#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 4.19 -0.27 2.12 -0.21 -0.15 -4.90 119.66 120.44 2q42 s GLN 2 Ca 0.00 0.74 0.01 0.00 0.02 0.00 0.00 55.36 56.13 2q42 s GLN 2 Cb 0.00 -3.16 0.08 0.00 1.00 0.00 0.00 33.01 30.93 2q42 s GLN 2 CO 0.00 0.59 0.00 0.42 -2.12 0.00 0.00 175.29 174.18 2q42 s ILE 3 N -1.20 1.55 -0.26 1.08 1.01 -1.26 -0.46 121.20 121.65 2q42 s ILE 3 Ca 0.32 -1.51 -0.10 0.00 0.00 0.00 0.00 60.65 59.37 2q42 s ILE 3 Cb -0.19 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.28 2q42 s ILE 3 CO 0.20 -0.34 0.14 -0.70 0.00 0.00 0.00 174.94 174.24 2q42 s GLU 4 N 1.34 3.86 0.23 2.79 2.12 0.59 -4.94 118.70 124.70 2q42 s GLU 4 Ca 0.01 -0.37 -0.30 0.00 0.36 0.00 0.00 54.97 54.68 2q42 s GLU 4 Cb -0.19 -3.51 -0.09 0.00 0.26 0.00 0.00 34.13 30.61 2q42 s GLU 4 CO -0.11 -0.13 1.07 -0.51 -0.54 0.00 0.00 175.26 175.03 2q42 s LEU 5 N 1.57 4.55 -0.31 2.70 1.02 -1.26 -0.74 118.68 126.20 2q42 s LEU 5 Ca 0.07 2.14 0.02 0.00 0.02 0.00 0.00 54.13 56.37 2q42 s LEU 5 Cb -0.15 -3.62 0.09 0.00 0.02 0.00 0.00 46.19 42.53 2q42 s LEU 5 CO 0.07 -0.11 0.04 -0.69 0.02 0.00 0.00 176.35 175.68 2q42 s VAL 6 N -0.83 1.69 0.27 -1.59 1.01 -0.39 -4.93 120.40 115.63 2q42 s VAL 6 Ca 0.45 -1.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.33 2q42 s VAL 6 Cb -0.30 -2.18 -0.11 0.00 0.00 0.00 0.00 36.38 33.80 2q42 s VAL 6 CO 0.37 -0.50 1.51 -2.84 0.00 0.00 0.00 175.10 173.64 2q42 s PRO 7 N 1.23 4.20 0.08 2.72 0.02 -1.26 -1.61 135.00 140.37 2q42 s PRO 7 Ca 0.07 2.43 0.01 0.00 0.02 0.00 0.00 61.00 63.52 2q42 s PRO 7 Cb -0.18 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.23 2q42 s PRO 7 CO -0.13 -0.52 -0.05 0.00 -0.33 0.00 0.00 177.00 175.97 2q42 n LEU 9 N 0.08 0.00 -0.07 0.00 4.77 -1.26 -1.22 117.00 119.29 2q42 n LEU 9 Ca -0.13 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.72 2q42 n LEU 9 Cb 0.61 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.55 2q42 n LEU 9 CO 0.29 0.00 -0.98 1.17 -1.33 0.00 0.00 177.39 176.53 2q42 n LYS 10 N 14.00 0.68 -0.47 3.23 4.81 -1.26 -4.75 118.16 134.39 2q42 n LYS 10 Ca 0.00 0.15 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 2q42 n LYS 10 Cb 0.00 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.43 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 -3.05 0.00 -4.86 3.14 5.68 -1.20 -5.04 116.55 111.22 2q42 n ASP 11 Ca -0.32 -1.23 -0.31 0.00 -0.50 0.00 0.00 54.79 52.44 2q42 n ASP 11 Cb 1.08 -0.05 -0.04 0.00 -1.14 0.00 0.00 41.12 40.97 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 -0.23 6.63 -0.12 -1.12 -0.87 -0.36 -1.32 114.94 117.56 2q42 s ASN 12 Ca 0.00 1.21 0.03 0.00 -1.57 0.00 0.00 52.86 52.53 2q42 s ASN 12 Cb 0.00 -2.35 0.01 0.00 -0.02 0.00 0.00 41.25 38.89 2q42 s ASN 12 CO 0.00 -0.33 -0.22 -0.31 -2.57 0.00 0.00 177.10 173.68 2q42 s TYR 13 N -2.22 2.50 0.35 2.20 2.02 -0.82 -1.48 117.35 119.89 2q42 s TYR 13 Ca 0.53 -1.15 0.06 0.00 -0.37 0.00 0.00 57.07 56.14 2q42 s TYR 13 Cb -0.10 -1.70 -0.01 0.00 -0.40 0.00 0.00 41.96 39.75 2q42 s TYR 13 CO 0.26 -0.51 0.49 0.00 -1.57 0.00 0.00 175.55 174.22 2q42 s ALA 14 N 0.63 4.26 -0.15 3.71 0.00 -0.63 -4.83 121.76 124.75 2q42 s ALA 14 Ca -0.12 -1.47 -0.03 0.00 0.00 0.00 0.00 51.96 50.34 2q42 s ALA 14 Cb -0.16 -1.69 0.05 0.00 0.00 0.00 0.00 23.12 21.32 2q42 s ALA 14 CO 0.03 -0.08 0.04 0.71 0.00 0.00 0.00 175.76 176.46 2q42 s TYR 15 N -2.21 0.71 -0.22 0.00 2.02 -0.02 -1.27 117.35 116.37 2q42 s TYR 15 Ca 0.46 -0.51 -0.20 0.00 -0.37 0.00 0.00 57.07 56.44 2q42 s TYR 15 Cb -0.10 -0.87 -0.02 0.00 -0.40 0.00 0.00 41.96 40.57 2q42 s TYR 15 CO 0.32 -0.50 0.62 0.42 -1.57 0.00 0.00 175.55 174.83 2q42 s ILE 16 N 1.96 5.02 -0.30 2.71 1.01 0.08 0.63 121.20 132.31 2q42 s ILE 16 Ca 0.01 1.14 -0.14 0.00 0.00 0.00 0.00 60.65 61.66 2q42 s ILE 16 Cb -0.15 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.36 2q42 s ILE 16 CO -0.07 0.09 0.33 -0.76 0.00 0.00 0.00 174.94 174.53 2q42 s LEU 17 N 2.09 4.16 -0.37 2.97 1.43 0.65 -0.30 118.68 129.33 2q42 s LEU 17 Ca 0.27 0.06 -0.10 0.00 -1.03 0.00 0.00 54.13 53.33 2q42 s LEU 17 Cb -0.16 -2.34 0.03 0.00 0.03 0.00 0.00 46.19 43.75 2q42 s LEU 17 CO 0.10 -0.21 0.19 -1.00 0.23 0.00 0.00 176.35 175.65 2q42 s HIS 18 N 1.99 3.24 0.25 0.29 3.76 0.39 -1.29 115.29 123.92 2q42 s HIS 18 Ca 0.12 -1.03 -0.30 0.00 -0.15 0.00 0.00 55.06 53.71 2q42 s HIS 18 Cb -0.16 -2.41 -0.09 0.00 1.11 0.00 0.00 32.58 31.03 2q42 s HIS 18 CO 0.11 -0.66 1.22 0.34 -0.85 0.00 0.00 174.74 174.90 2q42 s ASP 19 N 1.53 7.03 0.00 1.40 2.15 -0.56 -0.97 116.67 127.25 2q42 s ASP 19 Ca 0.01 2.38 0.22 0.00 0.43 0.00 0.00 52.55 55.60 2q42 s ASP 19 Cb -0.19 -2.62 0.20 0.00 -0.30 0.00 0.00 42.92 40.01 2q42 s ASP 19 CO 0.06 -0.38 1.21 -0.62 -0.17 0.00 0.00 175.17 175.28 2q42 n GLU 20 N 1.78 2.09 0.00 4.34 1.02 -1.26 -4.16 120.64 124.44 2q42 n GLU 20 Ca 0.02 -1.86 0.08 0.00 -0.02 0.00 0.00 57.16 55.39 2q42 n GLU 20 Cb 0.44 -1.43 0.06 0.00 -0.02 0.00 0.00 31.44 30.49 2q42 n GLU 20 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2q42 n ASP 21 N 1.25 2.33 0.00 1.62 2.03 -1.26 -4.96 116.55 117.55 2q42 n ASP 21 Ca 0.13 -1.66 0.00 0.00 0.52 0.00 0.00 54.79 53.78 2q42 n ASP 21 Cb 0.55 0.06 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 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 0.83 0.00 -1.15 5.18 -2.24 -1.26 -5.06 114.28 110.58 2q42 n THR 22 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 2q42 n THR 22 Cb 0.42 0.00 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 0.67 0.58 3.75 3.38 0.00 -1.26 -5.06 105.19 107.26 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 0.00 3.55 -0.11 2.61 2.01 -1.26 -4.81 115.64 117.62 2q42 s THR 24 Ca 0.00 1.48 -0.00 0.00 0.31 0.00 0.00 61.69 63.48 2q42 s THR 24 Cb 0.00 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.59 2q42 s THR 24 CO 0.00 0.32 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.48 2q42 s VAL 25 N -0.85 1.04 0.04 3.82 1.01 -1.26 -1.49 120.40 122.71 2q42 s VAL 25 Ca 0.46 -0.30 0.05 0.00 0.00 0.00 0.00 61.98 62.20 2q42 s VAL 25 Cb -0.32 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 2q42 s VAL 25 CO 0.40 0.37 -0.10 -0.83 0.00 0.00 0.00 175.10 174.93 2q42 s GLY 26 N 1.70 1.72 0.07 4.51 0.00 -0.41 -0.89 107.32 114.02 2q42 s GLY 26 Ca 0.05 -1.13 0.09 0.00 0.00 0.00 0.00 44.72 43.73 2q42 s GLY 26 CO -0.08 -1.03 -0.23 0.54 0.00 0.00 0.00 173.10 172.29 2q42 s VAL 27 N -1.04 2.44 -0.15 1.40 0.11 -0.45 0.24 120.40 122.94 2q42 s VAL 27 Ca 0.18 -1.41 -0.04 0.00 -2.93 0.00 0.00 61.98 57.78 2q42 s VAL 27 Cb -0.11 -2.02 -0.03 0.00 -1.53 0.00 0.00 36.38 32.69 2q42 s VAL 27 CO 0.09 0.28 -0.02 -0.69 -3.33 0.00 0.00 175.10 171.43 2q42 s VAL 28 N -0.93 4.08 -0.66 2.04 1.01 0.21 -1.55 120.40 124.60 2q42 s VAL 28 Ca 0.14 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.70 2q42 s VAL 28 Cb -0.10 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.51 2q42 s VAL 28 CO 0.05 0.50 0.64 0.47 0.00 0.00 0.00 175.10 176.76 2q42 n ASP 29 N 3.38 -6.09 -4.50 3.32 8.00 -0.04 -0.84 116.55 119.77 2q42 n ASP 29 Ca -0.17 -0.36 -0.42 0.00 0.71 0.00 0.00 54.79 54.54 2q42 n ASP 29 Cb 0.53 -2.98 -0.03 0.00 -0.02 0.00 0.00 41.12 38.62 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 -3.57 3.58 0.48 -0.24 0.04 -1.22 -3.91 135.00 130.16 2q42 s PRO 30 Ca 0.13 -1.42 0.34 0.00 0.04 0.00 0.00 61.00 60.10 2q42 s PRO 30 Cb -0.02 -5.11 1.48 0.00 0.04 0.00 0.00 34.50 30.89 2q42 s PRO 30 CO 0.84 -1.99 1.66 0.77 0.04 0.00 0.00 177.00 178.33 2q42 h SER 31 N 9.33 0.17 -4.42 6.66 0.02 -1.78 0.19 113.55 123.71 2q42 h SER 31 Ca 0.17 0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.24 2q42 h SER 31 Cb 1.02 0.06 -0.20 0.00 0.14 0.00 0.00 62.40 63.41 2q42 h SER 31 CO 1.27 -0.07 0.45 -1.83 -1.14 0.00 0.00 176.83 175.51 2q42 s GLU 32 N -5.16 0.75 0.04 3.45 -1.05 -1.26 -3.13 118.70 112.34 2q42 s GLU 32 Ca -0.07 0.08 -0.26 0.00 -0.15 0.00 0.00 54.97 54.57 2q42 s GLU 32 Cb 0.27 0.35 -0.17 0.00 -0.44 0.00 0.00 34.13 34.14 2q42 s GLU 32 CO 0.83 -0.26 1.47 0.00 0.95 0.00 0.00 175.26 178.25 2q42 h ALA 33 N 2.54 -0.31 -0.82 -0.84 0.00 -1.82 -3.35 119.26 114.66 2q42 h ALA 33 Ca -0.21 -0.14 0.19 0.00 0.00 0.00 0.00 54.91 54.75 2q42 h ALA 33 Cb 1.18 0.12 -0.15 0.00 0.00 0.00 0.00 17.79 18.94 2q42 h ALA 33 CO 0.33 -0.58 -0.05 1.49 0.00 0.00 0.00 179.25 180.45 2q42 h GLU 34 N -0.51 0.06 -0.15 0.00 4.57 -1.98 0.23 114.58 116.80 2q42 h GLU 34 Ca -0.03 -0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 