#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 4.66 -0.28 2.12 -1.52 -0.98 -4.89 119.66 118.78 2q42 s GLN 2 Ca 0.00 1.30 -0.05 0.00 -1.95 0.00 0.00 55.36 54.66 2q42 s GLN 2 Cb 0.00 -3.32 0.02 0.00 -0.22 0.00 0.00 33.01 29.49 2q42 s GLN 2 CO 0.00 0.39 0.02 0.42 -0.25 0.00 0.00 175.29 175.87 2q42 s ILE 3 N -0.58 3.50 -0.18 1.08 1.01 -1.26 -1.28 121.20 123.48 2q42 s ILE 3 Ca 0.41 -0.86 -0.16 0.00 0.00 0.00 0.00 60.65 60.04 2q42 s ILE 3 Cb -0.23 -2.81 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 2q42 s ILE 3 CO 0.28 0.11 0.40 -0.70 0.00 0.00 0.00 174.94 175.03 2q42 s GLU 4 N 1.42 4.22 -0.09 2.79 2.12 0.13 -4.94 118.70 124.35 2q42 s GLU 4 Ca 0.01 0.23 -0.22 0.00 0.36 0.00 0.00 54.97 55.35 2q42 s GLU 4 Cb -0.17 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 2q42 s GLU 4 CO -0.00 0.05 0.66 -0.51 -0.54 0.00 0.00 175.26 174.91 2q42 s LEU 5 N 1.04 4.29 -0.20 2.70 1.02 -1.26 -1.14 118.68 125.13 2q42 s LEU 5 Ca 0.20 1.10 0.01 0.00 0.02 0.00 0.00 54.13 55.46 2q42 s LEU 5 Cb -0.14 -3.01 0.04 0.00 0.02 0.00 0.00 46.19 43.09 2q42 s LEU 5 CO 0.08 -0.12 -0.15 -0.69 0.02 0.00 0.00 176.35 175.49 2q42 s VAL 6 N 0.89 1.98 0.30 -1.59 1.01 -0.49 -4.96 120.40 117.54 2q42 s VAL 6 Ca 0.35 -1.12 -0.28 0.00 0.00 0.00 0.00 61.98 60.92 2q42 s VAL 6 Cb -0.17 -1.92 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 2q42 s VAL 6 CO 0.16 0.31 1.07 -2.84 0.00 0.00 0.00 175.10 173.80 2q42 s PRO 7 N 1.27 4.58 0.07 2.72 0.02 -1.26 -1.13 135.00 141.27 2q42 s PRO 7 Ca 0.00 1.70 0.01 0.00 0.02 0.00 0.00 61.00 62.74 2q42 s PRO 7 Cb -0.15 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 2q42 s PRO 7 CO -0.10 0.19 -0.06 0.00 -0.33 0.00 0.00 177.00 176.70 2q42 n LEU 9 N 0.46 0.00 0.02 0.00 4.77 -1.26 -0.57 117.00 120.41 2q42 n LEU 9 Ca -0.16 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.84 2q42 n LEU 9 Cb 0.59 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.58 2q42 n LEU 9 CO 0.27 0.00 -0.45 1.17 -1.33 0.00 0.00 177.39 177.05 2q42 n LYS 10 N 14.00 0.63 -0.55 3.23 4.81 -1.26 -4.72 118.16 134.31 2q42 n LYS 10 Ca 0.00 0.11 -0.02 0.00 -0.87 0.00 0.00 58.31 57.53 2q42 n LYS 10 Cb 0.00 -1.73 -0.02 0.00 0.02 0.00 0.00 35.03 33.31 2q42 n LYS 10 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2q42 n ASP 11 N -2.74 -0.27 -4.91 3.14 5.68 -1.12 -5.05 116.55 111.27 2q42 n ASP 11 Ca -0.11 -0.97 -0.28 0.00 -0.50 0.00 0.00 54.79 52.93 2q42 n ASP 11 Cb 0.80 0.08 -0.03 0.00 -1.14 0.00 0.00 41.12 40.84 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 -0.27 6.42 -0.09 -1.12 -0.87 0.26 -1.84 114.94 117.43 2q42 s ASN 12 Ca 0.00 0.68 0.05 0.00 -1.57 0.00 0.00 52.86 52.02 2q42 s ASN 12 Cb 0.00 -2.13 -0.00 0.00 -0.02 0.00 0.00 41.25 39.10 2q42 s ASN 12 CO 0.00 -0.21 -0.24 -0.31 -2.57 0.00 0.00 177.10 173.77 2q42 s TYR 13 N -2.12 2.52 0.33 2.20 2.02 -0.23 -0.70 117.35 121.37 2q42 s TYR 13 Ca 0.43 -0.93 0.06 0.00 -0.37 0.00 0.00 57.07 56.27 2q42 s TYR 13 Cb -0.11 -1.67 -0.01 0.00 -0.40 0.00 0.00 41.96 39.77 2q42 s TYR 13 CO 0.31 -0.34 0.46 0.00 -1.57 0.00 0.00 175.55 174.40 2q42 s ALA 14 N 0.16 4.21 -0.16 3.71 0.00 -0.28 -4.77 121.76 124.63 2q42 s ALA 14 Ca -0.13 -1.45 -0.02 0.00 0.00 0.00 0.00 51.96 50.36 2q42 s ALA 14 Cb -0.16 -1.67 0.05 0.00 0.00 0.00 0.00 23.12 21.33 2q42 s ALA 14 CO 0.07 -0.01 0.02 0.71 0.00 0.00 0.00 175.76 176.55 2q42 s TYR 15 N -2.16 0.99 -0.17 0.00 2.02 -0.47 -1.39 117.35 116.16 2q42 s TYR 15 Ca 0.44 -0.71 -0.23 0.00 -0.37 0.00 0.00 57.07 56.21 2q42 s TYR 15 Cb -0.09 -0.99 -0.02 0.00 -0.40 0.00 0.00 41.96 40.45 2q42 s TYR 15 CO 0.31 -0.54 0.70 0.42 -1.57 0.00 0.00 175.55 174.87 2q42 s ILE 16 N 1.87 4.98 -0.24 2.71 1.01 -0.29 -0.27 121.20 130.96 2q42 s ILE 16 Ca 0.01 1.36 -0.12 0.00 0.00 0.00 0.00 60.65 61.90 2q42 s ILE 16 Cb -0.16 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.25 2q42 s ILE 16 CO -0.07 0.10 0.21 -0.76 0.00 0.00 0.00 174.94 174.42 2q42 s LEU 17 N 1.87 4.11 -0.18 2.97 1.43 0.21 0.21 118.68 129.29 2q42 s LEU 17 Ca 0.33 0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 53.57 2q42 s LEU 17 Cb -0.16 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.85 2q42 s LEU 17 CO 0.12 0.01 -0.06 -1.00 0.23 0.00 0.00 176.35 175.65 2q42 s HIS 18 N 1.24 2.94 -0.71 0.29 3.76 -0.41 -1.45 115.29 120.96 2q42 s HIS 18 Ca 0.10 -0.67 -0.18 0.00 -0.15 0.00 0.00 55.06 54.16 2q42 s HIS 18 Cb -0.14 -2.00 0.14 0.00 1.11 0.00 0.00 32.58 31.68 2q42 s HIS 18 CO 0.06 -0.31 0.79 0.34 -0.85 0.00 0.00 174.74 174.77 2q42 s ASP 19 N 0.88 6.39 0.63 1.40 2.15 -0.43 -2.31 116.67 125.38 2q42 s ASP 19 Ca -0.01 -1.84 0.32 0.00 0.43 0.00 0.00 52.55 51.45 2q42 s ASP 19 Cb -0.15 -2.30 1.78 0.00 -0.30 0.00 0.00 42.92 41.96 2q42 s ASP 19 CO 0.01 -0.98 2.07 -0.33 -0.17 0.00 0.00 175.17 175.77 2q42 h GLU 20 N 8.80 0.00 -0.02 4.34 5.08 -1.97 0.68 114.58 131.50 2q42 h GLU 20 Ca -0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2q42 h GLU 20 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2q42 h GLU 20 CO 1.03 0.00 0.00 -3.47 -1.00 0.00 0.00 179.01 175.57 2q42 n ASP 21 N -3.34 1.28 0.00 1.42 2.03 -1.26 -4.46 116.55 112.23 2q42 n ASP 21 Ca 0.00 -1.44 0.00 0.00 0.52 0.00 0.00 54.79 53.87 2q42 n ASP 21 Cb 0.33 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 2q42 n ASP 21 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2q42 n THR 22 N 0.01 0.00 -0.73 5.18 -2.24 0.68 -5.00 114.28 112.19 2q42 n THR 22 Ca 0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 2q42 n THR 22 Cb 0.32 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 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 0.00 0.84 3.74 3.38 0.00 0.21 -5.01 105.19 108.35 2q42 n GLY 23 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2q42 n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q42 s THR 24 N -3.30 3.17 -0.06 2.61 2.01 -1.25 -4.84 115.64 113.98 2q42 s THR 24 Ca 0.00 1.00 0.04 0.00 0.31 0.00 0.00 61.69 63.04 2q42 s THR 24 Cb 0.00 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.87 2q42 s THR 24 CO 0.00 0.17 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.23 2q42 s VAL 25 N -0.16 1.53 0.22 3.82 1.01 -1.26 -1.31 120.40 124.25 2q42 s VAL 25 Ca 0.55 -0.75 0.10 0.00 0.00 0.00 0.00 61.98 61.88 2q42 s VAL 25 Cb -0.36 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 2q42 s VAL 25 CO 0.40 0.44 -0.18 -0.83 0.00 0.00 0.00 175.10 174.93 2q42 s GLY 26 N 0.24 1.62 -0.05 4.51 0.00 -0.53 -1.16 107.32 111.96 2q42 s GLY 26 Ca -0.09 -1.70 0.03 0.00 0.00 0.00 0.00 44.72 42.96 2q42 s GLY 26 CO 0.04 -1.78 -0.13 0.54 0.00 0.00 0.00 173.10 171.77 2q42 s VAL 27 N -2.46 1.16 -0.22 1.40 0.11 0.13 0.66 120.40 121.18 2q42 s VAL 27 Ca 0.23 -0.54 -0.12 0.00 -2.93 0.00 0.00 61.98 58.62 2q42 s VAL 27 Cb -0.04 -1.02 -0.05 0.00 -1.53 0.00 0.00 36.38 33.74 2q42 s VAL 27 CO 0.10 0.35 0.24 -0.69 -3.33 0.00 0.00 175.10 171.77 2q42 s VAL 28 N 0.29 5.30 -1.10 2.04 1.01 0.62 -1.12 120.40 127.45 2q42 s VAL 28 Ca -0.07 0.37 -0.14 0.00 0.00 0.00 0.00 61.98 62.14 2q42 s VAL 28 Cb -0.12 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2q42 s VAL 28 CO 0.02 0.32 0.85 0.47 0.00 0.00 0.00 175.10 176.76 2q42 n ASP 29 N 4.31 -5.80 -4.56 3.32 8.00 0.13 -1.37 116.55 120.57 2q42 n ASP 29 Ca -0.13 -0.87 -0.33 0.00 0.71 0.00 0.00 54.79 54.17 2q42 n ASP 29 Cb 0.52 -4.24 -0.04 0.00 -0.02 0.00 0.00 41.12 37.34 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 -5.26 2.83 0.36 -0.24 0.04 -1.23 -4.25 135.00 127.26 2q42 s PRO 30 Ca 0.45 -0.25 0.10 0.00 0.04 0.00 0.00 61.00 61.34 2q42 s PRO 30 Cb -0.11 -4.89 0.85 0.00 0.04 0.00 0.00 34.50 30.39 2q42 s PRO 30 CO 0.80 -2.89 1.87 0.77 0.04 0.00 0.00 177.00 177.59 2q42 h SER 31 N 11.70 0.62 -5.00 6.66 0.02 -1.78 0.13 113.55 125.90 2q42 h SER 31 Ca 0.00 0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 2q42 h SER 31 Cb 1.05 -0.08 -0.19 0.00 0.14 0.00 0.00 62.40 63.31 2q42 h SER 31 CO 1.26 0.31 -0.24 -1.83 -1.14 0.00 0.00 176.83 175.19 2q42 s GLU 32 N -5.64 0.72 0.07 3.45 -1.05 -1.26 -2.98 118.70 112.01 2q42 s GLU 32 Ca -0.10 -0.21 -0.16 0.00 -0.15 0.00 0.00 54.97 54.35 2q42 s GLU 32 Cb 0.22 0.32 -0.15 0.00 -0.44 0.00 0.00 34.13 34.08 2q42 s GLU 32 CO 0.79 -0.21 1.30 0.00 0.95 0.00 0.00 175.26 178.09 2q42 h ALA 33 N 3.69 0.28 -0.54 -0.84 0.00 -1.84 -3.38 119.26 116.63 2q42 h ALA 33 Ca -0.30 -0.48 0.09 0.00 0.00 0.00 0.00 54.91 54.22 2q42 h ALA 33 Cb 1.18 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.83 2q42 h ALA 33 CO 0.41 0.43 -0.36 1.49 0.00 0.00 0.00 179.25 181.21 2q42 h GLU 34 