06 -0.29 1.75 0.58 -0.54 0.00 0.00 174.62 176.18 2q42 h VAL 211 N 2.37 1.25 -0.42 2.29 2.07 -1.35 -0.21 116.25 122.24 2q42 h VAL 211 Ca -0.39 -0.80 -0.15 0.00 0.82 0.00 0.00 66.70 66.18 2q42 h VAL 211 Cb 1.23 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2q42 h VAL 211 CO 0.66 0.32 -0.33 0.50 0.02 0.00 0.00 177.57 178.74 2q42 h LYS 212 N 1.01 0.96 -0.47 1.57 3.64 -1.76 -0.63 116.57 120.90 2q42 h LYS 212 Ca 0.23 -0.48 -0.10 0.00 -1.27 0.00 0.00 60.65 59.03 2q42 h LYS 212 Cb 0.23 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2q42 h LYS 212 CO -0.02 1.14 -0.12 1.98 -2.27 0.00 0.00 179.45 180.16 2q42 h MET 213 N 0.79 0.87 -0.05 1.90 4.05 -1.75 -2.45 114.93 118.30 2q42 h MET 213 Ca 0.08 -0.31 -0.21 0.00 -0.28 0.00 0.00 59.70 58.97 2q42 h MET 213 Cb 0.92 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.66 2q42 h MET 213 CO 0.09 0.95 -0.85 0.93 0.23 0.00 0.00 176.91 178.25 2q42 h GLU 214 N 0.78 0.48 -0.57 0.39 4.39 -0.85 -1.58 114.58 117.62 2q42 h GLU 214 Ca 0.12 -0.45 0.03 0.00 0.34 0.00 0.00 59.36 59.41 2q42 h GLU 214 Cb 0.64 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 2q42 h GLU 214 CO 0.04 1.09 0.38 0.87 -1.16 0.00 0.00 179.01 180.24 2q42 h LYS 215 N 0.30 0.64 0.00 2.33 1.57 -1.04 0.36 116.57 120.72 2q42 h LYS 215 Ca -0.06 -0.04 -0.18 0.00 -1.87 0.00 0.00 60.65 58.50 2q42 h LYS 215 Cb 1.46 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.60 2q42 h LYS 215 CO 0.15 0.42 -0.85 0.00 -0.57 0.00 0.00 179.45 178.60 2q42 h ALA 216 N 1.67 0.49 0.00 3.86 0.00 -1.13 -3.41 119.26 120.73 2q42 h ALA 216 Ca 0.23 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2q42 h ALA 216 Cb 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2q42 h ALA 216 CO -0.06 1.06 -0.96 0.00 0.00 0.00 0.00 179.25 179.29 2q42 s ASN 218 N -2.28 6.62 0.57 0.00 3.84 0.12 -4.88 114.94 118.93 2q42 s ASN 218 Ca 0.00 1.10 0.27 0.00 0.21 0.00 0.00 52.86 54.44 2q42 s ASN 218 Cb 0.00 -2.54 1.60 0.00 -0.55 0.00 0.00 41.25 39.76 2q42 s ASN 218 CO 0.00 -1.15 2.11 1.55 -2.79 0.00 0.00 177.10 176.82 2q42 h PRO 219 N 9.51 0.00 0.00 0.43 0.13 -1.87 0.26 132.00 140.47 2q42 h PRO 219 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2q42 h PRO 219 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2q42 h PRO 219 CO 1.05 0.00 0.00 0.74 -0.23 0.00 0.00 178.00 179.56 2q42 h PHE 220 N 0.00 0.00 -0.36 1.56 0.04 -1.90 -1.71 116.94 114.57 2q42 h PHE 220 Ca 0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.86 2q42 h PHE 220 Cb 0.45 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.60 2q42 h PHE 220 CO 0.00 0.00 0.00 1.28 -0.60 0.00 0.00 178.31 178.99 2q42 n LEU 221 N -2.34 3.26 -0.98 1.54 4.77 0.91 -4.47 117.00 119.69 2q42 n LEU 221 Ca 0.02 -1.54 0.04 0.00 -0.03 0.00 0.00 56.01 54.50 2q42 n LEU 221 Cb 0.25 -0.23 0.07 0.00 -2.33 0.00 0.00 43.42 41.18 2q42 n LEU 221 CO 0.21 0.72 0.21 0.54 -1.33 0.00 0.00 177.39 177.74 2q42 n ARG 222 N 1.28 0.49 0.00 3.23 1.74 -0.66 -4.89 116.66 117.85 2q42 n ARG 222 Ca 0.17 -2.19 0.02 0.00 -0.77 0.00 