2q42 h GLU 34 Cb 0.38 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 2q42 h GLU 34 CO 0.05 0.04 -0.02 -1.35 -1.18 0.00 0.00 179.01 176.55 2q42 h PRO 35 N 0.06 0.21 0.06 0.92 0.11 -1.95 -1.53 132.00 129.88 2q42 h PRO 35 Ca 0.45 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.52 2q42 h PRO 35 Cb 0.79 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2q42 h PRO 35 CO -0.77 0.25 -0.03 0.82 -0.21 0.00 0.00 178.00 178.07 2q42 h ILE 36 N 0.21 1.25 -0.77 4.15 1.08 -0.72 -3.18 117.51 119.54 2q42 h ILE 36 Ca 0.05 -1.48 0.18 0.00 -0.39 0.00 0.00 64.86 63.22 2q42 h ILE 36 Cb 0.18 2.16 -0.13 0.00 -3.07 0.00 0.00 36.82 35.96 2q42 h ILE 36 CO 0.00 0.35 0.09 0.40 -0.69 0.00 0.00 178.15 178.30 2q42 h ILE 37 N -0.79 0.38 -1.00 -0.67 2.04 -1.15 0.16 117.51 116.48 2q42 h ILE 37 Ca -0.01 -0.06 0.08 0.00 1.00 0.00 0.00 64.86 65.87 2q42 h ILE 37 Cb 0.63 0.21 -0.07 0.00 -0.74 0.00 0.00 36.82 36.85 2q42 h ILE 37 CO 0.01 0.03 0.64 0.44 0.00 0.00 0.00 178.15 179.28 2q42 h ASP 38 N 0.16 1.01 0.99 1.72 3.32 -1.33 0.65 116.42 122.95 2q42 h ASP 38 Ca 0.43 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.39 2q42 h ASP 38 Cb 0.78 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2q42 h ASP 38 CO -0.62 0.62 -0.52 -1.28 -1.72 0.00 0.00 179.24 175.72 2q42 h SER 39 N 1.13 0.00 0.32 6.45 0.87 -0.75 -3.25 113.55 118.32 2q42 h SER 39 Ca 0.45 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.72 2q42 h SER 39 Cb 0.24 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.22 2q42 h SER 39 CO -0.19 0.52 -1.24 -0.07 -0.53 0.00 0.00 176.83 175.32 2q42 h LEU 40 N 0.00 0.70 -2.09 2.23 3.38 0.37 -3.18 115.31 116.73 2q42 h LEU 40 Ca -0.01 -0.67 -0.00 0.00 0.09 0.00 0.00 57.88 57.29 2q42 h LEU 40 Cb 1.16 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2q42 h LEU 40 CO 0.07 1.50 -0.01 0.11 0.09 0.00 0.00 178.44 180.20 2q42 h LYS 41 N 0.19 0.00 0.32 1.13 1.79 -1.00 0.22 116.57 119.23 2q42 h LYS 41 Ca -0.17 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.29 2q42 h LYS 41 Cb 1.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.57 2q42 h LYS 41 CO 0.22 0.01 -0.15 -0.09 -1.08 0.00 0.00 179.45 178.36 2q42 h ARG 42 N 0.00 -0.42 0.00 3.15 2.43 -1.58 -2.71 114.38 115.26 2q42 h ARG 42 Ca -0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2q42 h ARG 42 Cb 0.02 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2q42 h ARG 42 CO 0.00 -0.28 0.00 -1.13 -1.51 0.00 0.00 179.97 177.05 2q42 n SER 43 N -3.34 0.00 -3.80 -3.80 3.41 -1.13 -4.86 113.62 100.10 2q42 n SER 43 Ca -0.05 -0.15 -0.26 0.00 -0.26 0.00 0.00 58.87 58.15 2q42 n SER 43 Cb 0.17 -0.18 0.03 0.00 -0.26 0.00 0.00 64.21 63.97 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 0.04 -0.42 3.40 5.00 0.00 0.75 -4.99 105.19 108.96 2q42 n GLY 44 Ca 0.09 0.17 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 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 -6.33 1.42 0.51 1.61 0.52 -1.02 -5.03 118.95 110.63 2q42 s ARG 45 Ca 0.40 -1.37 -0.11 0.00 -0.52 0.00 0.00 55.73 54.13 2q42 s ARG 45 Cb -0.19 -1.90 -0.06 0.00 0.52 0.00 0.00 34.95 33.32 2q42 s ARG 45 CO 0.81 0.45 0.90 1.21 0.02 0.00 0.00 175.30 178.69 2q42 s ASN 46 N -2.13 6.42 -0.37 0.23 3.04 -1.26 -4.72 114.94 116.15 2q42 s ASN 46 Ca 0.15 1.29 -0.18 0.00 0.04 0.00 0.00 52.86 54.16 2q42 s ASN 46 Cb -0.10 -2.40 0.00 0.00 -1.54 0.00 0.00 41.25 37.22 2q42 s ASN 46 CO 0.07 -0.61 0.52 -0.22 -3.04 0.00 0.00 177.10 173.81 2q42 s LEU 47 N -4.44 4.43 -0.14 3.21 2.96 -1.26 -4.30 118.68 119.14 2q42 s LEU 47 Ca 0.54 -0.15 -0.24 0.00 -0.22 0.00 0.00 54.13 54.05 2q42 s LEU 47 Cb -0.10 -2.57 -0.22 0.00 0.50 0.00 0.00 46.19 43.79 2q42 s LEU 47 CO 0.40 -0.53 0.61 0.74 -1.32 0.00 0.00 176.35 176.25 2q42 h THR 48 N 5.66 1.47 -3.76 3.68 2.02 -1.38 -3.40 112.91 117.19 2q42 h THR 48 Ca -0.27 -2.15 -0.50 0.00 0.77 0.00 0.00 66.41 64.26 2q42 h THR 48 Cb 1.12 2.82 -0.20 0.00 -1.74 0.00 0.00 68.15 70.15 2q42 h THR 48 CO 0.79 0.50 -0.80 -0.31 0.37 0.00 0.00 175.52 176.07 2q42 s TYR 49 N -2.16 1.61 -0.10 3.16 2.02 -1.08 -2.50 117.35 118.30 2q42 s TYR 49 Ca -0.18 -0.46 0.01 0.00 -0.37 0.00 0.00 57.07 56.07 2q42 s TYR 49 Cb -0.02 -0.86 0.02 0.00 -0.40 0.00 0.00 41.96 40.70 2q42 s TYR 49 CO 0.59 0.19 -0.10 0.42 -1.57 0.00 0.00 175.55 175.08 2q42 s ILE 50 N -1.50 1.11 -0.07 2.71 1.01 -0.18 -1.34 121.20 122.94 2q42 s ILE 50 Ca 0.07 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.38 2q42 s ILE 50 Cb -0.08 -1.08 -0.00 0.00 0.01 0.00 0.00 42.46 41.30 2q42 s ILE 50 CO 0.04 0.37 -0.23 -0.76 0.00 0.00 0.00 174.94 174.36 2q42 s LEU 51 N 1.33 2.04 -0.06 2.97 1.02 -0.60 0.19 118.68 125.58 2q42 s LEU 51 Ca -0.02 -0.50 0.05 0.00 0.02 0.00 0.00 54.13 53.68 2q42 s LEU 51 Cb -0.14 -1.31 -0.02 0.00 0.02 0.00 0.00 46.19 44.74 2q42 s LEU 51 CO -0.04 0.19 -0.19 0.20 0.02 0.00 0.00 176.35 176.53 2q42 s ASN 52 N 0.08 3.57 0.07 2.29 -0.87 -0.85 -0.86 114.94 118.37 2q42 s ASN 52 Ca -0.10 -0.35 -0.02 0.00 -1.57 0.00 0.00 52.86 50.82 2q42 s ASN 52 Cb -0.15 -0.85 -0.27 0.00 -0.02 0.00 0.00 41.25 39.96 2q42 s ASN 52 CO 0.05 0.29 1.12 0.71 -2.57 0.00 0.00 177.10 176.71 2q42 h THR 53 N 4.71 1.49 -3.05 1.60 1.35 -1.89 -3.42 112.91 113.70 2q42 h THR 53 Ca -0.39 -3.09 0.02 0.00 -0.55 0.00 0.00 66.41 62.40 2q42 h THR 53 Cb 1.16 2.90 -0.03 0.00 -1.73 0.00 0.00 68.15 70.46 2q42 h THR 53 CO 0.49 0.89 0.23 -1.38 -0.25 0.00 0.00 175.52 175.50 2q42 s HIS 54 N -2.66 0.01 -0.65 4.73 -3.43 -1.26 -0.96 115.29 111.07 2q42 s HIS 54 Ca -0.04 -0.56 0.25 0.00 -0.80 0.00 0.00 55.06 53.92 2q42 s HIS 54 Cb 0.07 0.73 0.65 0.00 -1.43 0.00 0.00 32.58 32.61 2q42 s HIS 54 CO 0.87 -1.38 1.68 1.12 -2.00 0.00 0.00 174.74 175.03 2q42 h HIS 55 N 2.01 0.00 -2.93 0.38 -0.00 -1.93 -3.42 115.15 109.26 2q42 h HIS 55 Ca -0.26 0.00 -0.59 0.00 -0.00 0.00 0.00 60.37 59.53 2q42 h HIS 55 Cb 1.25 0.00 0.15 0.00 -0.00 0.00 0.00 27.41 28.81 2q42 h HIS 55 CO 0.89 0.00 -0.16 0.72 -0.00 0.00 0.00 177.93 179.38 2q42 n HIS 56 N -2.43 0.10 -0.07 6.12 8.25 -1.26 -4.60 115.22 121.33 2q42 n HIS 56 Ca 0.05 0.51 0.06 0.00 -0.26 0.00 0.00 57.72 58.08 2q42 n HIS 56 Cb 0.45 -2.07 0.42 0.00 1.12 0.00 0.00 29.99 29.92 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 0.77 0.57 0.00 4.41 3.20 -1.95 -0.39 116.97 123.58 2q42 h TYR 57 Ca -0.44 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.44 2q42 h TYR 57 Cb 1.38 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2q42 h TYR 57 CO 0.37 0.32 0.00 -0.40 -1.64 0.00 0.00 178.16 176.81 2q42 n ASP 58 N -4.47 0.00 0.00 -2.11 5.75 -1.26 -0.46 116.55 114.00 2q42 n ASP 58 Ca 0.07 -0.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.47 2q42 n ASP 58 Cb 0.17 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 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 -1.10 0.00 -0.18 2.11 8.25 -0.22 -3.85 115.22 120.21 2q42 n HIS 59 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 2q42 n HIS 59 Cb 0.10 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.21 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 -1.03 0.00 0.24 1.59 -2.24 -0.79 -3.43 114.28 108.63 2q42 n THR 60 Ca 0.00 -0.32 0.18 0.00 -2.27 0.00 0.00 64.05 61.63 2q42 n THR 60 Cb 0.00 1.18 0.89 0.00 -2.10 0.00 0.00 70.33 70.30 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 0.77 3.38 0.00 -0.81 -0.85 103.07 105.55 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 -0.76 0.61 0.00 0.00 0.00 176.54 176.39 2q42 n GLY 62 N -1.34 -1.23 0.31 4.60 0.00 0.05 -4.51 105.19 103.07 2q42 n GLY 62 Ca 0.00 -0.38 0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 0.41 0.31 1.61 4.21 -1.32 -2.22 115.58 118.58 2q42 h ASN 63 Ca 0.00 0.13 -0.02 0.00 1.21 0.00 0.00 56.30 57.62 2q42 h ASN 63 Cb 0.62 0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.90 2q42 h ASN 63 CO 0.00 0.09 -0.15 -0.07 -1.29 0.00 0.00 177.43 176.01 2q42 h LEU 64 N 0.49 -0.35 -1.97 1.61 3.38 -1.79 0.25 115.31 116.92 2q42 h LEU 64 Ca 0.52 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 2q42 h LEU 64 Cb 0.89 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 2q42 h LEU 64 CO -0.46 0.06 -0.05 -0.08 0.09 0.00 0.00 178.44 178.00 2q42 h GLU 65 N -0.85 0.00 0.07 1.13 4.81 -1.85 0.17 114.58 118.07 2q42 h GLU 65 Ca -0.04 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.06 2q42 h GLU 65 Cb 0.52 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.91 2q42 h GLU 65 CO 0.07 0.05 -0.56 -0.07 -0.73 0.00 0.00 179.01 177.77 