N 0.27 -0.20 -0.74 0.00 4.57 -1.98 -1.43 114.58 115.07 2q42 h GLU 34 Ca -0.01 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.26 2q42 h GLU 34 Cb 1.08 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.67 2q42 h GLU 34 CO 0.10 -0.13 0.49 -1.35 -1.18 0.00 0.00 179.01 176.93 2q42 h PRO 35 N -0.21 0.71 -0.07 0.92 0.11 -1.94 0.29 132.00 131.82 2q42 h PRO 35 Ca 0.20 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 2q42 h PRO 35 Cb 0.56 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.50 2q42 h PRO 35 CO -0.65 0.47 -0.03 0.82 -0.21 0.00 0.00 178.00 178.40 2q42 h ILE 36 N 0.73 1.32 -0.44 4.15 1.08 -1.48 -2.04 117.51 120.83 2q42 h ILE 36 Ca 0.33 -1.04 0.06 0.00 -0.39 0.00 0.00 64.86 63.82 2q42 h ILE 36 Cb 0.33 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 35.90 2q42 h ILE 36 CO -0.11 0.29 0.14 0.40 -0.69 0.00 0.00 178.15 178.18 2q42 h ILE 37 N -0.23 0.84 -0.78 -0.67 2.04 -0.76 0.22 117.51 118.17 2q42 h ILE 37 Ca 0.02 -0.10 0.10 0.00 1.00 0.00 0.00 64.86 65.87 2q42 h ILE 37 Cb 0.47 0.51 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 2q42 h ILE 37 CO 0.01 0.06 0.42 0.44 0.00 0.00 0.00 178.15 179.08 2q42 h ASP 38 N 0.30 0.59 -0.19 1.72 3.32 -0.30 -0.23 116.42 121.63 2q42 h ASP 38 Ca 0.21 0.06 -0.18 0.00 0.02 0.00 0.00 57.03 57.14 2q42 h ASP 38 Cb 0.22 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 2q42 h ASP 38 CO -0.23 0.33 -0.56 -1.28 -1.72 0.00 0.00 179.24 175.79 2q42 h SER 39 N 0.71 0.87 -0.47 6.45 0.87 -0.59 -3.21 113.55 118.18 2q42 h SER 39 Ca 0.38 -0.47 -0.06 0.00 -1.23 0.00 0.00 61.79 60.42 2q42 h SER 39 Cb 0.38 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 2q42 h SER 39 CO -0.26 1.25 0.10 -0.07 -0.53 0.00 0.00 176.83 177.32 2q42 h LEU 40 N 0.60 0.77 -1.96 2.23 3.38 0.35 -1.76 115.31 118.92 2q42 h LEU 40 Ca 0.01 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2q42 h LEU 40 Cb 1.15 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2q42 h LEU 40 CO 0.12 0.78 -0.05 0.11 0.09 0.00 0.00 178.44 179.48 2q42 h LYS 41 N 0.79 0.00 0.52 1.13 1.79 -1.09 0.45 116.57 120.16 2q42 h LYS 41 Ca 0.17 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.61 2q42 h LYS 41 Cb 0.33 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.98 2q42 h LYS 41 CO 0.00 0.05 -0.25 -0.09 -1.08 0.00 0.00 179.45 178.09 2q42 h ARG 42 N 0.00 -0.67 0.00 3.15 2.43 -1.33 -2.98 114.38 114.99 2q42 h ARG 42 Ca -0.00 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2q42 h ARG 42 Cb 0.10 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2q42 h ARG 42 CO 0.01 -0.44 0.00 -1.13 -1.51 0.00 0.00 179.97 176.89 2q42 n SER 43 N -4.73 0.00 -2.06 -3.80 3.41 -1.13 -4.84 113.62 100.48 2q42 n SER 43 Ca -0.09 0.26 -0.18 0.00 -0.26 0.00 0.00 58.87 58.61 2q42 n SER 43 Cb 0.27 -0.37 -0.01 0.00 -0.26 0.00 0.00 64.21 63.84 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 -0.24 -0.37 3.54 5.00 0.00 0.12 -5.00 105.19 108.24 2q42 n GLY 44 Ca 0.05 -0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 2q42 n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q42 s ARG 45 N -4.90 1.93 0.28 1.61 0.52 -1.04 -5.03 118.95 112.31 2q42 s ARG 45 Ca 0.00 -1.54 0.00 0.00 -0.52 0.00 0.00 55.73 53.67 2q42 s ARG 45 Cb 0.00 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.46 2q42 s ARG 45 CO 0.00 0.37 0.47 1.21 0.02 0.00 0.00 175.30 177.36 2q42 s ASN 46 N -3.34 6.34 -0.14 0.23 3.84 -1.26 -4.63 114.94 115.97 2q42 s ASN 46 Ca 0.28 0.39 -0.23 0.00 0.21 0.00 0.00 52.86 53.52 2q42 s ASN 46 Cb -0.06 -2.01 -0.03 0.00 -0.55 0.00 0.00 41.25 38.60 2q42 s ASN 46 CO 0.16 -0.17 0.71 -0.22 -2.79 0.00 0.00 177.10 174.79 2q42 s LEU 47 N -3.86 4.21 -0.20 3.21 2.96 -1.26 -4.43 118.68 119.30 2q42 s LEU 47 Ca 0.39 1.05 -0.05 0.00 -0.22 0.00 0.00 54.13 55.29 2q42 s LEU 47 Cb -0.10 -3.05 -0.20 0.00 0.50 0.00 0.00 46.19 43.34 2q42 s LEU 47 CO 0.32 -0.25 0.02 0.41 -1.32 0.00 0.00 176.35 175.53 2q42 n THR 48 N 4.38 1.61 -4.34 3.68 -1.04 -0.31 -4.39 114.28 113.87 2q42 n THR 48 Ca 0.00 -0.53 -0.19 0.00 -2.04 0.00 0.00 64.05 61.29 2q42 n THR 48 Cb 0.50 -1.65 -0.13 0.00 -1.82 0.00 0.00 70.33 67.22 2q42 n THR 48 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2q42 s TYR 49 N -2.52 1.12 -0.06 -1.42 2.02 -0.95 -2.09 117.35 113.46 2q42 s TYR 49 Ca -0.30 -0.33 0.05 0.00 -0.37 0.00 0.00 57.07 56.12 2q42 s TYR 49 Cb 0.08 -0.67 -0.01 0.00 -0.40 0.00 0.00 41.96 40.97 2q42 s TYR 49 CO 0.65 0.02 -0.22 0.42 -1.57 0.00 0.00 175.55 174.85 2q42 s ILE 50 N -0.79 1.79 -0.06 2.71 1.01 -0.03 -0.69 121.20 125.13 2q42 s ILE 50 Ca 0.01 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.76 2q42 s ILE 50 Cb -0.07 -1.52 0.02 0.00 0.01 0.00 0.00 42.46 40.89 2q42 s ILE 50 CO 0.01 0.50 -0.06 -0.76 0.00 0.00 0.00 174.94 174.63 2q42 s LEU 51 N -0.03 1.29 -0.04 2.97 1.02 -0.28 -0.38 118.68 123.24 2q42 s LEU 51 Ca -0.05 -0.17 0.02 0.00 0.02 0.00 0.00 54.13 53.95 2q42 s LEU 51 Cb -0.13 -0.56 -0.03 0.00 0.02 0.00 0.00 46.19 45.48 2q42 s LEU 51 CO 0.03 -0.06 -0.08 0.20 0.02 0.00 0.00 176.35 176.46 2q42 s ASN 52 N 1.07 4.51 0.23 2.29 -0.87 -1.01 -0.70 114.94 120.46 2q42 s ASN 52 Ca -0.08 -0.10 0.21 0.00 -1.57 0.00 0.00 52.86 51.32 2q42 s ASN 52 Cb -0.14 -1.07 0.04 0.00 -0.02 0.00 0.00 41.25 40.06 2q42 s ASN 52 CO -0.01 0.33 1.13 0.71 -2.57 0.00 0.00 177.10 176.70 2q42 h THR 53 N 4.11 0.14 -2.06 1.60 1.35 -1.88 -3.42 112.91 112.76 2q42 h THR 53 Ca -0.48 -1.26 0.27 0.00 -0.55 0.00 0.00 66.41 64.39 2q42 h THR 53 Cb 1.17 1.74 -0.08 0.00 -1.73 0.00 0.00 68.15 69.25 2q42 h THR 53 CO 0.52 0.08 0.73 -1.38 -0.25 0.00 0.00 175.52 175.23 2q42 s HIS 54 N -3.23 -0.00 -0.97 4.73 -3.43 -1.26 -0.88 115.29 110.24 2q42 s HIS 54 Ca 0.01 -0.21 0.26 0.00 -0.80 0.00 0.00 55.06 54.32 2q42 s HIS 54 Cb 0.08 0.61 0.71 0.00 -1.43 0.00 0.00 32.58 32.55 2q42 s HIS 54 CO 0.77 -0.53 1.56 -2.39 -2.00 0.00 0.00 174.74 172.16 2q42 n HIS 55 N -0.66 0.06 -1.77 0.38 -0.00 -1.26 -4.68 115.22 107.29 2q42 n HIS 55 Ca -0.03 0.02 -0.41 0.00 -0.00 0.00 0.00 57.72 57.29 2q42 n HIS 55 Cb 0.60 -0.36 -0.00 0.00 -0.00 0.00 0.00 29.99 30.23 2q42 n HIS 55 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2q42 n HIS 56 N -1.56 2.91 -0.32 -1.40 8.25 -1.26 -4.73 115.22 117.12 2q42 n HIS 56 Ca 0.06 0.44 0.22 0.00 -0.26 0.00 0.00 57.72 58.17 2q42 n HIS 56 Cb 0.35 -2.53 0.49 0.00 1.12 0.00 0.00 29.99 29.42 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 3.08 0.70 0.00 4.41 3.20 -1.96 0.24 116.97 126.63 2q42 h TYR 57 Ca -0.50 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.39 2q42 h TYR 57 Cb 1.24 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.31 2q42 h TYR 57 CO 0.53 0.08 0.00 -0.40 -1.64 0.00 0.00 178.16 176.73 2q42 n ASP 58 N -4.64 0.00 0.00 -2.11 5.75 -1.26 -0.62 116.55 113.66 2q42 n ASP 58 Ca 0.25 -0.64 0.00 0.00 -0.01 0.00 0.00 54.79 54.39 2q42 n ASP 58 Cb 0.84 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.93 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 -0.91 0.00 -0.17 2.11 8.25 0.82 -4.09 115.22 121.23 2q42 n HIS 59 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2q42 n HIS 59 Cb 0.05 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.16 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 -0.58 0.00 0.20 1.59 -2.24 -1.05 -3.55 114.28 108.65 2q42 n THR 60 Ca 0.00 -0.26 0.18 0.00 -2.27 0.00 0.00 64.05 61.71 2q42 n THR 60 Cb 0.01 1.17 0.82 0.00 -2.10 0.00 0.00 70.33 70.23 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 0.00 0.82 3.38 0.00 -0.92 -0.60 103.07 105.75 2q42 h GLY 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2q42 h GLY 61 CO 0.00 0.00 -0.75 0.61 0.00 0.00 0.00 176.54 176.40 2q42 n GLY 62 N -1.38 -1.25 0.34 4.60 0.00 0.45 -4.53 105.19 103.42 2q42 n GLY 62 Ca 0.03 -0.36 0.16 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 0.66 0.12 1.61 4.21 -1.26 -2.51 115.58 118.40 2q42 h ASN 63 Ca 0.00 0.13 -0.01 0.00 1.21 0.00 0.00 56.30 57.64 2q42 h ASN 63 Cb 0.63 0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.87 2q42 h ASN 63 CO 0.00 0.12 -0.06 -0.07 -1.29 0.00 0.00 177.43 176.13 2q42 h LEU 64 N 0.59 -0.13 -1.82 1.61 3.38 -1.79 0.19 115.31 117.33 2q42 h LEU 64 Ca 0.63 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 2q42 h LEU 64 Cb 1.16 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2q42 h LEU 64 CO -0.47 0.42 -0.01 -0.08 0.09 0.00 0.00 178.44 178.39 2q42 h GLU 65 N -0.76 0.10 0.13 1.13 4.81 -1.84 0.43 114.58 118.57 2q42 h GLU 65 Ca -0.02 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.00 2q42 h GLU 65 