0.00 57.85 55.08 2q42 n ARG 222 Cb 0.55 -0.61 0.10 0.00 -1.02 0.00 0.00 32.46 31.48 2q42 n ARG 222 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2q42 n SER 223 N -0.15 0.00 -0.35 0.55 3.41 -1.13 -0.93 113.62 115.03 2q42 n SER 223 Ca 0.09 0.38 0.12 0.00 -0.26 0.00 0.00 58.87 59.20 2q42 n SER 223 Cb 0.92 -0.41 0.24 0.00 -0.26 0.00 0.00 64.21 64.70 2q42 n SER 223 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2q42 n SER 224 N -1.41 1.41 -4.76 4.04 3.41 -1.26 -4.59 113.62 110.47 2q42 n SER 224 Ca 0.02 -1.14 -0.41 0.00 -0.26 0.00 0.00 58.87 57.07 2q42 n SER 224 Cb 0.05 0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 64.24 2q42 n SER 224 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2q42 s ASN 225 N -2.48 6.38 0.31 4.04 3.84 -0.10 -4.89 114.94 122.04 2q42 s ASN 225 Ca 0.22 2.96 0.01 0.00 0.21 0.00 0.00 52.86 56.26 2q42 s ASN 225 Cb 0.19 -2.64 0.55 0.00 -0.55 0.00 0.00 41.25 38.80 2q42 s ASN 225 CO 0.53 -0.89 1.92 0.74 -2.79 0.00 0.00 177.10 176.62 2q42 h THR 226 N 3.29 1.07 -0.08 -5.21 2.02 -1.91 -2.13 112.91 109.96 2q42 h THR 226 Ca -0.48 -0.34 -0.13 0.00 0.77 0.00 0.00 66.41 66.23 2q42 h THR 226 Cb 1.22 -0.01 0.01 0.00 -1.74 0.00 0.00 68.15 67.63 2q42 h THR 226 CO 0.75 0.18 -0.46 0.44 0.37 0.00 0.00 175.52 176.81 2q42 h ASP 227 N 1.00 0.54 -0.34 4.18 3.32 -1.90 -1.85 116.42 121.37 2q42 h ASP 227 Ca 0.37 -0.66 0.00 0.00 0.02 0.00 0.00 57.03 56.76 2q42 h ASP 227 Cb 0.18 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2q42 h ASP 227 CO -0.13 1.11 0.22 0.40 -1.72 0.00 0.00 179.24 179.12 2q42 h ILE 228 N -0.01 1.09 -0.63 0.35 2.04 -1.59 0.39 117.51 119.15 2q42 h ILE 228 Ca -0.04 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 2q42 h ILE 228 Cb 1.12 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 2q42 h ILE 228 CO 0.09 0.09 0.17 0.03 0.00 0.00 0.00 178.15 178.53 2q42 h ARG 229 N 0.45 0.97 -0.05 2.37 3.08 -1.41 -2.63 114.38 117.18 2q42 h ARG 229 Ca 0.12 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2q42 h ARG 229 Cb -0.05 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 2q42 h ARG 229 CO -0.03 0.85 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.62 2q42 h ARG 230 N 0.93 0.10 -0.95 0.04 2.43 -0.98 0.53 114.38 116.48 2q42 h ARG 230 Ca 0.20 -0.04 0.25 0.00 -0.81 0.00 0.00 59.98 59.58 2q42 h ARG 230 Cb 0.31 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.79 2q42 h ARG 230 CO -0.00 0.48 0.65 0.00 -1.51 0.00 0.00 179.97 179.58 2q42 h ALA 231 N 0.62 2.52 -0.28 2.80 0.00 -0.05 0.14 119.26 125.00 2q42 h ALA 231 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2q42 h ALA 231 Cb 0.45 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2q42 h ALA 231 CO 0.01 -0.83 0.00 1.28 0.00 0.00 0.00 179.25 179.71 2q42 n LEU 232 N -4.42 2.94 -3.67 0.00 4.77 -1.01 -4.98 117.00 110.64 2q42 n LEU 232 Ca 0.21 -1.50 -0.28 0.00 -0.03 0.00 0.00 56.01 54.41 2q42 n LEU 232 Cb 0.88 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.80 2q42 n LEU 232 CO 0.33 0.65 0.05 -1.14 -1.33 0.00 