2q42 h LEU 66 N 0.00 0.36 -2.09 1.64 3.38 -1.34 0.23 115.31 117.48 2q42 h LEU 66 Ca -0.00 -0.91 -0.02 0.00 0.09 0.00 0.00 57.88 57.04 2q42 h LEU 66 Cb 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2q42 h LEU 66 CO 0.01 1.24 -0.08 0.50 0.09 0.00 0.00 178.44 180.19 2q42 h LYS 67 N -0.46 0.00 0.00 1.13 3.64 -0.15 -2.40 116.57 118.33 2q42 h LYS 67 Ca -0.09 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.15 2q42 h LYS 67 Cb 1.39 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 2q42 h LYS 67 CO 0.11 0.08 -0.93 0.22 -2.27 0.00 0.00 179.45 176.65 2q42 h ASP 68 N 0.00 0.00 -0.70 4.20 1.82 -0.95 -2.07 116.42 118.72 2q42 h ASP 68 Ca -0.00 -0.37 0.13 0.00 -0.39 0.00 0.00 57.03 56.40 2q42 h ASP 68 Cb 0.24 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 40.16 2q42 h ASP 68 CO 0.01 1.22 0.26 -0.09 -1.61 0.00 0.00 179.24 179.02 2q42 h ARG 69 N -1.00 0.39 -0.02 0.28 9.65 -0.53 -2.63 114.38 120.52 2q42 h ARG 69 Ca -0.22 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.64 2q42 h ARG 69 Cb 1.01 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 2q42 h ARG 69 CO -0.13 0.26 0.00 0.66 2.80 0.00 0.00 179.97 183.56 2q42 n TYR 70 N -5.02 0.02 -2.08 2.20 4.01 -0.91 -4.95 117.16 110.43 2q42 n TYR 70 Ca 0.12 -0.02 -0.20 0.00 -0.16 0.00 0.00 57.90 57.65 2q42 n TYR 70 Cb 0.37 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.36 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 0.59 0.44 3.74 2.72 0.00 -0.79 -4.93 105.19 106.97 2q42 n GLY 71 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.87 2.42 0.18 4.61 0.00 -1.14 -4.95 121.76 120.01 2q42 s ALA 72 Ca 0.00 1.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.88 2q42 s ALA 72 Cb 0.00 -3.48 -0.07 0.00 0.00 0.00 0.00 23.12 19.57 2q42 s ALA 72 CO 0.00 -1.42 0.53 0.15 0.00 0.00 0.00 175.76 175.02 2q42 s LYS 73 N -3.47 3.86 -0.17 0.00 -0.14 -1.04 -4.49 119.74 114.29 2q42 s LYS 73 Ca 0.78 0.34 -0.07 0.00 -1.36 0.00 0.00 55.97 55.66 2q42 s LYS 73 Cb -0.32 -2.81 -0.04 0.00 -1.68 0.00 0.00 37.83 32.98 2q42 s LYS 73 CO 0.37 0.41 0.07 0.08 -0.76 0.00 0.00 175.35 175.52 2q42 s VAL 74 N -1.62 4.83 -0.23 3.17 1.01 -1.26 -1.01 120.40 125.29 2q42 s VAL 74 Ca 0.42 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.39 2q42 s VAL 74 Cb -0.13 -3.16 0.04 0.00 0.00 0.00 0.00 36.38 33.12 2q42 s VAL 74 CO 0.20 0.48 -0.13 -0.63 0.00 0.00 0.00 175.10 175.02 2q42 s ILE 75 N 0.20 2.25 0.31 2.22 -1.09 0.13 -0.43 121.20 124.79 2q42 s ILE 75 Ca 0.05 -1.28 0.07 0.00 -2.23 0.00 0.00 60.65 57.25 2q42 s ILE 75 Cb -0.12 -2.16 -0.03 0.00 -1.58 0.00 0.00 42.46 38.57 2q42 s ILE 75 CO 0.00 0.21 0.25 0.61 -1.23 0.00 0.00 174.94 174.79 2q42 n GLY 76 N 4.54 3.03 3.76 6.18 0.00 -0.71 -2.01 105.19 119.99 2q42 n GLY 76 Ca -0.17 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 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 -3.12 7.36 0.61 1.61 0.15 -1.26 -0.63 113.70 118.42 2q42 s SER 77 Ca 0.35 2.00 0.36 0.00 0.70 0.00 0.00 55.95 59.37 2q42 s SER 77 Cb 0.02 -2.60 2.00 0.00 -1.71 0.00 0.00 66.02 63.72 2q42 s SER 77 CO 0.25 -0.05 2.26 0.00 1.20 0.00 0.00 173.24 176.89 2q42 h ALA 78 N 3.60 1.21 0.38 5.45 0.00 -0.11 -3.02 119.26 126.76 2q42 h ALA 78 Ca -0.46 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2q42 h ALA 78 Cb 1.20 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2q42 h ALA 78 CO 0.66 0.03 -0.27 0.52 0.00 0.00 0.00 179.25 180.19 2q42 h MET 79 N 0.00 -0.60 -1.74 0.00 2.86 -1.86 -3.30 114.93 110.29 2q42 h MET 79 Ca -0.00 0.04 -0.68 0.00 -2.06 0.00 0.00 59.70 57.00 2q42 h MET 79 Cb 0.10 0.14 -0.34 0.00 0.06 0.00 0.00 31.60 31.56 2q42 h MET 79 CO 0.00 -0.40 0.23 -0.25 1.06 0.00 0.00 176.91 177.55 2q42 n ASP 80 N -3.99 6.23 -0.29 1.22 8.00 -1.20 -4.81 116.55 121.71 2q42 n ASP 80 Ca -0.08 -3.78 0.09 0.00 0.71 0.00 0.00 54.79 51.73 2q42 n ASP 80 Cb 0.26 -0.78 0.24 0.00 -0.02 0.00 0.00 41.12 40.82 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 2.78 0.49 0.00 -1.24 3.64 -1.62 0.30 116.57 120.93 2q42 h LYS 81 Ca 0.45 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 2q42 h LYS 81 Cb 0.46 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2q42 h LYS 81 CO 1.17 0.33 0.00 -0.25 -2.27 0.00 0.00 179.45 178.42 2q42 n ASP 82 N -4.96 0.00 -0.06 4.20 8.00 -1.26 -2.79 116.55 119.67 2q42 n ASP 82 Ca 0.18 -0.77 0.06 0.00 0.71 0.00 0.00 54.79 54.97 2q42 n ASP 82 Cb 0.50 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.55 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 -0.96 2.66 -3.18 -1.24 1.74 0.11 -4.89 116.66 110.89 2q42 n ARG 83 Ca 0.16 -0.15 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 2q42 n ARG 83 Cb 0.07 -1.11 -0.07 0.00 -1.02 0.00 0.00 32.46 30.33 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 -2.07 4.90 0.11 0.55 -1.09 -1.12 -4.83 121.20 117.65 2q42 s ILE 84 Ca 0.06 -0.19 -0.33 0.00 -2.23 0.00 0.00 60.65 57.96 2q42 s ILE 84 Cb 0.10 -4.19 -0.13 0.00 -1.58 0.00 0.00 42.46 36.66 2q42 s ILE 84 CO 0.48 -0.62 1.70 -2.65 -1.23 0.00 0.00 174.94 172.62 2q42 n PRO 85 N 6.07 2.34 -1.08 2.79 -0.02 -1.26 -2.47 135.00 141.38 2q42 n PRO 85 Ca -0.05 0.85 -0.03 0.00 -2.02 0.00 0.00 63.50 62.26 2q42 n PRO 85 Cb 0.47 -2.67 -0.01 0.00 -0.02 0.00 0.00 33.50 31.27 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 3.82 0.54 3.67 -1.23 0.00 -1.26 -4.74 105.19 105.98 2q42 n GLY 86 Ca 0.18 -0.22 -0.45 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.65 0.52 -0.01 -0.61 3.06 -1.03 -4.18 119.36 114.46 2q42 n ILE 87 Ca -0.03 -0.13 0.00 0.00 -2.50 0.00 0.00 62.75 60.10 2q42 n ILE 87 Cb 0.22 -1.49 -0.03 0.00 0.54 0.00 0.00 39.64 38.89 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 2.69 4.12 -3.81 9.51 8.00 0.43 -4.90 116.55 132.59 2q42 n ASP 88 Ca 0.14 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.45 2q42 n ASP 88 Cb 0.30 0.93 -0.17 0.00 -0.02 0.00 0.00 41.12 42.16 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 -2.19 0.46 0.65 -1.24 1.75 -0.26 -4.97 119.30 113.50 2q42 s MET 89 Ca -0.02 0.07 -0.06 0.00 -1.25 0.00 0.00 55.69 54.44 2q42 s MET 89 Cb 0.02 -0.68 0.04 0.00 2.84 0.00 0.00 34.83 37.04 2q42 s MET 89 CO 0.15 -0.18 0.96 0.00 -0.65 0.00 0.00 175.02 175.30 2q42 s ALA 90 N 1.33 3.26 -0.07 4.11 0.00 -1.26 -1.73 121.76 127.40 2q42 s ALA 90 Ca -0.05 -0.85 -0.06 0.00 0.00 0.00 0.00 51.96 51.00 2q42 s ALA 90 Cb -0.13 -2.57 0.02 0.00 0.00 0.00 0.00 23.12 20.43 2q42 s ALA 90 CO -0.02 -1.07 0.17 -0.51 0.00 0.00 0.00 175.76 174.33 2q42 s LEU 91 N -5.12 1.29 0.12 0.00 1.43 0.20 -4.80 118.68 111.80 2q42 s LEU 91 Ca 0.57 0.35 0.09 0.00 -1.03 0.00 0.00 54.13 54.11 2q42 s LEU 91 Cb -0.11 0.58 -0.04 0.00 0.03 0.00 0.00 46.19 46.65 2q42 s LEU 91 CO 0.45 -0.07 -0.16 -0.54 0.23 0.00 0.00 176.35 176.25 2q42 s LYS 92 N 0.18 1.85 0.03 1.70 1.02 -1.26 0.66 119.74 123.92 2q42 s LYS 92 Ca -0.01 -1.15 -0.35 0.00 0.02 0.00 0.00 55.97 54.48 2q42 s LYS 92 Cb -0.02 -2.15 -0.14 0.00 -0.52 0.00 0.00 37.83 35.00 2q42 s LYS 92 CO -0.00 0.48 1.64 -3.47 -0.92 0.00 0.00 175.35 173.08 2q42 n ASP 93 N 0.77 2.86 0.00 2.83 2.03 -1.26 -1.92 116.55 121.86 2q42 n ASP 93 Ca -0.15 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.22 2q42 n ASP 93 Cb 0.53 -1.34 0.00 0.00 -0.72 0.00 0.00 41.12 39.59 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 3.62 1.81 3.33 0.27 0.00 0.24 -4.98 105.19 109.47 2q42 n GLY 94 Ca 0.20 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2q42 n GLY 94 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2q42 n ASP 95 N 1.46 -2.73 -4.81 1.61 -0.08 -0.81 -4.31 116.55 106.88 2q42 n ASP 95 Ca 0.00 0.68 -0.32 0.00 -1.51 0.00 0.00 54.79 53.65 2q42 n ASP 95 Cb 0.00 -0.96 -0.06 0.00 2.34 0.00 0.00 41.12 42.43 2q42 n ASP 95 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2q42 s LYS 96 N -1.39 3.10 -0.01 -0.67 1.02 -1.26 -1.49 119.74 119.03 2q42 s LYS 96 Ca 0.61 -0.53 0.01 0.00 0.02 0.00 0.00 55.97 56.09 2q42 s LYS 96 Cb -0.48 -2.87 0.00 0.00 -0.52 0.00 0.00 37.83 33.97 2q42 s LYS 96 CO 0.62 0.62 -0.03 -0.46 -0.92 0.00 0.00 175.35 175.18 2q42 s TRP 97 N -1.32 0.35 -0.26 3.18 -0.00 0.19 -4.95 118.94 116.14 2q42 s TRP 97 Ca 0.27 -0.06 -0.10 0.00 -0.00 0.00 0.00 56.10 56.21 2q42 s TRP 97 Cb -0.12 -0.28 -0.05 0.00 -0.00 0.00 0.00 33.47 33.03 2q42 s TRP 97 CO 0.19 -0.04 0.15 -1.64 -0.00 0.00 0.00 176.95 175.61 2q42 s MET 98 N 0.19 3.95 -1.12 5.86 -1.94 -1.26 0.29 119.30 125.26 2q42 s MET 98 Ca -0.02 -0.33 -0.09 0.00 -1.71 0.00 