Cb 0.55 -0.02 0.02 0.00 0.63 0.00 0.00 28.75 29.93 2q42 h GLU 65 CO 0.03 0.12 -0.89 -0.07 -0.73 0.00 0.00 179.01 177.47 2q42 h LEU 66 N 0.10 0.56 -1.34 1.64 3.38 -1.44 0.17 115.31 118.38 2q42 h LEU 66 Ca 0.02 -0.90 -0.06 0.00 0.09 0.00 0.00 57.88 57.03 2q42 h LEU 66 Cb 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2q42 h LEU 66 CO 0.00 1.42 -0.18 0.50 0.09 0.00 0.00 178.44 180.26 2q42 h LYS 67 N -0.21 0.22 0.03 1.13 3.64 -0.19 -2.02 116.57 119.17 2q42 h LYS 67 Ca -0.15 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2q42 h LYS 67 Cb 1.67 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.46 2q42 h LYS 67 CO 0.17 0.40 -0.01 0.22 -2.27 0.00 0.00 179.45 177.96 2q42 h ASP 68 N 0.20 -0.03 -0.68 4.20 -0.00 -0.16 -1.28 116.42 118.67 2q42 h ASP 68 Ca 0.04 -0.04 0.09 0.00 -0.00 0.00 0.00 57.03 57.13 2q42 h ASP 68 Cb 0.45 0.01 -0.07 0.00 -0.00 0.00 0.00 39.33 39.72 2q42 h ASP 68 CO 0.03 0.48 0.32 -0.09 -0.00 0.00 0.00 179.24 179.98 2q42 h ARG 69 N -1.01 0.53 -0.01 0.28 2.43 -0.71 -2.41 114.38 113.48 2q42 h ARG 69 Ca -0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2q42 h ARG 69 Cb 0.07 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2q42 h ARG 69 CO 0.01 0.35 -0.65 0.66 -1.51 0.00 0.00 179.97 178.83 2q42 n TYR 70 N -4.90 0.00 -1.51 2.20 4.01 -0.76 -4.93 117.16 111.26 2q42 n TYR 70 Ca 0.10 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.67 2q42 n TYR 70 Cb 0.28 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.23 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 1.42 1.69 3.73 2.72 0.00 -0.50 -4.89 105.19 109.35 2q42 n GLY 71 Ca 0.07 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.64 2.32 0.21 4.61 0.00 -1.07 -4.95 121.76 120.24 2q42 s ALA 72 Ca 0.00 1.16 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 2q42 s ALA 72 Cb 0.00 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2q42 s ALA 72 CO 0.00 -1.66 0.41 0.15 0.00 0.00 0.00 175.76 174.67 2q42 s LYS 73 N -3.47 3.54 -0.13 0.00 -0.14 -0.89 -4.44 119.74 114.22 2q42 s LYS 73 Ca 0.81 -0.29 -0.06 0.00 -1.36 0.00 0.00 55.97 55.08 2q42 s LYS 73 Cb -0.36 -2.81 -0.04 0.00 -1.68 0.00 0.00 37.83 32.94 2q42 s LYS 73 CO 0.41 0.38 0.08 0.08 -0.76 0.00 0.00 175.35 175.53 2q42 s VAL 74 N -1.89 4.96 -0.17 3.17 1.01 -1.26 -0.85 120.40 125.37 2q42 s VAL 74 Ca 0.39 0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.38 2q42 s VAL 74 Cb -0.11 -3.16 0.04 0.00 0.00 0.00 0.00 36.38 33.15 2q42 s VAL 74 CO 0.29 0.57 -0.06 -0.63 0.00 0.00 0.00 175.10 175.27 2q42 s ILE 75 N -0.61 1.21 0.00 2.22 -1.09 0.49 -1.44 121.20 121.98 2q42 s ILE 75 Ca 0.11 -0.71 0.00 0.00 -2.23 0.00 0.00 60.65 57.82 2q42 s ILE 75 Cb -0.12 -1.37 0.00 0.00 -1.58 0.00 0.00 42.46 39.39 2q42 s ILE 75 CO 0.02 0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.47 2q42 n GLY 76 N 4.84 4.28 3.71 6.18 0.00 -0.78 -2.40 105.19 121.03 2q42 n GLY 76 Ca -0.12 -1.30 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 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 0.69 7.28 0.24 1.61 0.15 -1.26 0.56 113.70 122.97 2q42 s SER 77 Ca 0.00 1.55 -0.04 0.00 0.70 0.00 0.00 55.95 58.16 2q42 s SER 77 Cb 0.00 -2.53 0.26 0.00 -1.71 0.00 0.00 66.02 62.04 2q42 s SER 77 CO 0.00 -0.21 1.77 0.00 1.20 0.00 0.00 173.24 176.00 2q42 h ALA 78 N 6.69 1.08 0.00 5.45 0.00 0.31 0.42 119.26 133.20 2q42 h ALA 78 Ca -0.41 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2q42 h ALA 78 Cb 1.21 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2q42 h ALA 78 CO 0.75 0.61 0.00 -1.33 0.00 0.00 0.00 179.25 179.27 2q42 n MET 79 N -4.25 0.65 0.00 0.00 2.81 -1.26 -2.33 117.12 112.75 2q42 n MET 79 Ca 0.04 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 2q42 n MET 79 Cb 0.25 -1.18 0.00 0.00 -0.71 0.00 0.00 33.22 31.58 2q42 n MET 79 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2q42 n ASP 80 N -0.12 0.00 -0.33 7.83 2.03 -0.50 -4.54 116.55 120.92 2q42 n ASP 80 Ca 0.00 -1.00 0.21 0.00 0.52 0.00 0.00 54.79 54.52 2q42 n ASP 80 Cb 0.09 0.00 0.40 0.00 -0.72 0.00 0.00 41.12 40.90 2q42 n ASP 80 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2q42 h LYS 81 N 0.00 0.04 -0.45 -0.67 3.64 -0.56 0.45 116.57 119.02 2q42 h LYS 81 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2q42 h LYS 81 Cb 0.77 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2q42 h LYS 81 CO 0.00 0.03 0.00 -0.25 -2.27 0.00 0.00 179.45 176.96 2q42 n ASP 82 N -5.36 0.45 0.00 4.20 8.00 -1.26 -2.65 116.55 119.94 2q42 n ASP 82 Ca 0.29 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.30 2q42 n ASP 82 Cb 0.95 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.82 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 -0.12 -0.14 -3.58 -1.24 1.74 0.16 -5.01 116.66 108.47 2q42 n ARG 83 Ca 0.00 -0.35 -0.41 0.00 -0.77 0.00 0.00 57.85 56.32 2q42 n ARG 83 Cb 0.11 -0.73 -0.10 0.00 -1.02 0.00 0.00 32.46 30.72 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 -0.08 4.52 0.18 0.55 -1.09 -1.08 -4.75 121.20 119.45 2q42 s ILE 84 Ca 0.00 -1.05 -0.33 0.00 -2.23 0.00 0.00 60.65 57.04 2q42 s ILE 84 Cb 0.00 -3.61 -0.13 0.00 -1.58 0.00 0.00 42.46 37.14 2q42 s ILE 84 CO 0.00 -0.35 1.66 -2.65 -1.23 0.00 0.00 174.94 172.37 2q42 n PRO 85 N 4.99 2.49 -1.03 2.79 -0.02 -1.26 -2.47 135.00 140.48 2q42 n PRO 85 Ca -0.11 0.90 -0.01 0.00 -2.02 0.00 0.00 63.50 62.25 2q42 n PRO 85 Cb 0.45 -2.71 -0.00 0.00 -0.02 0.00 0.00 33.50 31.21 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 3.73 0.44 3.67 -1.23 0.00 -1.26 -4.78 105.19 105.75 2q42 n GLY 86 Ca 0.17 -0.13 -0.46 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.71 0.14 0.11 -0.61 3.06 -1.03 -4.21 119.36 114.11 2q42 n ILE 87 Ca -0.01 -0.04 0.08 0.00 -2.50 0.00 0.00 62.75 60.28 2q42 n ILE 87 Cb 0.16 -1.54 -0.12 0.00 0.54 0.00 0.00 39.64 38.68 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 3.23 1.33 -3.66 9.51 8.00 -0.52 -4.90 116.55 129.54 2q42 n ASP 88 Ca 0.16 -0.14 -0.08 0.00 0.71 0.00 0.00 54.79 55.45 2q42 n ASP 88 Cb 0.29 1.60 -0.08 0.00 -0.02 0.00 0.00 41.12 42.91 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 -2.97 0.59 -0.21 -1.24 1.75 -0.73 -4.96 119.30 111.53 2q42 s MET 89 Ca -0.04 1.11 -0.04 0.00 -1.25 0.00 0.00 55.69 55.47 2q42 s MET 89 Cb 0.10 0.16 -0.02 0.00 2.84 0.00 0.00 34.83 37.92 2q42 s MET 89 CO 0.64 -0.16 -0.03 0.00 -0.65 0.00 0.00 175.02 174.82 2q42 s ALA 90 N 1.72 2.90 -0.04 4.11 0.00 -1.26 -1.86 121.76 127.33 2q42 s ALA 90 Ca -0.09 -1.07 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 2q42 s ALA 90 Cb -0.07 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.31 2q42 s ALA 90 CO -0.17 -0.26 0.05 -0.51 0.00 0.00 0.00 175.76 174.86 2q42 s LEU 91 N 1.19 3.78 0.46 0.00 1.43 0.19 -4.40 118.68 121.33 2q42 s LEU 91 Ca 0.03 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.30 2q42 s LEU 91 Cb -0.14 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.03 2q42 s LEU 91 CO -0.00 0.32 0.66 -0.54 0.23 0.00 0.00 176.35 177.02 2q42 s LYS 92 N -1.35 2.93 0.33 1.70 3.01 -1.26 0.90 119.74 126.01 2q42 s LYS 92 Ca 0.18 -0.67 -0.29 0.00 -1.01 0.00 0.00 55.97 54.18 2q42 s LYS 92 Cb -0.12 -2.59 -0.11 0.00 -1.01 0.00 0.00 37.83 34.00 2q42 s LYS 92 CO 0.08 -0.33 1.53 -3.47 0.51 0.00 0.00 175.35 173.68 2q42 n ASP 93 N -2.07 3.76 0.00 2.83 2.03 -1.26 -2.22 116.55 119.63 2q42 n ASP 93 Ca 0.03 1.19 0.00 0.00 0.52 0.00 0.00 54.79 56.53 2q42 n ASP 93 Cb 0.58 -1.60 0.00 0.00 -0.72 0.00 0.00 41.12 39.39 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 1.35 0.77 3.76 0.27 0.00 0.25 -4.98 105.19 106.61 2q42 n GLY 94 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.77 5.17 -0.07 1.61 1.01 -0.94 -4.74 116.67 115.93 2q42 s ASP 95 Ca 0.00 2.29 -0.01 0.00 0.71 0.00 0.00 52.55 55.54 2q42 s ASP 95 Cb 0.00 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 2q42 s ASP 95 CO 0.00 -1.60 0.00 -0.54 0.21 0.00 0.00 175.17 173.24 2q42 s LYS 96 N -3.48 2.96 -0.02 8.23 1.02 -1.26 -1.83 119.74 125.36 2q42 s LYS 96 Ca 0.75 -0.43 0.01 0.00 0.02 0.00 0.00 55.97 56.31 2q42 s LYS 96 Cb -0.28 -2.78 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 2q42 s LYS 96 CO 0.34 0.69 -0.02 -0.46 -0.92 0.00 0.00 175.35 174.99 2q42 s TRP 97 N -0.92 0.38 -0.24 3.18 -0.00 -0.94 -4.96 118.94 115.44 2q42 s TRP 97 Ca 0.14 -0.05 -0.14 0.00 -0.00 0.00 0.00 56.10 56.06 2q42 s TRP 97 Cb -0.11 -0.40 -0.04 0.00 -0.00 0.00 0.00 33.47 32.92 2q42 s TRP 97 CO 0.04 -0.11 0.32 -1.64 -0.00 0.00 0.00 176.95 175.56 2q42 s MET 98 N 0.72 4.07 -0.63 5.86 -1.94 -1.26 -0.91 119.30 125.21 2q42 