0.00 177.39 175.95 2q42 n ARG 233 N 1.03 -4.72 -2.65 3.23 0.63 0.62 -4.92 116.66 109.88 2q42 n ARG 233 Ca 0.14 0.59 -0.42 0.00 -0.92 0.00 0.00 57.85 57.24 2q42 n ARG 233 Cb 0.48 -5.42 -0.03 0.00 0.45 0.00 0.00 32.46 27.94 2q42 n ARG 233 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2q42 s ILE 234 N -3.18 4.69 0.44 5.15 1.01 0.15 -4.98 121.20 124.49 2q42 s ILE 234 Ca 0.56 1.94 -0.25 0.00 0.00 0.00 0.00 60.65 62.90 2q42 s ILE 234 Cb -0.28 -4.24 -0.09 0.00 0.01 0.00 0.00 42.46 37.86 2q42 s ILE 234 CO 0.68 0.10 1.32 -2.65 0.00 0.00 0.00 174.94 174.40 2q42 n PRO 235 N 4.28 1.99 0.26 2.79 -0.02 -1.26 -4.67 135.00 138.37 2q42 n PRO 235 Ca 0.07 0.71 0.09 0.00 -2.02 0.00 0.00 63.50 62.35 2q42 n PRO 235 Cb 0.49 -2.47 0.66 0.00 -0.02 0.00 0.00 33.50 32.17 2q42 n PRO 235 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2q42 h GLU 236 N 2.06 0.00 0.00 -0.52 5.08 -1.96 -1.72 114.58 117.52 2q42 h GLU 236 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2q42 h GLU 236 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2q42 h GLU 236 CO 0.60 0.04 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 2q42 n ALA 237 N -2.48 1.90 -1.77 3.43 0.00 -1.26 -4.83 120.51 115.49 2q42 n ALA 237 Ca -0.03 0.05 -0.39 0.00 0.00 0.00 0.00 53.44 53.07 2q42 n ALA 237 Cb 0.13 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.13 2q42 n ALA 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q42 s ALA 238 N -3.25 3.21 1.01 0.00 0.00 -0.65 -5.01 121.76 117.07 2q42 s ALA 238 Ca 0.06 1.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.94 2q42 s ALA 238 Cb 0.10 -3.41 0.19 0.00 0.00 0.00 0.00 23.12 20.00 2q42 s ALA 238 CO 0.48 -0.60 1.11 -0.40 0.00 0.00 0.00 175.76 176.35 2q42 n ASP 239 N 0.18 -0.02 0.03 0.00 5.68 -1.26 -4.80 116.55 116.35 2q42 n ASP 239 Ca 0.04 -1.39 -0.03 0.00 -0.50 0.00 0.00 54.79 52.91 2q42 n ASP 239 Cb 0.45 -0.86 0.21 0.00 -1.14 0.00 0.00 41.12 39.78 2q42 n ASP 239 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2q42 h GLU 240 N 0.00 0.44 -0.20 0.11 5.08 -1.95 -1.26 114.58 116.79 2q42 h GLU 240 Ca -0.36 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 57.78 2q42 h GLU 240 Cb 1.00 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2q42 h GLU 240 CO 0.25 0.68 -0.04 0.00 -1.00 0.00 0.00 179.01 178.90 2q42 h ALA 241 N 1.33 0.28 -0.75 3.43 0.00 -1.93 -0.15 119.26 121.47 2q42 h ALA 241 Ca 0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2q42 h ALA 241 Cb 0.68 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2q42 h ALA 241 CO 0.05 0.05 0.30 0.93 0.00 0.00 0.00 179.25 180.59 2q42 h GLU 242 N 0.12 1.12 -0.47 0.00 5.08 -1.89 -1.81 114.58 116.71 2q42 h GLU 242 Ca 0.05 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 2q42 h GLU 242 Cb 0.49 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2q42 h GLU 242 CO 0.02 0.91 0.21 0.00 -1.00 0.00 0.00 179.01 179.15 2q42 h ALA 243 N 1.15 0.61 -0.63 3.43 0.00 -1.14 -2.39 119.26 120.30 2q42 h ALA 243 Ca 0.25 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2q42 