0.00 55.69 53.55 2q42 s MET 98 Cb -0.05 -3.54 0.28 0.00 2.01 0.00 0.00 34.83 33.54 2q42 s MET 98 CO -0.00 -0.07 1.17 0.34 -0.01 0.00 0.00 175.02 176.45 2q42 n PHE 99 N 4.68 4.97 -3.36 -0.03 7.35 0.98 -4.67 117.46 127.39 2q42 n PHE 99 Ca -0.15 -3.76 -0.16 0.00 -0.76 0.00 0.00 57.45 52.61 2q42 n PHE 99 Cb 0.52 -1.68 0.08 0.00 0.35 0.00 0.00 39.48 38.75 2q42 n PHE 99 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2q42 n ALA 100 N 2.63 -2.27 0.00 3.13 0.00 -1.26 -2.93 120.51 119.81 2q42 n ALA 100 Ca 0.25 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2q42 n ALA 100 Cb 0.39 -4.13 0.00 0.00 0.00 0.00 0.00 19.45 15.70 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 -1.21 1.92 3.40 0.00 0.00 -1.26 -4.95 105.19 103.09 2q42 n GLY 101 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.37 3.02 0.17 1.61 4.02 -1.15 -5.08 115.29 115.51 2q42 s HIS 102 Ca 0.00 -0.60 -0.30 0.00 1.02 0.00 0.00 55.06 55.18 2q42 s HIS 102 Cb 0.00 -2.13 -0.07 0.00 -1.02 0.00 0.00 32.58 29.36 2q42 s HIS 102 CO 0.00 -0.37 1.07 -1.21 1.02 0.00 0.00 174.74 175.25 2q42 s GLU 103 N 1.30 4.63 -0.13 1.40 2.02 -1.26 -0.01 118.70 126.65 2q42 s GLU 103 Ca 0.04 1.66 0.02 0.00 0.02 0.00 0.00 54.97 56.71 2q42 s GLU 103 Cb -0.15 -3.30 -0.00 0.00 0.10 0.00 0.00 34.13 30.79 2q42 s GLU 103 CO 0.01 0.12 -0.19 0.08 0.02 0.00 0.00 175.26 175.30 2q42 s VAL 104 N -0.24 2.45 -0.31 2.63 1.01 0.15 -4.24 120.40 121.84 2q42 s VAL 104 Ca 0.48 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 2q42 s VAL 104 Cb -0.28 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.11 2q42 s VAL 104 CO 0.34 0.54 0.13 -1.00 0.00 0.00 0.00 175.10 175.10 2q42 s HIS 105 N 0.54 3.17 0.15 5.22 0.09 -0.34 -0.63 115.29 123.50 2q42 s HIS 105 Ca -0.12 -0.81 -0.30 0.00 -0.00 0.00 0.00 55.06 53.83 2q42 s HIS 105 Cb -0.16 -2.32 -0.07 0.00 -0.00 0.00 0.00 32.58 30.03 2q42 s HIS 105 CO 0.04 -0.53 1.07 0.08 -0.00 0.00 0.00 174.74 175.39 2q42 s VAL 106 N 1.55 4.06 -0.17 -0.90 1.01 -0.56 -2.22 120.40 123.18 2q42 s VAL 106 Ca 0.03 1.73 -0.00 0.00 0.00 0.00 0.00 61.98 63.75 2q42 s VAL 106 Cb -0.17 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 32.14 2q42 s VAL 106 CO 0.05 0.28 -0.08 -0.04 0.00 0.00 0.00 175.10 175.30 2q42 s MET 107 N -0.16 1.70 0.02 2.72 -1.94 -0.67 0.79 119.30 121.77 2q42 s MET 107 Ca 0.49 -0.59 -0.30 0.00 -1.71 0.00 0.00 55.69 53.58 2q42 s MET 107 Cb -0.28 -2.09 -0.06 0.00 2.01 0.00 0.00 34.83 34.40 2q42 s MET 107 CO 0.33 -0.40 1.49 -0.51 -0.01 0.00 0.00 175.02 175.92 2q42 s ASP 108 N 1.56 6.76 -0.46 3.03 1.11 -1.26 -0.49 116.67 126.91 2q42 s ASP 108 Ca 0.01 2.24 0.06 0.00 0.18 0.00 0.00 52.55 55.04 2q42 s ASP 108 Cb -0.15 -2.56 0.22 0.00 1.07 0.00 0.00 42.92 41.50 2q42 s ASP 108 CO -0.08 -0.78 0.50 0.35 1.18 0.00 0.00 175.17 176.34 2q42 n THR 109 N 4.69 -0.15 -2.27 -1.27 -2.24 0.17 -4.90 114.28 108.32 2q42 n THR 109 Ca 0.14 -4.11 -0.35 0.00 -2.27 0.00 0.00 64.05 57.46 2q42 n THR 109 Cb 0.43 -1.92 0.00 0.00 -2.10 0.00 0.00 70.33 66.74 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 -1.06 3.39 0.00 -0.78 0.04 -1.24 -4.24 135.00 131.11 2q42 s PRO 110 Ca 0.34 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.99 2q42 s PRO 110 Cb 0.11 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2q42 s PRO 110 CO -0.13 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.50 2q42 n GLY 111 N 0.16 -0.12 0.21 0.56 0.00 -1.26 -3.54 105.19 101.20 2q42 n GLY 111 Ca 0.11 0.19 -0.08 0.00 0.00 0.00 0.00 46.02 46.25 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 0.67 -3.05 1.61 -0.00 -1.83 0.57 115.15 113.11 2q42 h HIS 112 Ca 0.00 -0.01 -0.25 0.00 -0.00 0.00 0.00 60.37 60.11 2q42 h HIS 112 Cb 0.00 -0.22 -0.33 0.00 -0.00 0.00 0.00 27.41 26.86 2q42 h HIS 112 CO 0.00 0.48 -0.58 0.95 -0.00 0.00 0.00 177.93 178.79 2q42 s THR 113 N -5.90 -0.22 -0.56 6.26 -4.23 -1.26 -3.08 115.64 106.64 2q42 s THR 113 Ca -0.13 0.27 -0.26 0.00 -1.18 0.00 0.00 61.69 60.39 2q42 s THR 113 Cb 0.12 -0.33 -0.06 0.00 1.34 0.00 0.00 72.50 73.56 2q42 s THR 113 CO 0.75 0.11 2.26 -0.54 -0.54 0.00 0.00 174.62 176.67 2q42 s LYS 114 N 1.93 2.19 0.00 3.99 1.02 -1.26 0.38 119.74 127.99 2q42 s LYS 114 Ca -0.02 1.07 0.00 0.00 0.02 0.00 0.00 55.97 57.05 2q42 s LYS 114 Cb -0.12 -4.57 0.00 0.00 -0.52 0.00 0.00 37.83 32.62 2q42 s LYS 114 CO -0.07 -3.26 0.00 0.41 -0.92 0.00 0.00 175.35 171.51 2q42 n GLY 115 N 6.03 0.06 3.77 -3.33 0.00 -1.26 -4.79 105.19 105.67 2q42 n GLY 115 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 2.81 0.19 1.61 5.04 0.16 -4.71 115.29 120.39 2q42 s HIS 116 Ca 0.00 1.24 0.09 0.00 -1.54 0.00 0.00 55.06 54.85 2q42 s HIS 116 Cb 0.00 -3.87 -0.04 0.00 0.04 0.00 0.00 32.58 28.70 2q42 s HIS 116 CO 0.00 -2.54 -0.17 0.96 -2.34 0.00 0.00 174.74 170.65 2q42 s ILE 117 N -0.99 1.87 0.17 0.89 -4.36 -0.13 0.46 121.20 119.11 2q42 s ILE 117 Ca 0.52 -2.07 0.11 0.00 -0.26 0.00 0.00 60.65 58.95 2q42 s ILE 117 Cb -0.43 -1.96 -0.04 0.00 1.25 0.00 0.00 42.46 41.27 2q42 s ILE 117 CO 0.57 -0.42 -0.21 -0.44 0.24 0.00 0.00 174.94 174.68 2q42 s SER 118 N -2.98 3.61 -0.22 4.36 0.01 0.35 -4.65 113.70 114.18 2q42 s SER 118 Ca 0.20 -0.76 0.02 0.00 1.31 0.00 0.00 55.95 56.72 2q42 s SER 118 Cb -0.04 -0.36 0.04 0.00 0.21 0.00 0.00 66.02 65.87 2q42 s SER 118 CO 0.08 0.14 -0.16 -0.76 0.41 0.00 0.00 173.24 172.95 2q42 s LEU 119 N -2.51 2.75 -0.24 2.44 1.43 -0.12 -1.66 118.68 120.76 2q42 s LEU 119 Ca 0.20 -0.99 -0.08 0.00 -1.03 0.00 0.00 54.13 52.22 2q42 s LEU 119 Cb -0.09 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 2q42 s LEU 119 CO 0.10 -0.09 0.10 -0.47 0.23 0.00 0.00 176.35 176.23 2q42 s TYR 120 N 1.20 3.17 -0.62 0.29 5.04 -0.94 -0.59 117.35 124.91 2q42 s TYR 120 Ca -0.01 -0.12 -0.07 0.00 -2.44 0.00 0.00 57.07 54.43 2q42 s TYR 120 Cb -0.16 -2.24 0.16 0.00 0.35 0.00 0.00 41.96 40.07 2q42 s TYR 120 CO -0.09 -0.15 0.47 -0.06 -1.34 0.00 0.00 175.55 174.38 2q42 s PHE 121 N 1.30 3.50 0.32 4.97 0.08 -0.13 -1.20 117.98 126.83 2q42 s PHE 121 Ca 0.06 -2.35 0.03 0.00 0.12 0.00 0.00 56.93 54.78 2q42 s PHE 121 Cb -0.15 -3.40 0.61 0.00 -0.57 0.00 0.00 43.02 39.51 2q42 s PHE 121 CO 0.05 -0.92 1.93 -1.00 -0.10 0.00 0.00 175.22 175.18 2q42 h PRO 122 N 7.59 0.90 0.00 0.24 0.13 -1.80 -1.47 132.00 137.58 2q42 h PRO 122 Ca -0.04 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2q42 h PRO 122 Cb 1.00 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2q42 h PRO 122 CO 0.75 0.60 0.00 0.78 -0.23 0.00 0.00 178.00 179.90 2q42 h GLY 123 N 0.93 0.00 -0.60 1.56 0.00 -1.92 -1.84 103.07 101.20 2q42 h GLY 123 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2q42 h GLY 123 CO -0.13 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.85 2q42 n SER 124 N -2.47 2.20 -3.79 0.19 7.64 -0.62 -4.92 113.62 111.85 2q42 n SER 124 Ca 0.00 -1.79 -0.31 0.00 1.01 0.00 0.00 58.87 57.78 2q42 n SER 124 Cb 0.16 -0.09 0.02 0.00 -1.01 0.00 0.00 64.21 63.29 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 0.11 -1.02 -3.49 1.43 1.74 -0.69 -4.83 116.66 109.90 2q42 n ARG 125 Ca 0.05 0.53 -0.15 0.00 -0.77 0.00 0.00 57.85 57.51 2q42 n ARG 125 Cb 0.29 -3.14 -0.04 0.00 -1.02 0.00 0.00 32.46 28.54 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 -3.28 -1.63 -0.07 7.54 0.00 -1.12 -0.30 121.76 122.90 2q42 s ALA 126 Ca 0.28 0.88 -0.03 0.00 0.00 0.00 0.00 51.96 53.09 2q42 s ALA 126 Cb -0.13 0.40 0.04 0.00 0.00 0.00 0.00 23.12 23.43 2q42 s ALA 126 CO 0.90 -0.54 0.16 -1.50 0.00 0.00 0.00 175.76 174.77 2q42 s ILE 127 N -2.37 -0.11 -0.42 0.00 2.07 0.46 -0.96 121.20 119.88 2q42 s ILE 127 Ca -0.06 0.23 -0.25 0.00 -1.41 0.00 0.00 60.65 59.16 2q42 s ILE 127 Cb -0.01 -0.26 0.02 0.00 0.13 0.00 0.00 42.46 42.34 2q42 s ILE 127 CO -0.01 0.09 0.89 -0.36 -1.91 0.00 0.00 174.94 173.65 2q42 s PHE 128 N 1.48 3.00 -2.62 3.50 0.08 0.24 -1.08 117.98 122.60 2q42 s PHE 128 Ca -0.06 0.52 0.23 0.00 0.12 0.00 0.00 56.93 57.74 2q42 s PHE 128 Cb -0.12 -3.76 0.34 0.00 -0.57 0.00 0.00 43.02 38.91 2q42 s PHE 128 CO -0.06 -0.95 1.34 0.25 -0.10 0.00 0.00 175.22 175.70 2q42 n THR 129 N 6.17 0.33 0.00 0.64 -2.24 -1.05 -0.95 114.28 117.19 2q42 n THR 129 Ca 0.06 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2q42 n THR 129 Cb 0.48 1.