s MET 98 Ca -0.08 -0.01 -0.17 0.00 -1.71 0.00 0.00 55.69 53.72 2q42 s MET 98 Cb -0.11 -3.59 0.13 0.00 2.01 0.00 0.00 34.83 33.27 2q42 s MET 98 CO -0.01 -0.12 0.68 0.12 -0.01 0.00 0.00 175.02 175.68 2q42 s PHE 99 N 1.58 3.18 -1.41 -0.03 5.36 0.09 -4.38 117.98 122.37 2q42 s PHE 99 Ca 0.14 -1.22 -0.02 0.00 -0.96 0.00 0.00 56.93 54.86 2q42 s PHE 99 Cb -0.15 -3.94 0.02 0.00 -0.34 0.00 0.00 43.02 38.61 2q42 s PHE 99 CO 0.08 -1.19 0.55 0.00 -1.46 0.00 0.00 175.22 173.21 2q42 n ALA 100 N 5.71 -1.90 -1.00 11.12 0.00 -1.26 -1.63 120.51 131.55 2q42 n ALA 100 Ca -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2q42 n ALA 100 Cb 0.43 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.92 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 -1.82 0.55 3.18 0.00 0.00 -1.26 -5.00 105.19 100.84 2q42 n GLY 101 Ca -0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 2q42 n GLY 101 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2q42 s HIS 102 N -2.22 2.18 0.36 1.61 3.76 -0.64 -5.09 115.29 115.25 2q42 s HIS 102 Ca 0.00 -0.79 -0.27 0.00 -0.15 0.00 0.00 55.06 53.85 2q42 s HIS 102 Cb 0.00 -1.47 -0.09 0.00 1.11 0.00 0.00 32.58 32.13 2q42 s HIS 102 CO 0.00 -0.31 1.15 -2.00 -0.85 0.00 0.00 174.74 172.74 2q42 s GLU 103 N 0.25 4.25 -0.16 1.40 2.12 -1.26 -0.73 118.70 124.57 2q42 s GLU 103 Ca -0.13 1.84 0.01 0.00 0.36 0.00 0.00 54.97 57.05 2q42 s GLU 103 Cb -0.16 -2.83 0.01 0.00 0.26 0.00 0.00 34.13 31.41 2q42 s GLU 103 CO 0.06 -0.15 -0.19 0.08 -0.54 0.00 0.00 175.26 174.51 2q42 s VAL 104 N -1.35 2.24 -0.45 3.70 1.01 -0.08 -4.02 120.40 121.45 2q42 s VAL 104 Ca 0.53 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 61.41 2q42 s VAL 104 Cb -0.31 -1.93 0.03 0.00 0.00 0.00 0.00 36.38 34.18 2q42 s VAL 104 CO 0.40 0.53 0.59 -2.28 0.00 0.00 0.00 175.10 174.34 2q42 s HIS 105 N 0.99 3.08 -0.23 5.22 2.46 0.80 -2.23 115.29 125.38 2q42 s HIS 105 Ca -0.02 -0.25 -0.22 0.00 0.47 0.00 0.00 55.06 55.04 2q42 s HIS 105 Cb -0.15 -3.29 -0.02 0.00 -0.13 0.00 0.00 32.58 28.99 2q42 s HIS 105 CO -0.05 -0.88 0.68 0.08 -2.47 0.00 0.00 174.74 172.10 2q42 s VAL 106 N 2.62 4.96 -0.09 0.89 1.01 -0.76 -1.67 120.40 127.36 2q42 s VAL 106 Ca 0.18 1.26 0.02 0.00 0.00 0.00 0.00 61.98 63.44 2q42 s VAL 106 Cb -0.16 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 2q42 s VAL 106 CO 0.16 0.03 -0.15 -0.04 0.00 0.00 0.00 175.10 175.10 2q42 s MET 107 N 2.37 2.95 0.24 2.72 -1.94 -0.62 -0.58 119.30 124.44 2q42 s MET 107 Ca 0.29 -0.72 -0.30 0.00 -1.71 0.00 0.00 55.69 53.25 2q42 s MET 107 Cb -0.16 -2.47 -0.09 0.00 2.01 0.00 0.00 34.83 34.13 2q42 s MET 107 CO 0.09 0.38 1.03 -0.51 -0.01 0.00 0.00 175.02 176.01 2q42 s ASP 108 N -0.11 7.43 -0.37 3.03 1.01 -1.26 -1.28 116.67 125.11 2q42 s ASP 108 Ca -0.02 2.10 0.13 0.00 0.71 0.00 0.00 52.55 55.47 2q42 s ASP 108 Cb -0.14 -2.62 0.37 0.00 1.01 0.00 0.00 42.92 41.54 2q42 s ASP 108 CO 0.04 -0.03 0.77 0.35 0.21 0.00 0.00 175.17 176.51 2q42 n THR 109 N 1.54 0.13 -1.44 -1.27 -2.24 0.21 -4.85 114.28 106.36 2q42 n THR 109 Ca -0.01 -4.38 -0.36 0.00 -2.27 0.00 0.00 64.05 57.03 2q42 n THR 109 Cb 0.46 -0.16 0.08 0.00 -2.10 0.00 0.00 70.33 68.61 2q42 n THR 109 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2q42 n PRO 110 N 0.20 0.63 0.00 -0.78 -0.04 -1.24 -4.61 135.00 129.16 2q42 n PRO 110 Ca 0.23 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 2q42 n PRO 110 Cb 0.68 -2.20 0.00 0.00 -0.04 0.00 0.00 33.50 31.94 2q42 n PRO 110 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2q42 n GLY 111 N 1.18 -0.52 0.22 0.55 0.00 -1.26 -3.43 105.19 101.92 2q42 n GLY 111 Ca 0.13 0.26 -0.08 0.00 0.00 0.00 0.00 46.02 46.34 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 0.69 -4.51 1.61 -0.00 -1.82 0.24 115.15 111.36 2q42 h HIS 112 Ca 0.00 -0.03 -0.21 0.00 -0.00 0.00 0.00 60.37 60.13 2q42 h HIS 112 Cb 0.00 -0.22 -0.15 0.00 -0.00 0.00 0.00 27.41 27.04 2q42 h HIS 112 CO 0.00 0.53 -0.63 0.95 -0.00 0.00 0.00 177.93 178.78 2q42 s THR 113 N -5.77 0.05 -0.29 6.26 -4.23 -1.26 -2.00 115.64 108.40 2q42 s THR 113 Ca -0.13 -1.96 -0.14 0.00 -1.18 0.00 0.00 61.69 58.28 2q42 s THR 113 Cb 0.11 -2.28 -0.03 0.00 1.34 0.00 0.00 72.50 71.64 2q42 s THR 113 CO 0.76 -0.22 0.33 -0.54 -0.54 0.00 0.00 174.62 174.40 2q42 s LYS 114 N -4.11 3.87 0.00 3.99 1.02 -1.26 -3.70 119.74 119.55 2q42 s LYS 114 Ca 0.32 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.14 2q42 s LYS 114 Cb 0.07 -3.70 0.00 0.00 -0.52 0.00 0.00 37.83 33.68 2q42 s LYS 114 CO 0.07 -0.33 0.00 0.41 -0.92 0.00 0.00 175.35 174.58 2q42 n GLY 115 N 4.84 1.77 3.71 -3.33 0.00 -1.26 -4.89 105.19 106.04 2q42 n GLY 115 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 2q42 n GLY 115 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2q42 n HIS 116 N 0.00 2.56 -4.45 1.61 -0.00 -1.24 -4.72 115.22 108.98 2q42 n HIS 116 Ca 0.00 0.31 -0.23 0.00 -0.00 0.00 0.00 57.72 57.81 2q42 n HIS 116 Cb 0.00 -2.55 -0.10 0.00 -0.00 0.00 0.00 29.99 27.34 2q42 n HIS 116 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.34 177.30 2q42 s ILE 117 N 0.06 2.09 0.21 3.57 -4.36 -0.06 0.66 121.20 123.37 2q42 s ILE 117 Ca 0.67 -2.27 0.10 0.00 -0.26 0.00 0.00 60.65 58.89 2q42 s ILE 117 Cb -0.56 -2.34 -0.04 0.00 1.25 0.00 0.00 42.46 40.76 2q42 s ILE 117 CO 0.48 -0.38 -0.20 -0.44 0.24 0.00 0.00 174.94 174.63 2q42 s SER 118 N -3.47 3.13 -0.15 4.36 0.01 -0.40 -4.65 113.70 112.53 2q42 s SER 118 Ca 0.29 -0.92 -0.01 0.00 1.31 0.00 0.00 55.95 56.62 2q42 s SER 118 Cb -0.01 -0.22 0.04 0.00 0.21 0.00 0.00 66.02 66.04 2q42 s SER 118 CO 0.13 0.02 -0.05 -0.76 0.41 0.00 0.00 173.24 172.99 2q42 s LEU 119 N -2.94 1.43 -0.26 2.44 1.43 -0.09 -1.58 118.68 119.11 2q42 s LEU 119 Ca 0.22 -0.57 -0.07 0.00 -1.03 0.00 0.00 54.13 52.68 2q42 s LEU 119 Cb -0.06 -0.84 -0.02 0.00 0.03 0.00 0.00 46.19 45.30 2q42 s LEU 119 CO 0.10 -0.18 0.07 -0.47 0.23 0.00 0.00 176.35 176.09 2q42 s TYR 120 N 1.69 3.09 -0.66 0.29 5.04 -0.67 -0.09 117.35 126.03 2q42 s TYR 120 Ca 0.02 -0.55 -0.18 0.00 -2.44 0.00 0.00 57.07 53.92 2q42 s TYR 120 Cb -0.15 -2.24 0.13 0.00 0.35 0.00 0.00 41.96 40.06 2q42 s TYR 120 CO -0.08 -0.41 0.73 -0.06 -1.34 0.00 0.00 175.55 174.39 2q42 s PHE 121 N 1.59 3.18 0.23 4.97 0.08 0.31 -0.14 117.98 128.20 2q42 s PHE 121 Ca 0.06 -1.24 -0.06 0.00 0.12 0.00 0.00 56.93 55.81 2q42 s PHE 121 Cb -0.15 -3.98 0.33 0.00 -0.57 0.00 0.00 43.02 38.65 2q42 s PHE 121 CO 0.03 -1.22 1.83 -1.00 -0.10 0.00 0.00 175.22 174.76 2q42 h PRO 122 N 8.86 0.81 0.00 0.24 0.13 -1.81 -0.19 132.00 140.05 2q42 h PRO 122 Ca -0.18 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2q42 h PRO 122 Cb 1.07 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2q42 h PRO 122 CO 1.03 0.54 0.00 0.41 -0.23 0.00 0.00 178.00 179.75 2q42 n GLY 123 N -1.31 -0.68 0.00 1.56 0.00 -1.26 -1.35 105.19 102.14 2q42 n GLY 123 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.46 1.28 -4.12 1.61 7.64 -0.19 -4.90 113.62 113.48 2q42 n SER 124 Ca 0.02 -1.35 -0.28 0.00 1.01 0.00 0.00 58.87 58.26 2q42 n SER 124 Cb 0.07 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.22 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 -0.18 -2.36 -4.16 1.43 1.74 -0.46 -4.85 116.66 107.83 2q42 n ARG 125 Ca 0.00 0.28 -0.16 0.00 -0.77 0.00 0.00 57.85 57.20 2q42 n ARG 125 Cb 0.11 -4.22 -0.15 0.00 -1.02 0.00 0.00 32.46 27.19 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 -4.06 0.45 -0.04 7.54 0.00 -1.06 0.06 121.76 124.66 2q42 s ALA 126 Ca 0.07 -0.20 0.01 0.00 0.00 0.00 0.00 51.96 51.84 2q42 s ALA 126 Cb -0.04 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 22.96 2q42 s ALA 126 CO 0.94 0.10 -0.06 -1.50 0.00 0.00 0.00 175.76 175.23 2q42 s ILE 127 N -0.02 0.66 -0.32 0.00 2.07 -0.06 0.11 121.20 123.64 2q42 s ILE 127 Ca 0.01 -0.21 -0.18 0.00 -1.41 0.00 0.00 60.65 58.86 2q42 s ILE 127 Cb -0.03 -0.65 -0.01 0.00 0.13 0.00 0.00 42.46 41.90 2q42 s ILE 127 CO -0.00 0.24 0.51 -0.36 -1.91 0.00 0.00 174.94 173.42 2q42 s PHE 128 N 0.75 3.21 -1.40 3.50 0.08 0.87 -0.54 117.98 124.45 2q42 s PHE 128 Ca -0.11 0.33 0.15 0.00 0.12 0.00 0.00 56.93 57.42 2q42 s PHE 128 Cb -0.14 -2.85 0.40 0.00 -0.57 0.00 0.00 43.02 39.86 2q42 s PHE 128 CO 0.01 -0.45 1.32 0.25 -0.10 0.00 0.00 175.22 176.25 2q42 n THR 129 N 5.34 0.89 -2.08 0.64 -2.24 0.07 -0.92 114.28 115.97 2q42 n THR 129 Ca -0.05 -0.94 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 2q42 n THR 129 Cb 0.49 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 0.94 2.62 1.58 3.38 0.00 -1.26 -0.99 105.19 111.47 2q42 n GLY 130 Ca 0.16 -0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 1.03 4.91 0.27 1.61 8.00 -1.26 0.28 116.55 131.39 2q42 n ASP 131 Ca 0.00 -2.60 -0.11 0.00 0.71 0.00 0.00 54.79 52.79 2q42 n ASP 131 Cb 0.00 -0.59 -0.05 0.00 -0.02 0.00 0.00 41.12 40.46 2q42 n ASP 131 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2q42 h THR 132 N 3.82 0.00 -3.45 -3.53 2.02 -1.39 0.38 112.91 110.76 2q42 h THR 132 Ca 0.00 -0.12 -0.66 0.00 0.77 0.00 0.00 66.41 66.41 2q42 h THR 132 Cb 1.57 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 67.83 2q42 h THR 132 CO 0.29 0.00 -0.72 -0.32 0.37 0.00 0.00 175.52 175.14 2q42 s MET 133 N -4.25 2.18 0.42 6.66 -2.45 -1.24 -3.17 119.30 117.46 2q42 s MET 133 Ca -0.10 -1.03 0.03 0.00 -1.25 0.00 0.00 55.69 53.33 2q42 s MET 133 Cb 0.01 -2.32 -0.01 0.00 1.25 0.00 0.00 34.83 33.76 2q42 s MET 133 CO 0.31 0.50 0.09 1.19 1.05 0.00 0.00 175.02 178.17 2q42 n PHE 134 N 0.58 0.47 -2.50 4.11 3.72 0.39 -4.55 117.46 119.67 2q42 n PHE 134 Ca -0.13 -2.48 -0.43 0.00 -0.05 0.00 0.00 57.45 54.37 2q42 n PHE 134 Cb 0.53 -0.11 -0.02 0.00 -0.94 0.00 0.00 39.48 38.93 2q42 n PHE 134 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2q42 s SER 135 N -3.50 6.54 -0.57 4.37 0.01 -1.26 -3.21 113.70 116.08 2q42 s SER 135 Ca 0.13 0.65 0.00 0.00 1.31 0.00 0.00 55.95 58.04 2q42 s SER 135 Cb 0.01 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2q42 s SER 135 CO 0.09 -1.30 0.00 0.18 0.41 0.00 0.00 173.24 172.62 2q42 n LEU 136 N 8.16 -0.19 0.00 2.44 4.77 -1.26 -4.16 117.00 126.75 2q42 n LEU 136 Ca 0.14 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 2q42 n LEU 136 Cb 0.48 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 2q42 n LEU 136 CO 0.71 -0.48 0.00 -1.20 -1.33 0.00 0.00 177.39 175.09 2q42 n SER 137 N 0.06 0.00 -3.52 -1.43 7.64 -1.20 -4.50 113.62 110.67 2q42 n SER 137 Ca -0.05 -0.44 -0.16 0.00 1.01 0.00 0.00 58.87 59.22 2q42 n SER 137 Cb 0.28 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.42 2q42 n SER 137 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2q42 n GLY 139 N 0.79 -0.29 3.65 0.00 0.00 0.13 -4.91 105.19 104.57 2q42 n GLY 139 Ca -0.17 -0.44 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 2q42 n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q42 s LYS 140 N -3.76 0.58 -1.10 1.61 1.02 -1.26 -4.79 119.74 112.04 2q42 s LYS 140 Ca 0.73 0.92 -0.05 0.00 0.02 0.00 0.00 55.97 57.58 2q42 s LYS 140 Cb -0.31 -1.72 0.29 0.00 -0.52 0.00 0.00 37.83 35.57 2q42 s LYS 140 CO 0.51 -2.73 1.49 1.28 -0.92 0.00 0.00 175.35 174.99 2q42 n LEU 141 N -4.23 6.39 -0.15 3.17 4.77 -1.26 -4.07 117.00 121.61 2q42 n LEU 141 Ca 0.07 -5.15 -0.01 0.00 -0.03 0.00 0.00 56.01 50.89 2q42 n LEU 141 Cb 0.55 -1.31 0.23 0.00 -2.33 0.00 0.00 43.42 40.56 2q42 n LEU 141 CO 0.55 1.64 1.10 -0.26 -1.33 0.00 0.00 177.39 179.09 2q42 h PHE 142 N 5.56 0.86 0.00 -1.77 0.04 -1.65 -3.38 116.94 116.59 2q42 h PHE 142 Ca 0.22 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.96 2q42 h PHE 142 Cb 0.63 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.51 2q42 h PHE 142 CO 1.02 0.64 -0.77 0.39 -0.60 0.00 0.00 178.31 178.99 2q42 n GLU 143 N -4.35 2.49 -3.17 1.51 1.02 -0.84 -5.00 120.64 112.29 2q42 n GLU 143 Ca 0.06 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.99 2q42 n GLU 143 Cb 0.13 -0.89 0.06 0.00 -0.02 0.00 0.00 31.44 30.72 2q42 n GLU 143 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2q42 s GLY 144 N -2.19 1.81 0.32 0.62 0.00 0.85 -4.74 107.32 104.00 2q42 s GLY 144 Ca 0.00 -2.04 0.05 0.00 0.00 0.00 0.00 44.72 42.73 2q42 s GLY 144 CO 0.00 -1.75 0.47 -0.51 0.00 0.00 0.00 173.10 171.31 2q42 s THR 145 N -2.71 4.41 0.41 0.90 -4.23 -1.26 -4.85 115.64 108.30 2q42 s THR 145 Ca 0.58 -0.92 0.07 0.00 -1.18 0.00 0.00 61.69 60.24 2q42 s THR 145 Cb -0.05 -3.55 0.25 0.00 1.34 0.00 0.00 72.50 70.49 2q42 s THR 145 CO 0.37 -0.23 2.04 -0.65 -0.54 0.00 0.00 174.62 175.60 2q42 h PRO 146 N 0.91 0.49 -0.55 3.99 0.11 -1.95 0.56 132.00 135.56 2q42 h PRO 146 Ca -0.48 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.50 2q42 h PRO 146 Cb 1.25 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2q42 h PRO 146 CO 0.56 0.36 -0.02 -0.22 -0.21 0.00 0.00 178.00 178.47 2q42 h LYS 147 N 0.50 0.98 -0.25 1.05 3.64 -1.94 -0.46 116.57 120.08 2q42 h LYS 147 Ca 0.13 -0.32 -0.04 0.00 -1.27 0.00 0.00 60.65 59.15 2q42 h LYS 147 Cb 0.01 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2q42 h LYS 147 CO -0.02 0.99 0.01 1.96 -2.27 0.00 0.00 179.45 180.12 2q42 h GLN 148 N 0.85 0.44 -0.51 1.90 4.20 -1.64 -1.58 115.11 118.79 2q42 h GLN 148 Ca 0.15 -0.14 0.01 0.00 0.06 0.00 0.00 58.65 58.74 2q42 h GLN 148 Cb 0.56 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 2q42 h GLN 148 CO 0.03 0.60 0.33 1.98 -0.67 0.00 0.00 178.83 181.10 2q42 h MET 149 N 0.23 0.64 -0.90 1.46 4.05 -0.83 0.60 114.93 120.19 2q42 h MET 149 Ca 0.07 -0.04 0.03 0.00 -0.28 0.00 0.00 59.70 59.48 2q42 h MET 149 Cb 0.40 -0.15 -0.05 0.00 -0.80 0.00 0.00 31.60 31.00 2q42 h MET 149 CO 0.01 0.43 0.59 1.25 0.23 0.00 0.00 176.91 179.41 2q42 h LEU 150 N 0.66 0.99 -0.38 3.39 5.85 -0.90 0.31 115.31 125.23 2q42 h LEU 150 Ca 0.19 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 2q42 h LEU 150 Cb -0.05 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 2q42 h LEU 150 CO -0.06 0.69 0.13 0.00 -0.34 0.00 0.00 178.44 178.87 2q42 h ALA 151 N 1.36 0.49 -0.66 1.25 0.00 -0.69 0.24 119.26 121.25 2q42 h ALA 151 Ca 0.35 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 2q42 h ALA 151 Cb -0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2q42 h ALA 151 CO -0.10 0.12 0.25 0.77 0.00 0.00 0.00 179.25 180.29 2q42 h SER 152 N 0.46 0.90 -0.38 0.00 0.02 -0.30 -1.95 113.55 112.29 2q42 h SER 152 Ca 0.12 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 2q42 h SER 152 Cb 0.23 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2q42 h SER 152 CO -0.01 0.81 0.03 -0.07 -1.14 0.00 0.00 176.83 176.45 2q42 h LEU 153 N 0.96 0.64 -1.63 5.07 3.38 -0.59 -2.80 115.31 120.33 2q42 h LEU 153 Ca 0.22 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2q42 h LEU 153 Cb 0.20 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2q42 h LEU 153 CO -0.02 0.77 0.22 1.56 0.09 0.00 0.00 178.44 181.06 2q42 h GLN 154 N 0.49 0.47 -0.53 1.13 4.20 -0.53 -0.88 115.11 119.45 2q42 h GLN 154 Ca 0.11 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 2q42 h GLN 154 Cb 0.42 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 2q42 h GLN 154 CO 0.01 0.32 0.32 0.87 -0.67 0.00 0.00 178.83 179.68 2q42 h LYS 155 N 0.48 0.72 0.47 1.46 1.57 -1.11 -1.60 116.57 118.56 2q42 h LYS 155 Ca 0.13 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2q42 h LYS 155 Cb -0.04 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.13 2q42 h LYS 155 CO -0.03 0.52 -0.23 0.82 -0.57 0.00 0.00 179.45 179.97 2q42 h ILE 156 N 0.71 0.52 0.00 1.86 2.04 -1.19 -2.59 117.51 118.86 2q42 h ILE 156 Ca 0.19 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.84 2q42 h ILE 156 Cb -0.01 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2q42 h ILE 156 CO -0.04 0.04 0.00 0.35 0.00 0.00 0.00 178.15 178.50 2q42 n THR 157 N -5.31 1.71 1.43 -0.27 -2.24 -0.42 -1.06 114.28 108.11 2q42 n THR 157 Ca -0.11 0.43 0.15 0.00 -2.27 0.00 0.00 64.05 62.24 2q42 n THR 157 Cb 0.29 -1.36 0.76 0.00 -2.10 0.00 0.00 70.33 67.92 2q42 n THR 157 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2q42 n SER 158 N -1.50 0.01 -4.90 3.42 2.88 -0.61 -4.80 113.62 108.11 2q42 n SER 158 Ca 0.01 -0.15 -0.28 0.00 -1.33 0.00 0.00 58.87 57.12 2q42 n SER 158 Cb 0.05 -0.28 0.03 0.00 -0.75 0.00 0.00 64.21 63.26 2q42 n SER 158 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2q42 s LEU 159 N -2.57 3.19 0.55 2.46 1.43 -0.22 -5.03 118.68 118.50 2q42 s LEU 159 Ca 0.29 0.90 -0.21 0.00 -1.03 0.00 0.00 54.13 54.08 2q42 s LEU 159 Cb 0.20 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.62 2q42 s LEU 159 CO 0.46 -1.07 1.29 -2.65 0.23 0.00 0.00 176.35 174.61 2q42 n PRO 160 N -2.67 1.54 0.30 1.29 -0.02 -1.26 -4.84 135.00 129.33 2q42 n PRO 160 Ca 0.05 0.57 0.19 0.00 -2.02 0.00 0.00 63.50 62.28 2q42 n PRO 160 Cb 0.57 -2.49 1.02 0.00 -0.02 0.00 0.00 33.50 32.58 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 1.26 0.00 -0.33 2.55 3.32 -1.95 -1.46 116.42 119.81 2q42 h ASP 161 Ca -0.50 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.52 2q42 h ASP 161 Cb 1.32 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 2q42 h ASP 161 CO 0.56 0.00 0.04 -0.90 -1.72 0.00 0.00 