h ALA 243 Cb 0.21 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2q42 h ALA 243 CO -0.02 0.20 0.36 1.25 0.00 0.00 0.00 179.25 181.04 2q42 h LEU 244 N 0.62 0.56 -1.15 0.00 6.46 -0.77 -0.92 115.31 120.11 2q42 h LEU 244 Ca 0.16 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.95 2q42 h LEU 244 Cb 0.16 -0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 39.95 2q42 h LEU 244 CO -0.02 0.38 0.58 1.23 -0.62 0.00 0.00 178.44 179.99 2q42 h GLY 245 N 0.69 1.23 0.94 3.75 0.00 -1.02 0.11 103.07 108.78 2q42 h GLY 245 Ca 0.27 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 47.06 2q42 h GLY 245 CO -0.14 0.43 -0.13 -2.22 0.00 0.00 0.00 176.54 174.49 2q42 h ILE 246 N 1.16 1.28 -0.87 2.60 2.04 -0.89 -1.50 117.51 121.34 2q42 h ILE 246 Ca 0.32 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.96 2q42 h ILE 246 Cb -0.11 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 2q42 h ILE 246 CO -0.08 0.40 0.52 0.40 0.00 0.00 0.00 178.15 179.39 2q42 h ILE 247 N 0.47 1.24 -0.23 -0.67 2.04 -0.79 -0.17 117.51 119.40 2q42 h ILE 247 Ca 0.08 -0.54 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 2q42 h ILE 247 Cb 0.65 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2q42 h ILE 247 CO 0.04 0.26 0.02 -0.09 0.00 0.00 0.00 178.15 178.38 2q42 h ARG 248 N 1.20 0.40 -0.24 2.37 9.65 -0.58 0.07 114.38 127.24 2q42 h ARG 248 Ca 0.31 -0.12 -0.09 0.00 -1.10 0.00 0.00 59.98 58.99 2q42 h ARG 248 Cb -0.04 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.49 2q42 h ARG 248 CO -0.06 0.56 -0.22 0.87 2.80 0.00 0.00 179.97 183.93 2q42 h LYS 249 N 0.18 0.45 -0.07 0.20 1.57 -1.13 -1.25 116.57 116.52 2q42 h LYS 249 Ca 0.07 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 2q42 h LYS 249 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2q42 h LYS 249 CO 0.01 0.64 -0.29 0.00 -0.57 0.00 0.00 179.45 179.25 2q42 h ALA 250 N 1.37 1.39 0.03 3.86 0.00 -0.59 -2.43 119.26 122.89 2q42 h ALA 250 Ca 0.06 -0.30 -0.20 0.00 0.00 0.00 0.00 54.91 54.48 2q42 h ALA 250 Cb 0.61 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.35 2q42 h ALA 250 CO 0.04 0.43 -0.81 -0.22 0.00 0.00 0.00 179.25 178.70 2q42 h LYS 251 N 0.12 0.49 -0.94 0.00 3.64 -0.39 -2.82 116.57 116.67 2q42 h LYS 251 Ca 0.02 -0.57 0.07 0.00 -1.27 0.00 0.00 60.65 58.90 2q42 h LYS 251 Cb 0.57 0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 32.50 2q42 h LYS 251 CO 0.04 1.21 0.59 -0.44 -2.27 0.00 0.00 179.45 178.58 2q42 h ASP 252 N 0.02 0.93 -0.40 4.20 3.32 -1.13 -1.37 116.42 121.99 2q42 h ASP 252 Ca -0.11 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2q42 h ASP 252 Cb 1.51 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2q42 h ASP 252 CO 0.16 0.58 0.00 -0.67 -1.72 0.00 0.00 179.24 177.59 2q42 n ASP 253 N -4.57 3.72 -0.32 6.45 2.03 -0.93 -5.12 116.55 117.82 2q42 n ASP 253 Ca 0.15 -2.46 0.15 0.00 0.52 0.00 0.00 54.79 53.14 2q42 n ASP 253 Cb 0.20 -0.55 0.67 0.00 -0.72 0.00 0.00 41.12 40.72 2q42 n ASP 253 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61