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 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 1.43 3.26 1.67 3.38 0.00 -1.26 -0.94 105.19 112.73 2q42 n GLY 130 Ca 0.17 -0.06 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 3.65 3.24 -0.06 1.61 9.92 -1.26 0.04 116.55 133.69 2q42 n ASP 131 Ca 0.00 -3.64 -0.03 0.00 -0.53 0.00 0.00 54.79 50.59 2q42 n ASP 131 Cb 0.00 -0.73 -0.01 0.00 -0.64 0.00 0.00 41.12 39.74 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 1.16 0.00 -3.30 -3.53 2.02 -1.39 -2.04 112.91 105.83 2q42 h THR 132 Ca 0.39 -0.89 -0.67 0.00 0.77 0.00 0.00 66.41 66.01 2q42 h THR 132 Cb 2.22 0.00 -0.31 0.00 -1.74 0.00 0.00 68.15 68.32 2q42 h THR 132 CO 0.71 0.00 -0.84 -0.32 0.37 0.00 0.00 175.52 175.45 2q42 s MET 133 N -1.93 3.15 0.32 6.66 -2.45 -1.24 -1.54 119.30 122.27 2q42 s MET 133 Ca -0.09 -0.80 0.08 0.00 -1.25 0.00 0.00 55.69 53.62 2q42 s MET 133 Cb 0.01 -2.47 -0.03 0.00 1.25 0.00 0.00 34.83 33.59 2q42 s MET 133 CO 0.14 0.11 0.22 -0.06 1.05 0.00 0.00 175.02 176.49 2q42 s PHE 134 N 0.54 2.89 -0.09 4.11 0.08 -0.25 -4.53 117.98 120.73 2q42 s PHE 134 Ca -0.12 -0.28 -0.29 0.00 0.12 0.00 0.00 56.93 56.36 2q42 s PHE 134 Cb -0.16 -1.65 -0.05 0.00 -0.57 0.00 0.00 43.02 40.58 2q42 s PHE 134 CO 0.04 0.31 1.67 0.45 -0.10 0.00 0.00 175.22 177.59 2q42 s SER 135 N -3.92 6.56 -0.61 1.36 0.15 -1.26 -2.22 113.70 113.76 2q42 s SER 135 Ca 0.38 2.11 0.00 0.00 0.70 0.00 0.00 55.95 59.14 2q42 s SER 135 Cb -0.05 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2q42 s SER 135 CO 0.25 -1.04 0.00 0.18 1.20 0.00 0.00 173.24 173.83 2q42 n LEU 136 N 7.58 -0.87 0.00 3.45 4.77 -1.26 -4.24 117.00 126.44 2q42 n LEU 136 Ca 0.18 0.08 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 2q42 n LEU 136 Cb 0.43 -1.23 0.02 0.00 -2.33 0.00 0.00 43.42 40.30 2q42 n LEU 136 CO 0.63 -0.20 0.52 -1.20 -1.33 0.00 0.00 177.39 175.80 2q42 n SER 137 N 0.88 -1.22 -4.21 -1.43 7.64 -0.94 -4.64 113.62 109.70 2q42 n SER 137 Ca -0.07 -1.68 -0.12 0.00 1.01 0.00 0.00 58.87 58.01 2q42 n SER 137 Cb 0.38 1.99 -0.10 0.00 -1.01 0.00 0.00 64.21 65.47 2q42 n SER 137 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2q42 s GLY 139 N -3.14 2.90 0.52 0.00 0.00 -0.59 -4.81 107.32 102.20 2q42 s GLY 139 Ca 0.30 1.18 -0.21 0.00 0.00 0.00 0.00 44.72 45.99 2q42 s GLY 139 CO 0.07 1.88 0.92 0.28 0.00 0.00 0.00 173.10 176.25 2q42 n LYS 140 N 1.19 1.04 -2.92 2.90 5.02 -1.26 -4.67 118.16 119.46 2q42 n LYS 140 Ca 0.01 0.39 -0.44 0.00 -2.02 0.00 0.00 58.31 56.25 2q42 n LYS 140 Cb 0.42 -2.04 -0.02 0.00 -0.02 0.00 0.00 35.03 33.37 2q42 n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2q42 s LEU 141 N -0.95 5.03 0.03 -0.35 1.43 -1.26 -4.16 118.68 118.45 2q42 s LEU 141 Ca 0.69 -2.19 -0.16 0.00 -1.03 0.00 0.00 54.13 51.44 2q42 s LEU 141 Cb -0.48 -2.40 -0.34 0.00 0.03 0.00 0.00 46.19 42.99 2q42 s LEU 141 CO 0.52 -1.02 1.02 -0.26 0.23 0.00 0.00 176.35 176.84 2q42 h PHE 142 N 8.58 0.98 0.00 0.29 0.04 -1.62 -3.42 116.94 121.78 2q42 h PHE 142 Ca 0.18 -0.69 -0.06 0.00 2.80 0.00 0.00 57.97 60.20 2q42 h PHE 142 Cb 1.00 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 39.09 2q42 h PHE 142 CO 1.16 1.53 -1.23 0.39 -0.60 0.00 0.00 178.31 179.56 2q42 n GLU 143 N -3.76 0.38 -0.09 1.51 1.02 -1.11 -5.03 120.64 113.55 2q42 n GLU 143 Ca -0.16 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2q42 n GLU 143 Cb 1.07 -1.08 0.00 0.00 -0.02 0.00 0.00 31.44 31.40 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 3.27 -0.54 3.55 0.62 0.00 0.20 -4.77 105.19 107.50 2q42 n GLY 144 Ca -0.07 -1.72 -0.26 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.31 2.00 0.39 2.61 -4.23 -1.26 -4.91 115.64 109.93 2q42 s THR 145 Ca 0.00 -2.11 0.06 0.00 -1.18 0.00 0.00 61.69 58.46 2q42 s THR 145 Cb 0.00 -2.75 0.28 0.00 1.34 0.00 0.00 72.50 71.37 2q42 s THR 145 CO 0.00 -0.14 2.02 -0.65 -0.54 0.00 0.00 174.62 175.31 2q42 h PRO 146 N 1.98 0.64 -0.44 3.99 0.11 -1.97 -1.27 132.00 135.05 2q42 h PRO 146 Ca -0.42 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 2q42 h PRO 146 Cb 1.24 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2q42 h PRO 146 CO 0.73 0.43 -0.01 -0.22 -0.21 0.00 0.00 178.00 178.72 2q42 h LYS 147 N 0.66 0.78 -0.30 1.05 3.64 -1.96 -1.38 116.57 119.07 2q42 h LYS 147 Ca 0.22 -0.25 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 2q42 h LYS 147 Cb 0.07 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2q42 h LYS 147 CO -0.06 0.85 0.03 1.96 -2.27 0.00 0.00 179.45 179.96 2q42 h GLN 148 N 0.62 0.50 -0.69 1.90 4.20 -1.74 -2.16 115.11 117.74 2q42 h GLN 148 Ca 0.12 -0.14 0.01 0.00 0.06 0.00 0.00 58.65 58.70 2q42 h GLN 148 Cb 0.51 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 2q42 h GLN 148 CO 0.02 0.62 0.45 1.98 -0.67 0.00 0.00 178.83 181.24 2q42 h MET 149 N 0.31 0.89 -0.47 1.46 4.05 -1.20 0.14 114.93 120.11 2q42 h MET 149 Ca 0.09 -0.05 0.01 0.00 -0.28 0.00 0.00 59.70 59.47 2q42 h MET 149 Cb 0.37 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 2q42 h MET 149 CO 0.01 0.59 0.29 1.25 0.23 0.00 0.00 176.91 179.28 2q42 h LEU 150 N 0.91 0.49 -0.94 3.39 5.85 -1.08 0.27 115.31 124.20 2q42 h LEU 150 Ca 0.26 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.95 2q42 h LEU 150 Cb -0.08 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2q42 h LEU 150 CO -0.07 0.35 0.39 0.00 -0.34 0.00 0.00 178.44 178.77 2q42 h ALA 151 N 1.20 1.17 -0.63 1.25 0.00 -0.88 -0.11 119.26 121.26 2q42 h ALA 151 Ca 0.18 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2q42 h ALA 151 Cb -0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2q42 h ALA 151 CO -0.07 0.63 0.05 0.77 0.00 0.00 0.00 179.25 180.63 2q42 h SER 152 N 1.14 1.05 -0.35 0.00 0.02 0.14 -0.49 113.55 115.05 2q42 h SER 152 Ca 0.28 -0.29 -0.13 0.00 -0.84 0.00 0.00 61.79 60.81 2q42 h SER 152 Cb 0.11 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2q42 h SER 152 CO -0.04 1.08 -0.26 -0.07 -1.14 0.00 0.00 176.83 176.40 2q42 h LEU 153 N 0.99 0.89 -1.21 5.07 3.38 -0.49 -2.21 115.31 121.73 2q42 h LEU 153 Ca 0.19 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 2q42 h LEU 153 Cb 0.51 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2q42 h LEU 153 CO 0.02 1.10 -0.37 1.56 0.09 0.00 0.00 178.44 180.84 2q42 h GLN 154 N 0.74 0.00 -0.14 1.13 4.20 -0.81 0.12 115.11 120.35 2q42 h GLN 154 Ca 0.09 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.70 2q42 h GLN 154 Cb 0.80 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 2q42 h GLN 154 CO 0.07 0.37 -0.37 0.87 -0.67 0.00 0.00 178.83 179.10 2q42 h LYS 155 N 0.00 0.30 0.07 1.46 1.57 -0.66 -2.18 116.57 117.13 2q42 h LYS 155 Ca -0.00 -0.13 -0.14 0.00 -1.87 0.00 0.00 60.65 58.50 2q42 h LYS 155 Cb 0.72 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.04 2q42 h LYS 155 CO 0.05 0.63 -0.60 0.82 -0.57 0.00 0.00 179.45 179.79 2q42 h ILE 156 N 0.26 1.52 0.00 1.86 2.04 -0.85 -3.32 117.51 119.02 2q42 h ILE 156 Ca 0.03 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.58 2q42 h ILE 156 Cb 0.77 2.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.84 2q42 h ILE 156 CO 0.06 0.65 0.00 0.35 0.00 0.00 0.00 178.15 179.21 2q42 n THR 157 N -4.25 0.69 0.18 -0.27 -2.24 0.37 -1.95 114.28 106.81 2q42 n THR 157 Ca -0.12 0.14 0.07 0.00 -2.27 0.00 0.00 64.05 61.87 2q42 n THR 157 Cb 0.70 -0.87 0.13 0.00 -2.10 0.00 0.00 70.33 68.19 2q42 n THR 157 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2q42 h SER 158 N 0.00 0.00 -3.28 3.42 4.64 -1.49 -3.45 113.55 113.40 2q42 h SER 158 Ca 0.00 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.89 2q42 h SER 158 Cb 0.37 0.00 0.21 0.00 -0.31 0.00 0.00 62.40 62.67 2q42 h SER 158 CO 0.00 0.28 0.02 -0.76 -0.87 0.00 0.00 176.83 175.50 2q42 s LEU 159 N -6.39 0.77 0.74 5.97 1.43 -0.82 -4.89 118.68 115.48 2q42 s LEU 159 Ca 0.05 1.43 -0.16 0.00 -1.03 0.00 0.00 54.13 54.41 2q42 s LEU 159 Cb 0.07 -3.33 -0.06 0.00 0.03 0.00 0.00 46.19 42.90 2q42 s LEU 159 CO 0.70 -4.18 0.32 -2.65 0.23 0.00 0.00 176.35 170.77 2q42 n PRO 160 N -4.89 0.20 0.07 1.29 -0.02 -1.26 -4.89 135.00 125.50 2q42 n PRO 160 Ca 0.03 0.10 -0.02 0.00 -2.02 0.00 0.00 63.50 61.58 2q42 n PRO 160 Cb 0.55 -1.65 0.22 0.00 -0.02 0.00 0.00 33.50 32.59 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 -0.46 0.31 -0.28 2.55 5.19 -1.90 -2.69 116.42 119.14 2q42 h ASP 161 Ca -0.45 -0.12 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 2q42 h ASP 161 Cb 1.35 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2q42 h ASP 161 CO 0.40 0.67 0.00 -0.90 -3.12 0.00 0.00 179.24 176.29 2q42 n ASP 162 N -4.05 1.62 -4.67 6.45 5.75 -1.26 -0.97 116.55 119.41 2q42 n ASP 162 Ca -0.01 -2.02 -0.34 0.00 -0.01 0.00 0.00 