179.24 177.22 2q42 n ASP 162 N -3.47 3.54 -4.72 6.45 5.75 -1.26 -2.70 116.55 120.13 2q42 n ASP 162 Ca -0.02 -2.54 -0.40 0.00 -0.01 0.00 0.00 54.79 51.82 2q42 n ASP 162 Cb 0.13 -0.61 -0.05 0.00 -1.03 0.00 0.00 41.12 39.57 2q42 n ASP 162 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2q42 s THR 163 N -1.93 4.99 0.12 2.12 2.01 -0.55 -4.91 115.64 117.49 2q42 s THR 163 Ca 0.29 1.52 -0.28 0.00 0.31 0.00 0.00 61.69 63.54 2q42 s THR 163 Cb 0.23 -4.07 -0.07 0.00 0.01 0.00 0.00 72.50 68.60 2q42 s THR 163 CO 0.08 0.26 0.86 -0.44 -0.69 0.00 0.00 174.62 174.70 2q42 s SER 164 N 0.68 7.42 -0.24 3.53 0.01 0.11 -2.35 113.70 122.86 2q42 s SER 164 Ca 0.39 1.69 -0.04 0.00 1.31 0.00 0.00 55.95 59.30 2q42 s SER 164 Cb -0.18 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2q42 s SER 164 CO 0.20 0.05 -0.02 -0.63 0.41 0.00 0.00 173.24 173.24 2q42 s ILE 165 N -0.44 3.37 -0.34 1.44 1.01 0.15 -0.88 121.20 125.51 2q42 s ILE 165 Ca 0.41 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 60.39 2q42 s ILE 165 Cb -0.23 -2.61 0.07 0.00 0.01 0.00 0.00 42.46 39.70 2q42 s ILE 165 CO 0.27 0.31 0.08 -0.31 0.00 0.00 0.00 174.94 175.29 2q42 s TYR 166 N 1.45 3.41 0.36 3.97 2.02 0.30 -1.37 117.35 127.48 2q42 s TYR 166 Ca 0.04 -2.10 0.07 0.00 -0.37 0.00 0.00 57.07 54.71 2q42 s TYR 166 Cb -0.15 -2.55 -0.02 0.00 -0.40 0.00 0.00 41.96 38.84 2q42 s TYR 166 CO -0.03 -0.87 0.38 0.00 -1.57 0.00 0.00 175.55 173.47 2q42 h GLY 168 N 1.05 0.00 -2.88 0.00 0.00 -0.42 -3.43 103.07 97.40 2q42 h GLY 168 Ca -0.44 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.72 2q42 h GLY 168 CO 0.55 0.00 -0.61 0.30 0.00 0.00 0.00 176.54 176.78 2q42 s HIS 169 N -4.73 0.80 -1.05 5.60 3.76 -1.26 -1.07 115.29 117.34 2q42 s HIS 169 Ca -0.04 -1.17 -0.06 0.00 -0.15 0.00 0.00 55.06 53.63 2q42 s HIS 169 Cb 0.16 -0.43 0.27 0.00 1.11 0.00 0.00 32.58 33.69 2q42 s HIS 169 CO 0.66 -0.54 1.07 -1.91 -0.85 0.00 0.00 174.74 173.17 2q42 n GLU 170 N -0.11 3.41 -0.12 1.40 4.07 -0.77 -4.74 120.64 123.78 2q42 n GLU 170 Ca -0.06 -4.48 0.06 0.00 -0.06 0.00 0.00 57.16 52.63 2q42 n GLU 170 Cb 0.64 -2.51 0.12 0.00 -0.06 0.00 0.00 31.44 29.63 2q42 n GLU 170 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2q42 n TYR 171 N 2.40 0.31 -0.23 4.31 4.01 -1.26 -4.81 117.16 121.89 2q42 n TYR 171 Ca 0.24 -0.30 -0.02 0.00 -0.16 0.00 0.00 57.90 57.66 2q42 n TYR 171 Cb 0.38 -0.01 0.09 0.00 -0.31 0.00 0.00 39.34 39.49 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 2.38 0.99 0.23 -0.72 2.02 -1.85 0.27 112.91 116.23 2q42 h THR 172 Ca 0.00 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 2q42 h THR 172 Cb 0.67 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 2q42 h THR 172 CO 0.00 0.13 -0.11 0.25 0.37 0.00 0.00 175.52 176.16 2q42 h LEU 173 N 0.70 -0.26 -1.04 2.58 5.85 -1.87 0.79 115.31 122.05 2q42 h LEU 173 Ca 0.29 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.90 2q42 h LEU 173 Cb 0.16 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 2q42 h LEU 173 CO -0.17 -0.03 0.65 -1.28 -0.34 0.00 0.00 178.44 177.27 2q42 h SER 174 N -0.49 1.13 -0.81 1.25 0.87 -1.89 -0.28 113.55 113.33 2q42 h SER 174 Ca -0.03 -0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2q42 h SER 174 Cb 0.37 -0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 2q42 h SER 174 CO 0.05 0.82 0.53 0.78 -0.53 0.00 0.00 176.83 178.48 2q42 h ASN 175 N 1.33 0.87 0.78 6.23 2.35 -0.10 -0.69 115.58 126.34 2q42 h ASN 175 Ca 0.36 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 56.01 2q42 h ASN 175 Cb -0.15 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.00 2q42 h ASN 175 CO -0.08 0.60 -0.40 0.77 -1.65 0.00 0.00 177.43 176.67 2q42 h SER 176 N 1.01 0.00 -0.41 5.81 4.64 0.94 -1.11 113.55 124.43 2q42 h SER 176 Ca 0.32 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.69 2q42 h SER 176 Cb 0.02 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.06 2q42 h SER 176 CO -0.09 0.40 0.14 0.11 -0.87 0.00 0.00 176.83 176.52 2q42 h LYS 177 N 0.00 0.29 -0.09 4.77 1.79 -0.64 0.88 116.57 123.57 2q42 h LYS 177 Ca -0.00 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.38 2q42 h LYS 177 Cb 0.90 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.48 2q42 h LYS 177 CO 0.05 0.19 -0.20 0.35 -1.08 0.00 0.00 179.45 178.77 2q42 h PHE 178 N 0.30 0.37 -0.93 -1.35 3.57 -1.47 -2.77 116.94 114.66 2q42 h PHE 178 Ca 0.19 -0.14 0.17 0.00 3.53 0.00 0.00 57.97 61.73 2q42 h PHE 178 Cb 0.18 -0.07 -0.08 0.00 2.79 0.00 0.00 35.95 38.78 2q42 h PHE 178 CO -0.16 0.80 0.60 0.00 -2.23 0.00 0.00 178.31 177.33 2q42 h ALA 179 N 0.50 1.88 0.00 2.41 0.00 -0.74 0.86 119.26 124.17 2q42 h ALA 179 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2q42 h ALA 179 Cb 0.79 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2q42 h ALA 179 CO 0.04 -0.16 -0.07 -0.07 0.00 0.00 0.00 179.25 178.99 2q42 h LEU 180 N 0.65 0.00 -1.08 0.00 3.38 -0.80 -2.09 115.31 115.38 2q42 h LEU 180 Ca 0.49 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.43 2q42 h LEU 180 Cb 0.88 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2q42 h LEU 180 CO -0.25 0.07 -0.17 0.77 0.09 0.00 0.00 178.44 178.95 2q42 h SER 181 N 0.00 0.00 0.03 -0.43 4.64 -0.53 -3.10 113.55 114.15 2q42 h SER 181 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.94 2q42 h SER 181 Cb 1.02 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.04 2q42 h SER 181 CO 0.01 0.17 -2.38 0.18 -0.87 0.00 0.00 176.83 173.94 2q42 n LEU 182 N -3.30 1.30 -3.15 5.97 4.77 -1.05 -4.75 117.00 116.79 2q42 n LEU 182 Ca 0.01 -0.03 -0.20 0.00 -0.03 0.00 0.00 56.01 55.76 2q42 n LEU 182 Cb 0.42 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 2q42 n LEU 182 CO 0.32 0.68 -0.16 1.21 -1.33 0.00 0.00 177.39 178.11 2q42 n GLU 183 N -2.99 1.40 0.29 3.23 2.13 -0.80 -3.83 120.64 120.07 2q42 n GLU 183 Ca -0.37 -3.66 0.16 0.00 0.66 0.00 0.00 57.16 53.94 2q42 n GLU 183 Cb 1.08 -1.80 0.91 0.00 0.27 0.00 0.00 31.44 31.91 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 3.03 0.00 -0.18 5.31 0.13 -1.77 -1.86 132.00 136.66 2q42 h PRO 184 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2q42 h PRO 184 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2q42 h PRO 184 CO 0.56 0.03 0.00 0.09 -0.23 0.00 0.00 178.00 178.45 2q42 n ASN 185 N -3.64 1.29 -4.62 1.44 5.03 -1.26 -4.79 115.26 108.71 2q42 n ASN 185 Ca -0.03 -1.80 -0.43 0.00 0.87 0.00 0.00 54.58 53.20 2q42 n ASN 185 Cb 0.13 -0.12 -0.03 0.00 -1.02 0.00 0.00 39.78 38.74 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 -1.31 6.82 0.25 6.41 3.84 -0.70 -4.91 114.94 125.33 2q42 s ASN 186 Ca 0.25 0.85 0.08 0.00 0.21 0.00 0.00 52.86 54.25 2q42 s ASN 186 Cb 0.13 -2.51 0.27 0.00 -0.55 0.00 0.00 41.25 38.59 2q42 s ASN 186 CO 0.19 -0.86 1.56 -0.08 -2.79 0.00 0.00 177.10 175.12 2q42 h GLU 187 N 8.25 0.07 -0.25 0.43 4.81 -1.89 -0.27 114.58 125.73 2q42 h GLU 187 Ca -0.22 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 58.87 2q42 h GLU 187 Cb 1.07 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 2q42 h GLU 187 CO 1.01 0.70 -0.18 0.28 -0.73 0.00 0.00 179.01 180.09 2q42 h VAL 188 N 0.05 1.31 -0.73 0.32 2.07 -1.91 -2.87 116.25 114.49 2q42 h VAL 188 Ca -0.01 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.17 2q42 h VAL 188 Cb 1.17 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 2q42 h VAL 188 CO 0.09 0.41 0.32 0.25 0.02 0.00 0.00 177.57 178.65 2q42 h LEU 189 N 0.28 0.99 -0.29 2.57 5.85 -1.78 -0.84 115.31 122.08 2q42 h LEU 189 Ca 0.05 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.67 2q42 h LEU 189 Cb 0.71 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 2q42 h LEU 189 CO 0.05 0.87 -0.11 1.56 -0.34 0.00 0.00 178.44 180.47 2q42 h GLN 190 N 1.04 -0.05 -0.16 1.25 4.20 -0.94 0.30 115.11 120.74 2q42 h GLN 190 Ca 0.25 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.77 2q42 h GLN 190 Cb 0.17 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 2q42 h GLN 190 CO -0.02 -0.04 -0.67 1.03 -0.67 0.00 0.00 178.83 178.46 2q42 h SER 191 N -0.06 0.71 -0.30 1.46 0.87 -1.37 -2.84 113.55 112.02 2q42 h SER 191 Ca 0.15 -0.43 0.02 0.00 -1.23 0.00 0.00 61.79 60.29 2q42 h SER 191 Cb 0.28 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2q42 h SER 191 CO -0.33 1.19 0.15 0.22 -0.53 0.00 0.00 176.83 177.53 2q42 h TYR 192 N 0.44 0.28 -0.32 2.24 3.20 -0.60 0.32 116.97 122.54 2q42 h TYR 192 Ca -0.02 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.87 2q42 h TYR 192 Cb 1.26 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 2q42 h TYR 