54.79 52.40 2q42 n ASP 162 Cb 0.46 -0.21 0.11 0.00 -1.03 0.00 0.00 41.12 40.45 2q42 n ASP 162 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 2q42 n THR 163 N 0.34 2.43 -3.80 2.12 -1.04 -1.02 -4.84 114.28 108.47 2q42 n THR 163 Ca 0.10 -0.27 -0.35 0.00 -2.04 0.00 0.00 64.05 61.49 2q42 n THR 163 Cb 0.26 -1.20 -0.05 0.00 -1.82 0.00 0.00 70.33 67.53 2q42 n THR 163 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2q42 s SER 164 N -1.95 6.46 -0.24 8.00 0.15 0.59 -3.33 113.70 123.38 2q42 s SER 164 Ca 0.74 0.50 0.02 0.00 0.70 0.00 0.00 55.95 57.91 2q42 s SER 164 Cb -0.31 -2.07 0.06 0.00 -1.71 0.00 0.00 66.02 61.99 2q42 s SER 164 CO 0.50 0.27 -0.08 -0.63 1.20 0.00 0.00 173.24 174.50 2q42 s ILE 165 N -1.28 1.77 -0.55 6.45 1.01 -0.95 0.18 121.20 127.83 2q42 s ILE 165 Ca 0.26 -1.35 -0.11 0.00 0.00 0.00 0.00 60.65 59.45 2q42 s ILE 165 Cb -0.13 -1.96 0.14 0.00 0.01 0.00 0.00 42.46 40.52 2q42 s ILE 165 CO 0.16 -0.05 0.46 -0.31 0.00 0.00 0.00 174.94 175.19 2q42 s TYR 166 N 1.29 3.42 0.30 3.97 2.02 -0.24 -1.59 117.35 126.52 2q42 s TYR 166 Ca -0.07 -1.79 -0.29 0.00 -0.37 0.00 0.00 57.07 54.56 2q42 s TYR 166 Cb -0.19 -3.61 -0.10 0.00 -0.40 0.00 0.00 41.96 37.66 2q42 s TYR 166 CO -0.06 -0.99 1.28 0.00 -1.57 0.00 0.00 175.55 174.21 2q42 h GLY 168 N 3.85 0.00 -3.26 0.00 0.00 -0.63 -3.43 103.07 99.60 2q42 h GLY 168 Ca -0.48 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.75 2q42 h GLY 168 CO 0.68 0.00 -0.50 0.30 0.00 0.00 0.00 176.54 177.03 2q42 s HIS 169 N -3.98 0.29 -1.15 5.60 3.76 -1.26 -1.95 115.29 116.60 2q42 s HIS 169 Ca -0.02 -0.75 -0.09 0.00 -0.15 0.00 0.00 55.06 54.04 2q42 s HIS 169 Cb 0.11 -0.19 0.25 0.00 1.11 0.00 0.00 32.58 33.87 2q42 s HIS 169 CO 0.51 -0.47 1.31 -1.91 -0.85 0.00 0.00 174.74 173.32 2q42 n GLU 170 N 0.07 3.65 0.00 1.40 4.07 -0.44 -4.66 120.64 124.74 2q42 n GLU 170 Ca -0.15 -4.26 0.03 0.00 -0.06 0.00 0.00 57.16 52.72 2q42 n GLU 170 Cb 0.62 -2.69 0.02 0.00 -0.06 0.00 0.00 31.44 29.32 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 3.30 0.00 -0.34 4.31 4.01 -1.26 -4.81 117.16 122.37 2q42 n TYR 171 Ca 0.29 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 58.20 2q42 n TYR 171 Cb 0.39 0.00 0.40 0.00 -0.31 0.00 0.00 39.34 39.82 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 1.12 0.55 -0.03 -0.72 2.02 -1.83 0.23 112.91 114.26 2q42 h THR 172 Ca 0.00 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2q42 h THR 172 Cb 0.24 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 66.58 2q42 h THR 172 CO 0.00 0.10 -0.02 0.25 0.37 0.00 0.00 175.52 176.23 2q42 h LEU 173 N 0.57 0.06 -0.46 2.58 5.85 -1.90 0.82 115.31 122.83 2q42 h LEU 173 Ca 0.63 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 2q42 h LEU 173 Cb 1.23 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 2q42 h LEU 173 CO -0.44 0.50 0.18 0.77 -0.34 0.00 0.00 178.44 179.11 2q42 h SER 174 N -0.38 0.64 -0.11 1.25 4.64 -1.68 -2.39 113.55 115.52 2q42 h SER 174 Ca 0.01 -0.17 -0.10 0.00 -0.47 0.00 0.00 61.79 61.06 2q42 h SER 174 Cb 0.48 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 2q42 h SER 174 CO 0.00 0.64 -0.23 0.78 -0.87 0.00 0.00 176.83 177.15 2q42 h ASN 175 N 0.61 0.55 0.43 4.97 2.35 -0.54 -2.64 115.58 121.31 2q42 h ASN 175 Ca 0.15 -0.18 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 2q42 h ASN 175 Cb 0.20 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2q42 h ASN 175 CO -0.01 0.78 -0.23 -1.28 -1.65 0.00 0.00 177.43 175.04 2q42 h SER 176 N 0.48 0.00 -0.01 5.81 0.87 0.12 -2.83 113.55 117.99 2q42 h SER 176 Ca 0.07 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2q42 h SER 176 Cb 0.66 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2q42 h SER 176 CO 0.05 0.23 -0.01 0.11 -0.53 0.00 0.00 176.83 176.68 2q42 h LYS 177 N 0.00 0.03 -0.62 2.24 1.57 -1.08 -1.93 116.57 116.77 2q42 h LYS 177 Ca -0.00 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.86 2q42 h LYS 177 Cb 0.51 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.74 2q42 h LYS 177 CO 0.03 0.50 0.25 0.35 -0.57 0.00 0.00 179.45 180.01 2q42 h PHE 178 N -0.45 0.43 -0.97 -1.35 3.57 -1.56 0.21 116.94 116.84 2q42 h PHE 178 Ca 0.00 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.55 2q42 h PHE 178 Cb 0.50 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 39.08 2q42 h PHE 178 CO 0.09 0.12 0.64 0.00 -2.23 0.00 0.00 178.31 176.93 2q42 h ALA 179 N 1.42 1.34 0.00 2.41 0.00 -1.47 -0.53 119.26 122.43 2q42 h ALA 179 Ca 0.31 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2q42 h ALA 179 Cb 0.38 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2q42 h ALA 179 CO -0.30 0.60 -0.11 -0.07 0.00 0.00 0.00 179.25 179.37 2q42 h LEU 180 N 1.28 0.00 -0.38 0.00 3.38 0.20 0.87 115.31 120.65 2q42 h LEU 180 Ca 0.36 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.16 2q42 h LEU 180 Cb -0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2q42 h LEU 180 CO -0.09 0.11 -0.81 0.28 0.09 0.00 0.00 178.44 178.02 2q42 h SER 181 N 0.00 0.02 0.58 -0.43 0.02 0.09 -3.12 113.55 110.70 2q42 h SER 181 Ca -0.00 -0.02 -0.20 0.00 -0.84 0.00 0.00 61.79 60.73 2q42 h SER 181 Cb 0.28 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 2q42 h SER 181 CO 0.01 0.82 -1.57 0.18 -1.14 0.00 0.00 176.83 175.13 2q42 n LEU 182 N -3.59 0.76 -3.15 5.07 4.77 -0.33 -4.65 117.00 115.88 2q42 n LEU 182 Ca -0.01 0.34 -0.18 0.00 -0.03 0.00 0.00 56.01 56.13 2q42 n LEU 182 Cb 0.78 0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.96 2q42 n LEU 182 CO 0.45 0.21 -0.19 1.21 -1.33 0.00 0.00 177.39 177.73 2q42 n GLU 183 N -2.88 0.91 0.32 3.23 2.13 0.15 -3.65 120.64 120.86 2q42 n GLU 183 Ca -0.13 -3.20 0.21 0.00 0.66 0.00 0.00 57.16 54.71 2q42 n GLU 183 Cb 0.89 -1.54 1.10 0.00 0.27 0.00 0.00 31.44 32.16 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 3.26 0.00 0.00 5.31 0.13 -1.74 -2.46 132.00 136.49 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 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2q42 h PRO 184 CO 0.46 0.00 -0.25 -0.91 -0.23 0.00 0.00 178.00 177.07 2q42 h ASN 185 N 0.00 0.00 -2.56 1.44 4.21 -1.92 -3.43 115.58 113.32 2q42 h ASN 185 Ca 0.00 -0.03 -0.55 0.00 1.21 0.00 0.00 56.30 56.93 2q42 h ASN 185 Cb 0.11 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.27 2q42 h ASN 185 CO 0.00 0.02 1.26 0.21 -1.29 0.00 0.00 177.43 177.63 2q42 s ASN 186 N -5.28 5.78 0.38 5.81 3.84 -0.93 -4.81 114.94 119.73 2q42 s ASN 186 Ca 0.07 0.92 0.26 0.00 0.21 0.00 0.00 52.86 54.32 2q42 s ASN 186 Cb 0.09 -2.53 0.70 0.00 -0.55 0.00 0.00 41.25 38.96 2q42 s ASN 186 CO 0.67 -1.87 1.73 -0.33 -2.79 0.00 0.00 177.10 174.52 2q42 h GLU 187 N 13.13 0.00 -0.19 0.43 5.08 -1.89 -2.60 114.58 128.54 2q42 h GLU 187 Ca -0.30 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 57.88 2q42 h GLU 187 Cb 1.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 2q42 h GLU 187 CO 1.10 0.00 -0.61 0.28 -1.00 0.00 0.00 179.01 178.78 2q42 h VAL 188 N 0.00 1.31 -0.70 3.13 2.07 -1.90 -2.06 116.25 118.09 2q42 h VAL 188 Ca 0.00 -1.85 -0.07 0.00 0.82 0.00 0.00 66.70 65.59 2q42 h VAL 188 Cb 0.79 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 2q42 h VAL 188 CO 0.00 0.58 0.15 0.25 0.02 0.00 0.00 177.57 178.58 2q42 h LEU 189 N 0.49 1.08 -0.53 2.57 5.85 -1.74 -0.13 115.31 122.89 2q42 h LEU 189 Ca -0.00 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.48 2q42 h LEU 189 Cb 1.19 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 2q42 h LEU 189 CO 0.12 1.05 0.35 1.56 -0.34 0.00 0.00 178.44 181.18 2q42 h GLN 190 N 1.08 0.70 0.06 1.25 4.20 -1.29 0.26 115.11 121.36 2q42 h GLN 190 Ca 0.22 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 2q42 h GLN 190 Cb 0.40 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2q42 h GLN 190 CO 0.01 0.47 -0.03 1.03 -0.67 0.00 0.00 178.83 179.64 2q42 h SER 191 N 0.72 -0.07 -0.67 1.46 0.87 -1.08 -1.56 113.55 113.23 2q42 h SER 191 Ca 0.19 -0.17 -0.06 0.00 -1.23 0.00 0.00 61.79 60.53 2q42 h SER 191 Cb -0.08 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 2q42 h SER 191 CO -0.04 0.13 0.18 0.22 -0.53 0.00 0.00 176.83 176.79 2q42 h TYR 192 N -0.26 1.11 -0.39 2.24 3.20 -0.82 -1.26 116.97 120.78 2q42 h TYR 192 Ca -0.01 -0.12 0.03 0.00 3.14 0.00 0.00 58.73 61.77 2q42 h TYR 192 Cb 0.23 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 2q42 h TYR 192 CO -0.01 0.91 0.19 0.00 -1.64 0.00 0.00 178.16 177.60 2q42 h ALA 193 N 1.08 0.49 -0.78 1.82 0.00 -0.40 -0.06 119.26 121.40 2q42 h ALA 193 Ca 0.21 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2q42 h ALA 193 Cb 0.34 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2q42 h ALA 193 CO -0.00 -0.18 0.47 0.00 0.00 0.00 0.00 179.25 179.53 2q42 h ALA 194 N 1.22 0.99 -0.51 0.00 0.00 -0.84 0.13 119.26 120.25 2q42 h ALA 194 Ca 0.17 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2q42 h ALA 194 Cb 0.09 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2q42 h ALA 194 CO -0.13 0.46 0.27 1.25 0.00 0.00 0.00 179.25 181.10 2q42 h HIS 195 N 1.06 0.49 -0.12 0.00 6.17 -0.42 -0.93 115.15 121.41 2q42 h HIS 195 Ca 0.28 0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.37 2q42 h HIS 195 Cb -0.04 -0.15 -0.01 0.00 2.52 0.00 0.00 27.41 29.74 2q42 h HIS 195 CO -0.01 0.25 0.04 0.28 0.71 0.00 0.00 177.93 179.20 2q42 h VAL 196 N 0.52 1.16 -1.00 5.26 2.07 -0.44 -1.16 116.25 122.66 2q42 h VAL 196 Ca 0.22 -0.50 0.16 0.00 0.82 0.00 0.00 66.70 67.40 2q42 h VAL 196 Cb 0.12 1.28 -0.10 0.00 -1.52 0.00 0.00 31.29 31.07 2q42 h VAL 196 CO -0.15 0.15 0.62 0.00 0.02 0.00 0.00 177.57 178.21 2q42 h ALA 197 N 0.87 1.62 -0.25 1.67 0.00 -0.26 0.15 119.26 123.05 2q42 h ALA 197 Ca 0.04 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2q42 h ALA 197 Cb 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2q42 h ALA 197 CO -0.00 0.07 -0.07 0.93 0.00 0.00 0.00 179.25 180.18 2q42 h GLU 198 N 0.87 0.48 -0.10 0.00 5.08 -0.89 -2.22 114.58 117.80 2q42 h GLU 198 Ca 0.54 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.72 2q42 h GLU 198 Cb 0.71 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2q42 h GLU 198 CO -0.32 0.71 0.02 -0.07 -1.00 0.00 0.00 179.01 178.35 2q42 h LEU 199 N 0.22 0.01 -1.69 1.33 3.38 0.09 -1.64 115.31 117.00 2q42 h LEU 199 Ca 0.06 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2q42 h LEU 199 Cb 0.54 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2q42 h LEU 199 CO 0.03 0.02 0.00 0.03 0.09 0.00 0.00 178.44 178.61 2q42 h ARG 200 N 0.07 0.00 0.00 1.13 2.47 -0.78 0.18 114.38 117.45 2q42 h ARG 200 Ca 0.05 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.69 2q42 h ARG 200 Cb 0.04 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.35 2q42 h ARG 200 CO -0.06 0.00 -0.34 0.77 0.56 0.00 0.00 179.97 180.90 2q42 h SER 201 N 0.00 0.00 -0.29 7.04 0.02 -0.64 -3.11 113.55 116.57 2q42 h SER 201 Ca 0.00 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 2q42 h SER 201 Cb 0.34 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.82 2q42 h SER 201 CO 0.00 0.34 -0.05 2.29 -1.14 0.00 0.00 176.83 178.26 2q42 n LYS 202 N -3.36 2.15 -3.61 3.45 2.85 -0.75 -4.98 118.16 113.90 2q42 n LYS 202 Ca 0.01 -3.02 -0.25 0.00 -1.05 0.00 0.00 58.31 53.99 2q42 n LYS 202 Cb 0.54 -1.80 0.06 0.00 -0.65 0.00 0.00 35.03 33.19 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 -0.95 -7.21 -4.09 -1.58 5.02 -0.94 -5.01 118.16 103.40 2q42 n LYS 203 Ca 0.28 0.79 -0.24 0.00 -2.02 0.00 0.00 58.31 57.11 2q42 n LYS 203 Cb 0.95 -5.79 -0.05 0.00 -0.02 0.00 0.00 35.03 30.12 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 -7.26 3.84 0.60 -0.35 1.43 -0.02 -5.00 118.68 111.93 2q42 s LEU 204 Ca 0.58 -0.17 -0.14 0.00 -1.03 0.00 0.00 54.13 53.36 2q42 s LEU 204 Cb -0.26 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.51 2q42 s LEU 204 CO 0.72 0.01 1.04 -2.84 0.23 0.00 0.00 176.35 175.51 2q42 s PRO 205 N -3.50 3.37 -0.06 1.29 0.02 -1.26 -4.10 135.00 130.76 2q42 s PRO 205 Ca 0.32 1.07 0.13 0.00 0.02 0.00 0.00 61.00 62.54 2q42 s PRO 205 Cb -0.09 -2.05 0.38 0.00 0.02 0.00 0.00 34.50 32.77 2q42 s PRO 205 CO 0.24 -0.76 1.31 0.25 -0.33 0.00 0.00 177.00 177.72 2q42 n THR 206 N -2.24 1.43 -4.55 0.99 -2.24 -1.26 -4.94 114.28 101.47 2q42 n THR 206 Ca 0.08 -1.28 -0.22 0.00 -2.27 0.00 0.00 64.05 60.35 2q42 n THR 206 Cb 0.53 0.25 -0.14 0.00 -2.10 0.00 0.00 70.33 68.87 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 -1.60 1.26 0.66 2.28 -1.09 -1.26 -4.03 121.20 117.43 2q42 s ILE 207 Ca 0.30 -0.91 -0.14 0.00 -2.23 0.00 0.00 60.65 57.67 2q42 s ILE 207 Cb 0.19 -1.10 0.00 0.00 -1.58 0.00 0.00 42.46 39.98 2q42 s ILE 207 CO 0.14 0.17 1.09 -2.16 -1.23 0.00 0.00 174.94 172.94 2q42 s PRO 208 N -0.86 2.86 0.00 2.79 0.04 -1.26 -5.05 135.00 133.52 2q42 s PRO 208 Ca 0.04 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2q42 s PRO 208 Cb -0.07 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2q42 s PRO 208 CO 0.01 -1.18 0.00 -2.37 0.04 0.00 0.00 177.00 173.49 2q42 n THR 209 N -2.58 0.00 -3.88 1.26 5.66 -0.62 -4.92 114.28 109.20 2q42 n THR 209 Ca 0.09 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 61.00 2q42 n THR 209 Cb 0.53 -0.72 -0.08 0.00 -1.55 0.00 0.00 70.33 68.50 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 1.76 0.13 0.24 1.09 -4.23 -1.26 -2.23 115.64 111.14 2q42 s THR 210 Ca 0.00 -1.08 -0.05 0.00 -1.18 0.00 0.00 61.69 59.38 2q42 s THR 210 Cb 0.00 -1.08 0.20 0.00 1.34 0.00 0.00 72.50 72.97 2q42 s THR 210 CO 0.00 -0.60 1.80 0.58 -0.54 0.00 0.00 174.62 175.86 2q42 h VAL 211 N 3.26 0.88 -0.36 2.29 2.07 -1.61 -1.97 116.25 120.80 2q42 h VAL 211 Ca -0.33 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.00 2q42 h VAL 211 Cb 1.19 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 2q42 h VAL 211 CO 0.52 0.13 0.06 0.50 0.02 0.00 0.00 177.57 178.80 2q42 h LYS 212 N 0.72 0.17 0.00 1.57 3.64 -1.36 -0.61 116.57 120.71 2q42 h LYS 212 Ca 0.39 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.76 2q42 h LYS 212 Cb 0.38 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2q42 h LYS 212 CO -0.26 0.11 -0.00 1.98 -2.27 0.00 0.00 179.45 179.01 2q42 h MET 213 N 0.18 -0.00 -0.58 1.90 4.05 -1.68 -3.05 114.93 115.75 2q42 h MET 213 Ca 0.17 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.50 2q42 h MET 213 Cb 0.21 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.99 2q42 h MET 213 CO -0.24 0.33 -0.03 0.93 0.23 0.00 0.00 176.91 178.13 2q42 h GLU 214 N -0.34 1.03 0.00 0.39 4.39 -1.28 -1.04 114.58 117.73 2q42 h GLU 214 Ca -0.00 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.37 2q42 h GLU 214 Cb 0.34 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 2q42 h GLU 214 CO 0.00 1.02 0.00 1.17 -1.16 0.00 0.00 179.01 180.04 2q42 n LYS 215 N -4.17 0.12 -0.13 2.33 4.81 -0.25 -1.09 118.16 119.78 2q42 n LYS 215 Ca 0.03 0.60 0.04 0.00 -0.87 0.00 0.00 58.31 58.11 2q42 n LYS 215 Cb 0.36 -1.88 0.11 0.00 0.02 0.00 0.00 35.03 33.63 2q42 n LYS 215 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2q42 n ALA 216 N -1.74 2.21 -1.67 3.14 0.00 -0.45 -4.80 120.51 117.21 2q42 n ALA 216 Ca -0.01 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 52.11 2q42 n ALA 216 Cb 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.19 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 0.00 6.49 0.40 0.00 3.84 -0.25 -4.92 114.94 120.50 2q42 s ASN 218 Ca 0.00 0.58 0.28 0.00 0.21 0.00 0.00 52.86 53.93 2q42 s ASN 218 Cb 0.00 -2.23 1.38 0.00 -0.55 0.00 0.00 41.25 39.85 2q42 s ASN 218 CO 0.00 -0.01 1.86 1.55 -2.79 0.00 0.00 177.10 177.71 2q42 h PRO 219 N 7.03 0.00 -0.02 0.43 0.13 -1.89 -2.46 132.00 135.22 2q42 h PRO 219 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2q42 h PRO 219 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2q42 h PRO 219 CO 0.74 0.00 -0.06 1.19 -0.23 0.00 0.00 178.00 179.63 2q42 n PHE 220 N -2.53 0.00 0.32 1.56 3.72 -1.26 -3.61 117.46 115.66 2q42 n PHE 220 Ca -0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.43 2q42 n PHE 220 Cb 0.14 -0.02 0.01 0.00 -0.94 0.00 0.00 39.48 38.67 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 0.38 1.20 -1.82 4.37 4.77 -0.94 -4.63 117.00 120.33 2q42 n LEU 221 Ca 0.16 -0.83 -0.12 0.00 -0.03 0.00 0.00 56.01 55.19 2q42 n LEU 221 Cb 0.43 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.59 2q42 n LEU 221 CO 0.18 0.25 0.18 0.54 -1.33 0.00 0.00 177.39 177.21 2q42 n ARG 222 N -0.10 2.62 0.00 3.23 1.74 -1.12 -4.88 116.66 118.14 2q42 n ARG 222 Ca 0.03 -3.73 0.06 0.00 -0.77 0.00 0.00 57.85 53.45 2q42 n ARG 222 Cb 0.16 -1.87 0.32 0.00 -1.02 0.00 0.00 32.46 30.05 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 -0.70 0.00 -0.74 0.55 3.41 -1.25 -1.23 113.62 113.65 2q42 n SER 223 Ca 0.30 0.07 0.07 0.00 -0.26 0.00 0.00 58.87 59.05 2q42 n SER 223 Cb 0.89 -0.27 0.16 0.00 -0.26 0.00 0.00 64.21 64.74 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 -1.27 2.92 -4.73 4.04 3.41 -1.26 -4.69 