192 CO 0.06 0.16 0.21 0.00 -1.64 0.00 0.00 178.16 176.95 2q42 h ALA 193 N 1.15 1.80 -0.27 1.82 0.00 -0.41 0.33 119.26 123.69 2q42 h ALA 193 Ca 0.13 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 2q42 h ALA 193 Cb 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2q42 h ALA 193 CO -0.09 0.18 -0.42 0.00 0.00 0.00 0.00 179.25 178.93 2q42 h ALA 194 N 1.81 0.41 -0.24 0.00 0.00 -1.07 0.41 119.26 120.58 2q42 h ALA 194 Ca 0.12 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2q42 h ALA 194 Cb -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2q42 h ALA 194 CO -0.03 0.53 0.04 1.25 0.00 0.00 0.00 179.25 181.05 2q42 h HIS 195 N 0.50 0.34 -0.05 0.00 6.17 0.55 0.04 115.15 122.69 2q42 h HIS 195 Ca 0.02 -0.01 -0.16 0.00 0.71 0.00 0.00 60.37 60.93 2q42 h HIS 195 Cb 1.01 -0.11 -0.01 0.00 2.52 0.00 0.00 27.41 30.83 2q42 h HIS 195 CO 0.08 0.31 -0.68 0.28 0.71 0.00 0.00 177.93 178.63 2q42 h VAL 196 N 0.34 1.42 -0.02 5.26 2.07 -0.04 -2.48 116.25 122.79 2q42 h VAL 196 Ca 0.08 -2.16 -0.08 0.00 0.82 0.00 0.00 66.70 65.36 2q42 h VAL 196 Cb 0.16 2.13 0.01 0.00 -1.52 0.00 0.00 31.29 32.07 2q42 h VAL 196 CO -0.00 0.64 -0.28 0.00 0.02 0.00 0.00 177.57 177.94 2q42 h ALA 197 N 1.12 0.06 -0.57 1.67 0.00 -0.22 -2.02 119.26 119.29 2q42 h ALA 197 Ca -0.02 -0.46 0.07 0.00 0.00 0.00 0.00 54.91 54.50 2q42 h ALA 197 Cb 1.22 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.97 2q42 h ALA 197 CO 0.11 0.12 0.26 0.93 0.00 0.00 0.00 179.25 180.66 2q42 h GLU 198 N -0.39 0.46 -0.61 0.00 5.08 -1.06 -0.99 114.58 117.07 2q42 h GLU 198 Ca -0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2q42 h GLU 198 Cb 1.00 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 2q42 h GLU 198 CO 0.06 0.31 0.34 -0.07 -1.00 0.00 0.00 179.01 178.64 2q42 h LEU 199 N 0.47 0.75 0.00 1.33 3.38 -1.45 -1.12 115.31 118.67 2q42 h LEU 199 Ca 0.27 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2q42 h LEU 199 Cb 0.26 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2q42 h LEU 199 CO -0.23 0.62 0.00 0.54 0.09 0.00 0.00 178.44 179.46 2q42 n ARG 200 N -4.58 0.91 0.07 1.13 5.12 -0.76 -1.37 116.66 117.18 2q42 n ARG 200 Ca 0.04 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.93 2q42 n ARG 200 Cb 0.08 -1.50 -0.07 0.00 -1.16 0.00 0.00 32.46 29.81 2q42 n ARG 200 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 2q42 h SER 201 N 0.00 0.00 -0.18 0.55 0.02 0.13 -3.32 113.55 110.75 2q42 h SER 201 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2q42 h SER 201 Cb 0.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 2q42 h SER 201 CO 0.00 0.77 -0.09 2.29 -1.14 0.00 0.00 176.83 178.66 2q42 n LYS 202 N -3.19 2.01 -3.85 3.45 2.85 -1.06 -5.00 118.16 113.37 2q42 n LYS 202 Ca -0.03 -2.93 -0.29 0.00 -1.05 0.00 0.00 58.31 54.00 2q42 n LYS 202 Cb 0.87 -1.72 0.04 0.00 -0.65 0.00 0.00 35.03 33.57 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 -1.01 -6.09 -3.52 -1.58 4.01 -1.05 -5.00 118.16 103.92 2q42 n LYS 203 Ca 0.23 0.65 -0.19 0.00 -0.51 0.00 0.00 58.31 58.48 2q42 n LYS 203 Cb 0.84 -5.58 -0.01 0.00 -0.51 0.00 0.00 35.03 29.77 2q42 n LYS 203 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2q42 s LEU 204 N -7.30 4.01 0.52 -0.35 1.43 -0.47 -5.02 118.68 111.49 2q42 s LEU 204 Ca 0.66 -0.12 -0.17 0.00 -1.03 0.00 0.00 54.13 53.47 2q42 s LEU 204 Cb -0.32 -2.79 -0.08 0.00 0.03 0.00 0.00 46.19 43.03 2q42 s LEU 204 CO 0.81 -0.39 0.99 -2.84 0.23 0.00 0.00 176.35 175.15 2q42 s PRO 205 N -4.16 3.88 -0.05 1.29 0.02 -1.26 -4.40 135.00 130.32 2q42 s PRO 205 Ca 0.43 1.00 0.14 0.00 0.02 0.00 0.00 61.00 62.59 2q42 s PRO 205 Cb -0.09 -2.12 0.44 0.00 0.02 0.00 0.00 34.50 32.74 2q42 s PRO 205 CO 0.31 -0.33 1.37 0.25 -0.33 0.00 0.00 177.00 178.27 2q42 n THR 206 N -1.59 1.36 -5.11 0.99 -2.24 -1.26 -4.93 114.28 101.50 2q42 n THR 206 Ca 0.07 -1.19 -0.30 0.00 -2.27 0.00 0.00 64.05 60.36 2q42 n THR 206 Cb 0.54 0.31 -0.15 0.00 -2.10 0.00 0.00 70.33 68.92 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 -1.46 2.01 0.60 2.28 -1.09 -1.26 -4.07 121.20 118.21 2q42 s ILE 207 Ca 0.33 -1.18 -0.16 0.00 -2.23 0.00 0.00 60.65 57.42 2q42 s ILE 207 Cb 0.21 -1.69 -0.03 0.00 -1.58 0.00 0.00 42.46 39.37 2q42 s ILE 207 CO 0.18 0.47 1.07 -2.16 -1.23 0.00 0.00 174.94 173.27 2q42 s PRO 208 N -0.83 3.23 0.14 2.79 0.04 -1.26 -5.08 135.00 134.04 2q42 s PRO 208 Ca 0.10 1.24 0.02 0.00 0.04 0.00 0.00 61.00 62.39 2q42 s PRO 208 Cb -0.10 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.44 2q42 s PRO 208 CO 0.00 -0.88 0.13 -2.37 0.04 0.00 0.00 177.00 173.92 2q42 n THR 209 N -2.09 0.00 -4.33 1.26 5.66 -0.47 -4.86 114.28 109.46 2q42 n THR 209 Ca 0.09 -0.55 -0.17 0.00 -3.05 0.00 0.00 64.05 60.37 2q42 n THR 209 Cb 0.53 -0.51 -0.10 0.00 -1.55 0.00 0.00 70.33 68.70 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 -0.50 1.17 0.10 1.09 -4.23 -1.26 0.32 115.64 112.33 2q42 s THR 210 Ca 0.10 -2.06 -0.23 0.00 -1.18 0.00 0.00 61.69 58.32 2q42 s THR 210 Cb -0.01 -2.24 -0.13 0.00 1.34 0.00 0.00 72.50 71.47 2q42 s THR 210 CO 0.06 -0.42 1.73 0.58 -0.54 0.00 0.00 174.62 176.03 2q42 h VAL 211 N 2.52 0.93 -0.83 2.29 2.07 -1.51 -1.25 116.25 120.47 2q42 h VAL 211 Ca -0.38 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.21 2q42 h VAL 211 Cb 1.22 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 2q42 h VAL 211 CO 0.64 0.00 0.54 0.50 0.02 0.00 0.00 177.57 179.28 2q42 h LYS 212 N -0.04 0.86 -0.20 1.57 3.64 -1.81 0.18 116.57 120.77 2q42 h LYS 212 Ca 0.02 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 59.16 2q42 h LYS 212 Cb 0.06 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 2q42 h LYS 212 CO -0.04 0.57 -0.60 1.98 -2.27 0.00 0.00 179.45 179.09 2q42 h MET 213 N 0.89 0.69 0.00 1.90 4.05 -1.70 -3.02 114.93 117.73 2q42 h MET 213 Ca 0.36 -0.46 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 2q42 h MET 213 Cb 0.27 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 2q42 h MET 213 CO -0.13 1.08 -0.12 0.39 0.23 0.00 0.00 176.91 178.36 2q42 n GLU 214 N -3.96 0.17 0.35 0.39 -0.58 -0.53 -2.29 120.64 114.19 2q42 n GLU 214 Ca -0.04 0.12 -0.14 0.00 -0.42 0.00 0.00 57.16 56.68 2q42 n GLU 214 Cb 0.65 -1.67 -0.07 0.00 -0.57 0.00 0.00 31.44 29.78 2q42 n GLU 214 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2q42 h LYS 215 N 0.00 -0.86 -0.22 3.49 1.57 -0.55 -2.85 116.57 117.15 2q42 h LYS 215 Ca 0.00 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2q42 h LYS 215 Cb 0.65 0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.16 2q42 h LYS 215 CO 0.00 -0.58 0.00 0.00 -0.57 0.00 0.00 179.45 178.30 2q42 n ALA 216 N -2.53 2.50 0.00 3.86 0.00 -1.22 -4.30 120.51 118.82 2q42 n ALA 216 Ca -0.11 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2q42 n ALA 216 Cb 0.35 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2q42 n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q42 s ASN 218 N -0.93 6.21 0.48 0.00 3.84 -1.07 -4.86 114.94 118.61 2q42 s ASN 218 Ca 0.00 0.02 0.22 0.00 0.21 0.00 0.00 52.86 53.31 2q42 s ASN 218 Cb 0.00 -2.20 1.25 0.00 -0.55 0.00 0.00 41.25 39.75 2q42 s ASN 218 CO 0.00 -0.26 1.94 1.55 -2.79 0.00 0.00 177.10 177.54 2q42 h PRO 219 N 8.34 0.19 0.00 0.43 0.13 -1.88 0.28 132.00 139.48 2q42 h PRO 219 Ca -0.31 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2q42 h PRO 219 Cb 1.15 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2q42 h PRO 219 CO 0.67 0.12 0.00 1.19 -0.23 0.00 0.00 178.00 179.75 2q42 n PHE 220 N -4.41 0.00 -0.04 1.56 3.72 -1.26 -1.50 117.46 115.52 2q42 n PHE 220 Ca 0.14 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.60 2q42 n PHE 220 Cb 0.63 -0.50 0.15 0.00 -0.94 0.00 0.00 39.48 38.83 2q42 n PHE 220 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2q42 n LEU 221 N -1.50 2.88 -0.83 4.37 4.77 0.08 -4.59 117.00 122.17 2q42 n LEU 221 Ca 0.04 -1.78 0.04 0.00 -0.03 0.00 0.00 56.01 54.27 2q42 n LEU 221 Cb 0.18 -0.21 0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2q42 n LEU 221 CO 0.14 0.69 0.23 0.54 -1.33 0.00 0.00 177.39 177.67 2q42 n ARG 222 N 0.71 0.36 0.00 3.23 1.74 -0.57 -4.90 116.66 117.24 2q42 n ARG 222 Ca 0.12 -1.86 0.02 0.00 -0.77 0.00 0.00 57.85 55.36 2q42 n ARG 222 Cb 0.43 -0.58 0.08 0.00 -1.02 0.00 0.00 32.46 31.36 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 -0.14 0.00 -0.05 0.55 3.41 -1.15 -0.94 113.62 115.29 2q42 n SER 223 Ca 0.07 0.36 0.11 0.00 -0.26 0.00 0.00 58.87 59.15 2q42 n SER 223 Cb 0.86 -0.38 0.14 0.00 -0.26 0.00 0.00 64.21 64.57 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 -1.38 0.79 -4.71 4.04 3.41 -1.26 -4.64 113.62 109.87 2q42 n SER 224 Ca 0.01 -0.61 -0.43 0.00 -0.26 0.00 0.00 58.87 57.58 2q42 n SER 224 Cb 0.03 0.47 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 2q42 n SER 224 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2q42 n ASN 225 N -1.33 3.49 0.05 4.04 2.85 -0.12 -4.87 115.26 119.37 2q42 n ASN 225 Ca 0.06 1.12 0.02 0.00 -0.11 0.00 0.00 54.58 55.68 2q42 n ASN 225 Cb 0.34 -1.53 0.38 0.00 1.24 0.00 0.00 39.78 40.22 2q42 n ASN 225 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 2q42 h THR 226 N 3.37 1.15 -0.15 -0.44 2.02 -1.91 -1.92 112.91 115.03 2q42 h THR 226 Ca -0.46 -0.56 -0.19 0.00 0.77 0.00 0.00 66.41 65.98 2q42 h THR 226 Cb 1.24 0.88 0.01 0.00 -1.74 0.00 0.00 68.15 68.54 2q42 h THR 226 CO 0.82 0.20 -0.64 0.44 0.37 0.00 0.00 175.52 176.71 2q42 h ASP 227 N 0.42 0.83 -0.45 4.18 3.32 -1.89 -1.67 116.42 121.15 2q42 h ASP 227 Ca 0.10 -0.62 -0.04 0.00 0.02 0.00 0.00 57.03 56.49 2q42 h ASP 227 Cb 0.20 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 2q42 h ASP 227 CO -0.00 1.31 0.13 0.40 -1.72 0.00 0.00 179.24 179.36 2q42 h ILE 228 N 0.40 1.23 -0.40 0.35 2.04 -1.63 0.15 117.51 119.64 2q42 h ILE 228 Ca -0.04 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 2q42 h ILE 228 Cb 1.27 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 2q42 h ILE 228 CO 0.13 0.28 0.16 0.03 0.00 0.00 0.00 178.15 178.74 2q42 h ARG 229 N 0.60 0.61 -0.47 2.37 3.08 -1.29 -2.40 114.38 116.88 2q42 h ARG 229 Ca 0.15 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 2q42 h ARG 229 Cb 0.29 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2q42 h ARG 229 CO -0.00 0.58 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.36 2q42 h ARG 230 N 0.51 0.85 0.00 0.04 2.43 -1.24 0.24 114.38 117.21 2q42 h ARG 230 Ca 0.13 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2q42 h ARG 230 Cb 0.20 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2q42 h ARG 230 CO -0.01 0.91 0.00 0.00 -1.51 0.00 0.00 179.97 179.36 2q42 n ALA 231 N -2.44 1.17 -1.42 2.80 0.00 0.53 -2.40 120.51 118.74 2q42 n ALA 231 Ca 0.00 0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.59 2q42 n ALA 231 Cb 0.32 -1.18 0.10 0.00 0.00 0.00 0.00 19.45 18.69 2q42 n ALA 231 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2q42 n LEU 232 N -1.85 1.63 -4.26 0.00 4.77 -0.91 -5.01 117.00 111.37 2q42 n LEU 232 Ca 0.00 -2.48 -0.35 0.00 -0.03 0.00 0.00 56.01 53.15 2q42 n LEU 232 Cb 0.06 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 40.81 2q42 n LEU 232 CO 0.07 0.61 -0.15 -1.14 -1.33 0.00 0.00 177.39 175.45 2q42 n ARG 233 N -0.94 -2.40 -3.01 3.23 3.00 -0.53 -4.90 116.66 111.11 2q42 n ARG 233 Ca 0.11 0.29 -0.42 0.00 -0.00 0.00 0.00 57.85 57.83 2q42 n ARG 233 Cb 0.67 -4.73 -0.06 0.00 0.00 0.00 0.00 32.46 28.35 2q42 n ARG 233 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2q42 s ILE 234 N -3.54 4.77 0.73 5.15 1.01 0.73 -5.03 121.20 125.03 2q42 s ILE 234 Ca 0.54 0.69 -0.16 0.00 0.00 0.00 0.00 60.65 61.73 2q42 s ILE 234 Cb -0.30 -4.18 0.03 0.00 0.01 0.00 0.00 42.46 38.02 2q42 s ILE 234 CO 0.95 -0.44 1.18 -2.65 0.00 0.00 0.00 174.94 173.98 2q42 n PRO 235 N 6.34 0.61 0.22 2.79 -0.02 -1.26 -4.58 135.00 139.10 2q42 n PRO 235 Ca 0.01 0.27 0.05 0.00 -2.02 0.00 0.00 63.50 61.82 2q42 n PRO 235 Cb 0.48 -2.42 0.49 0.00 -0.02 0.00 0.00 33.50 32.04 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 -0.21 0.00 0.00 -0.52 5.08 -1.97 -2.33 114.58 114.63 2q42 h GLU 236 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2q42 h GLU 236 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2q42 h GLU 236 CO 0.49 0.20 0.00 0.00 -1.00 0.00 0.00 179.01 178.70 2q42 n ALA 237 N -2.49 1.80 -1.78 3.43 0.00 -1.26 -4.76 120.51 115.45 2q42 n ALA 237 Ca -0.02 -0.06 -0.37 0.00 0.00 0.00 0.00 53.44 52.98 2q42 n ALA 237 Cb 0.26 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.41 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 -2.76 3.17 0.75 0.00 0.00 -0.88 -5.05 121.76 116.99 2q42 s ALA 238 Ca 0.12 0.67 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 2q42 s ALA 238 Cb 0.10 -3.25 0.11 0.00 0.00 0.00 0.00 23.12 20.08 2q42 s ALA 238 CO 0.26 -0.07 0.70 -0.40 0.00 0.00 0.00 175.76 176.24 2q42 n ASP 239 N 0.33 0.55 -0.25 0.00 5.68 -1.26 -4.85 116.55 116.75 2q42 n ASP 239 Ca 0.03 -1.56 -0.07 0.00 -0.50 0.00 0.00 54.79 52.69 2q42 n ASP 239 Cb 0.49 -0.49 0.04 0.00 -1.14 0.00 0.00 41.12 40.03 2q42 n ASP 239 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2q42 h GLU 240 N 0.00 1.11 -0.34 0.11 4.81 -1.96 -1.77 114.58 116.54 2q42 h GLU 240 Ca -0.23 -0.26 -0.05 0.00 -0.13 0.00 0.00 59.36 58.69 2q42 h GLU 240 Cb 0.75 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2q42 h GLU 240 CO 0.21 0.97 0.01 0.00 -0.73 0.00 0.00 179.01 179.47 2q42 h ALA 241 N 1.09 0.46 -0.49 2.92 0.00 -1.94 -0.40 119.26 120.90 2q42 h ALA 241 Ca 0.22 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2q42 h ALA 241 Cb 0.35 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2q42 h ALA 241 CO -0.00 0.21 0.17 0.93 0.00 0.00 0.00 179.25 180.56 2q42 h GLU 242 N 0.41 0.74 -0.62 0.00 5.08 -1.91 -1.61 114.58 116.67 2q42 h GLU 242 Ca 0.10 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2q42 h GLU 242 Cb 0.44 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2q42 h GLU 242 CO 0.02 0.69 0.35 0.00 -1.00 0.00 0.00 179.01 179.06 2q42 h ALA 243 N 1.02 0.79 -0.83 3.43 0.00 -1.17 -2.25 119.26 120.25 2q42 h ALA 243 Ca 0.16 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.03 2q42 h ALA 243 Cb 0.24 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 2q42 h ALA 243 CO -0.01 0.30 0.51 1.25 0.00 0.00 0.00 179.25 181.31 2q42 h LEU 244 N 0.84 0.79 -0.93 0.00 6.46 -0.78 0.05 115.31 121.75 2q42 h LEU 244 Ca 0.22 0.02 0.06 0.00 -0.12 0.00 0.00 57.88 58.06 2q42 h LEU 244 Cb 0.03 -0.15 -0.06 0.00 -0.73 0.00 0.00 40.66 39.75 2q42 h LEU 244 CO -0.04 0.51 0.59 1.23 -0.62 0.00 0.00 178.44 180.11 2q42 h GLY 245 N 0.93 1.39 1.21 3.75 0.00 -0.71 0.20 103.07 109.83 2q42 h GLY 245 Ca 0.37 -0.43 -0.23 0.00 0.00 0.00 0.00 47.33 47.03 2q42 h GLY 245 CO -0.18 0.32 -0.82 -2.22 0.00 0.00 0.00 176.54 173.65 2q42 h ILE 246 N 1.09 1.28 -0.24 2.60 2.04 -1.07 -2.57 117.51 120.64 2q42 h ILE 246 Ca 0.39 -2.02 0.02 0.00 1.00 0.00 0.00 64.86 64.25 2q42 h ILE 246 Cb 0.13 2.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 2q42 h ILE 246 CO -0.16 0.64 0.12 0.40 0.00 0.00 0.00 178.15 179.15 2q42 h ILE 247 N 0.51 0.99 0.00 -0.67 2.04 -0.63 0.03 117.51 119.78 2q42 h ILE 247 Ca -0.06 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 2q42 h ILE 247 Cb 1.45 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 38.25 2q42 h ILE 247 CO 0.17 0.05 -0.07 -0.09 0.00 0.00 0.00 178.15 178.21 2q42 h ARG 248 N 0.25 0.00 0.23 2.37 9.65 -0.63 -1.46 114.38 124.80 2q42 h ARG 248 Ca 0.10 0.00 -0.34 0.00 -1.10 0.00 0.00 59.98 58.64 2q42 h ARG 248 Cb 0.03 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 28.64 2q42 h ARG 248 CO -0.07 0.07 -1.56 -0.22 2.80 0.00 0.00 179.97 180.98 2q42 h LYS 249 N 0.00 0.50 0.17 0.20 3.64 -0.98 -2.76 116.57 117.34 2q42 h LYS 249 Ca -0.00 -0.85 -0.01 0.00 -1.27 0.00 0.00 60.65 58.52 2q42 h LYS 249 Cb 0.41 0.32 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 2q42 h LYS 249 CO 0.01 1.40 -0.08 0.00 -2.27 0.00 0.00 179.45 178.51 2q42 h ALA 250 N 0.15 -0.23 -0.69 5.00 0.00 -0.38 -2.05 119.26 121.07 2q42 h ALA 250 Ca -0.28 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.58 2q42 h ALA 250 Cb 2.15 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 19.96 2q42 h ALA 250 CO 0.25 -0.51 0.33 -0.22 0.00 0.00 0.00 179.25 179.10 2q42 h LYS 251 N -0.47 0.55 -0.95 0.00 3.64 -1.43 0.16 116.57 118.08 2q42 h LYS 251 Ca -0.02 -0.03 0.21 0.00 -1.27 0.00 0.00 60.65 59.54 2q42 h LYS 251 Cb 0.36 -0.12 -0.12 0.00 -0.41 0.00 0.00 32.23 31.94 2q42 h LYS 251 CO 0.04 0.37 0.51 -0.44 -2.27 0.00 0.00 179.45 177.66 2q42 h ASP 252 N 0.57 0.57 -0.46 4.20 5.19 -1.18 -1.14 116.42 124.16 2q42 h ASP 252 Ca 0.34 0.13 -0.09 0.00 -0.62 0.00 0.00 57.03 56.79 2q42 h ASP 252 Cb 0.36 0.05 -0.06 0.00 0.18 0.00 0.00 39.33 39.86 2q42 h ASP 252 CO -0.27 0.12 0.07 -0.67 -3.12 0.00 0.00 179.24 175.37 2q42 n ASP 253 N -4.91 4.24 -0.11 6.45 2.03 -0.25 -5.10 116.55 118.90 2q42 n ASP 253 Ca 0.23 -3.18 0.16 0.00 0.52 0.00 0.00 54.79 52.52 2q42 n ASP 253 Cb 0.64 -0.64 0.85 0.00 -0.72 0.00 0.00 41.12 41.26 2q42 n ASP 253 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61