113.62 112.05 2q42 n SER 224 Ca 0.06 -1.90 -0.42 0.00 -0.26 0.00 0.00 58.87 56.36 2q42 n SER 224 Cb 0.10 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 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 -1.04 6.76 0.14 4.04 3.84 -0.37 -4.92 114.94 123.38 2q42 s ASN 225 Ca 0.26 2.50 -0.19 0.00 0.21 0.00 0.00 52.86 55.64 2q42 s ASN 225 Cb 0.14 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 38.24 2q42 s ASN 225 CO 0.19 -0.66 1.72 0.74 -2.79 0.00 0.00 177.10 176.30 2q42 h THR 226 N 3.84 0.82 -0.38 -5.21 2.02 -1.95 -0.92 112.91 111.13 2q42 h THR 226 Ca -0.44 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 2q42 h THR 226 Cb 1.21 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 2q42 h THR 226 CO 0.82 0.01 0.12 0.44 0.37 0.00 0.00 175.52 177.28 2q42 h ASP 227 N 0.08 0.55 -0.49 4.18 3.32 -1.91 0.30 116.42 122.44 2q42 h ASP 227 Ca 0.12 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2q42 h ASP 227 Cb 0.15 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2q42 h ASP 227 CO -0.20 0.60 0.32 0.40 -1.72 0.00 0.00 179.24 178.64 2q42 h ILE 228 N 0.46 1.13 -0.69 0.35 2.04 -1.58 0.20 117.51 119.42 2q42 h ILE 228 Ca 0.12 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 2q42 h ILE 228 Cb 0.24 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2q42 h ILE 228 CO -0.00 0.12 0.26 0.03 0.00 0.00 0.00 178.15 178.56 2q42 h ARG 229 N 0.66 1.02 0.02 2.37 3.08 -0.81 -2.34 114.38 118.37 2q42 h ARG 229 Ca 0.18 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2q42 h ARG 229 Cb -0.07 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.81 2q42 h ARG 229 CO -0.04 0.84 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.60 2q42 h ARG 230 N 1.00 -0.02 -0.83 0.04 2.43 -0.56 0.51 114.38 116.95 2q42 h ARG 230 Ca 0.23 0.00 0.22 0.00 -0.81 0.00 0.00 59.98 59.62 2q42 h ARG 230 Cb 0.21 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 2q42 h ARG 230 CO -0.02 0.38 0.58 0.00 -1.51 0.00 0.00 179.97 179.40 2q42 h ALA 231 N 0.55 2.55 -0.26 2.80 0.00 -0.44 0.53 119.26 124.99 2q42 h ALA 231 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2q42 h ALA 231 Cb 0.41 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2q42 h ALA 231 CO 0.00 -0.80 0.00 1.28 0.00 0.00 0.00 179.25 179.74 2q42 n LEU 232 N -4.38 2.87 -3.76 0.00 4.77 -0.90 -4.98 117.00 110.63 2q42 n LEU 232 Ca 0.17 -1.46 -0.29 0.00 -0.03 0.00 0.00 56.01 54.40 2q42 n LEU 232 Cb 0.80 -0.16 0.01 0.00 -2.33 0.00 0.00 43.42 41.74 2q42 n LEU 232 CO 0.36 0.62 0.06 -1.14 -1.33 0.00 0.00 177.39 175.95 2q42 n ARG 233 N 1.00 -4.78 -2.73 3.23 0.63 0.12 -4.93 116.66 109.20 2q42 n ARG 233 Ca 0.13 0.57 -0.42 0.00 -0.92 0.00 0.00 57.85 57.22 2q42 n ARG 233 Cb 0.47 -5.41 -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 -3.20 4.79 0.42 5.15 1.01 0.14 -4.99 121.20 124.51 2q42 s ILE 234 Ca 0.59 2.04 -0.26 0.00 0.00 0.00 0.00 60.65 63.02 2q42 s ILE 234 Cb -0.30 -4.31 -0.10 0.00 0.01 0.00 0.00 42.46 37.76 2q42 s ILE 234 CO 0.73 0.20 1.29 -2.65 0.00 0.00 0.00 174.94 174.51 2q42 n PRO 235 N 3.64 2.00 0.17 2.79 -0.02 -1.26 -4.67 135.00 137.64 2q42 n PRO 235 Ca 0.05 0.71 0.06 0.00 -2.02 0.00 0.00 63.50 62.30 2q42 n PRO 235 Cb 0.51 -2.41 0.53 0.00 -0.02 0.00 0.00 33.50 32.11 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 2.17 0.18 0.00 -0.52 5.08 -1.96 -1.67 114.58 117.86 2q42 h GLU 236 Ca -0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2q42 h GLU 236 Cb 1.29 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2q42 h GLU 236 CO 0.60 0.17 0.00 0.00 -1.00 0.00 0.00 179.01 178.78 2q42 n ALA 237 N -2.51 2.04 -1.77 3.43 0.00 -1.26 -4.85 120.51 115.58 2q42 n ALA 237 Ca -0.01 -0.07 -0.39 0.00 0.00 0.00 0.00 53.44 52.96 2q42 n ALA 237 Cb 0.12 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.18 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 -3.01 3.31 0.81 0.00 0.00 -0.63 -5.00 121.76 117.24 2q42 s ALA 238 Ca 0.11 1.11 -0.12 0.00 0.00 0.00 0.00 51.96 53.06 2q42 s ALA 238 Cb 0.15 -3.43 0.08 0.00 0.00 0.00 0.00 23.12 19.92 2q42 s ALA 238 CO 0.42 -0.59 1.15 0.16 0.00 0.00 0.00 175.76 176.89 2q42 s ASP 239 N -0.82 4.47 0.49 0.00 1.47 -1.26 -4.79 116.67 116.23 2q42 s ASP 239 Ca 0.53 0.94 0.18 0.00 1.18 0.00 0.00 52.55 55.38 2q42 s ASP 239 Cb -0.35 -1.53 1.22 0.00 -0.34 0.00 0.00 42.92 41.91 2q42 s ASP 239 CO 0.46 -1.95 2.04 -0.33 0.68 0.00 0.00 175.17 176.07 2q42 h GLU 240 N -1.08 0.15 -0.38 2.11 5.08 -1.95 -0.75 114.58 117.77 2q42 h GLU 240 Ca -0.47 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 57.80 2q42 h GLU 240 Cb 1.31 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 2q42 h GLU 240 CO 0.64 0.10 -0.08 0.00 -1.00 0.00 0.00 179.01 178.67 2q42 h ALA 241 N 1.81 0.52 -0.33 3.43 0.00 -1.91 -0.80 119.26 121.97 2q42 h ALA 241 Ca 0.17 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 2q42 h ALA 241 Cb 0.49 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2q42 h ALA 241 CO -0.02 0.37 -0.25 0.93 0.00 0.00 0.00 179.25 180.27 2q42 h GLU 242 N 0.52 0.75 0.23 0.00 5.08 -1.54 -2.46 114.58 117.16 2q42 h GLU 242 Ca 0.10 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2q42 h GLU 242 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2q42 h GLU 242 CO 0.04 0.99 -0.19 0.00 -1.00 0.00 0.00 179.01 178.84 2q42 h ALA 243 N 0.74 -0.41 -0.62 3.43 0.00 -1.17 -1.20 119.26 120.03 2q42 h ALA 243 Ca 0.06 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 55.03 2q42 h ALA 243 Cb 0.81 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.76 2q42 h ALA 243 CO 0.07 -0.75 0.08 1.25 0.00 0.00 0.00 179.25 179.89 2q42 h LEU 244 N -0.43 -0.12 -0.98 0.00 6.46 -1.17 0.43 115.31 119.51 2q42 h LEU 244 Ca -0.01 0.13 0.01 0.00 -0.12 0.00 0.00 57.88 57.89 2q42 h LEU 244 Cb 0.39 0.21 -0.05 0.00 -0.73 0.00 0.00 40.66 40.48 2q42 h LEU 244 CO -0.02 -0.05 0.64 1.23 -0.62 0.00 0.00 178.44 179.62 2q42 h GLY 245 N 0.20 1.38 1.00 3.75 0.00 -1.03 0.76 103.07 109.13 2q42 h GLY 245 Ca 0.33 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 47.08 2q42 h GLY 245 CO -0.47 0.51 0.12 -2.22 0.00 0.00 0.00 176.54 174.49 2q42 h ILE 246 N 1.33 1.25 -0.55 2.60 2.04 0.16 -0.69 117.51 123.65 2q42 h ILE 246 Ca 0.36 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.28 2q42 h ILE 246 Cb -0.14 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 2q42 h ILE 246 CO -0.08 0.33 0.19 0.40 0.00 0.00 0.00 178.15 178.99 2q42 h ILE 247 N 0.79 1.21 -0.31 -0.67 2.04 -0.50 -2.39 117.51 117.68 2q42 h ILE 247 Ca 0.17 -0.70 -0.15 0.00 1.00 0.00 0.00 64.86 65.18 2q42 h ILE 247 Cb 0.36 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 2q42 h ILE 247 CO 0.00 0.27 -0.40 -0.09 0.00 0.00 0.00 178.15 177.94 2q42 h ARG 248 N 0.79 0.82 -0.49 2.37 9.65 -0.30 0.22 114.38 127.44 2q42 h ARG 248 Ca 0.18 -0.46 -0.04 0.00 -1.10 0.00 0.00 59.98 58.56 2q42 h ARG 248 Cb 0.21 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.80 2q42 h ARG 248 CO -0.01 1.10 0.16 0.87 2.80 0.00 0.00 179.97 184.89 2q42 h LYS 249 N 0.59 0.76 -0.10 0.20 1.57 -0.97 -0.57 116.57 118.05 2q42 h LYS 249 Ca 0.04 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.58 2q42 h LYS 249 Cb 0.99 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 2q42 h LYS 249 CO 0.09 0.70 -0.31 0.00 -0.57 0.00 0.00 179.45 179.37 2q42 h ALA 250 N 1.02 1.30 -0.99 3.86 0.00 -1.37 -1.97 119.26 121.11 2q42 h ALA 250 Ca 0.16 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2q42 h ALA 250 Cb 0.25 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2q42 h ALA 250 CO -0.01 0.49 0.65 -0.22 0.00 0.00 0.00 179.25 180.16 2q42 h LYS 251 N 0.16 1.24 -0.10 0.00 1.63 0.88 -0.65 116.57 119.74 2q42 h LYS 251 Ca 0.02 -0.07 -0.22 0.00 -0.85 0.00 0.00 60.65 59.53 2q42 h LYS 251 Cb 0.64 -0.28 0.01 0.00 -0.60 0.00 0.00 32.23 32.01 2q42 h LYS 251 CO 0.05 0.82 -0.80 -0.44 -3.45 0.00 0.00 179.45 175.63 2q42 h ASP 252 N 1.27 0.87 -0.26 4.20 3.32 -0.88 -3.27 116.42 121.66 2q42 h ASP 252 Ca 0.38 -0.67 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2q42 h ASP 252 Cb -0.04 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.25 2q42 h ASP 252 CO -0.11 1.40 0.00 -0.67 -1.72 0.00 0.00 179.24 178.14 2q42 n ASP 253 N -3.98 2.51 -0.12 6.45 2.03 -0.71 -5.13 116.55 117.61 2q42 n ASP 253 Ca -0.09 -2.25 0.15 0.00 0.52 0.00 0.00 54.79 53.13 2q42 n ASP 253 Cb 0.76 -0.45 0.84 0.00 -0.72 0.00 0.00 41.12 41.55 2q42 n ASP 253 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61