#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q89 n ASP 1 N 0.00 0.00 0.17 0.55 -0.08 -1.26 -4.67 116.55 111.26 2q89 n ASP 1 Ca 0.00 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.31 2q89 n ASP 1 Cb 0.00 0.00 0.31 0.00 2.34 0.00 0.00 41.12 43.77 2q89 n ASP 1 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2q89 h GLU 2 N 0.00 0.00 -1.02 -0.67 4.39 -2.00 -3.17 114.58 112.11 2q89 h GLU 2 Ca 0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 2q89 h GLU 2 Cb 0.00 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 28.36 2q89 h GLU 2 CO 0.00 0.44 0.74 0.27 -1.16 0.00 0.00 179.01 179.30 2q89 n ASN 3 N -3.77 5.78 -0.07 1.42 2.04 -1.26 -4.65 115.26 114.74 2q89 n ASN 3 Ca -0.01 -3.64 -0.13 0.00 -0.44 0.00 0.00 54.58 50.36 2q89 n ASN 3 Cb 0.50 -0.91 -0.06 0.00 -2.53 0.00 0.00 39.78 36.79 2q89 n ASN 3 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 2q89 h LYS 4 N 1.48 0.49 -0.46 -3.83 1.63 -1.82 -3.05 116.57 111.02 2q89 h LYS 4 Ca 0.60 -0.25 0.04 0.00 -0.85 0.00 0.00 60.65 60.18 2q89 h LYS 4 Cb 1.75 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 33.34 2q89 h LYS 4 CO 1.31 0.82 0.24 1.25 -3.45 0.00 0.00 179.45 179.61 2q89 h LEU 5 N 0.18 0.35 -0.50 5.20 6.46 -1.88 -1.46 115.31 123.65 2q89 h LEU 5 Ca 0.04 0.02 0.07 0.00 -0.12 0.00 0.00 57.88 57.89 2q89 h LEU 5 Cb 0.71 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.54 2q89 h LEU 5 CO 0.05 0.25 0.15 -0.33 -0.62 0.00 0.00 178.44 177.93 2q89 h GLU 6 N 0.47 0.29 -0.53 1.25 3.07 -1.91 -0.37 114.58 116.85 2q89 h GLU 6 Ca 0.20 -0.02 -0.08 0.00 -0.50 0.00 0.00 59.36 58.96 2q89 h GLU 6 Cb 0.09 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 2q89 h GLU 6 CO -0.13 0.20 -0.00 0.93 -1.40 0.00 0.00 179.01 178.60 2q89 h GLU 7 N 0.30 0.89 -0.20 2.33 5.08 -1.34 -1.77 114.58 119.88 2q89 h GLU 7 Ca 0.24 -0.26 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 2q89 h GLU 7 Cb 0.29 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2q89 h GLU 7 CO -0.28 0.89 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.27 2q89 h LEU 8 N 0.83 0.40 -0.09 1.33 3.38 -0.71 0.12 115.31 120.56 2q89 h LEU 8 Ca 0.16 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2q89 h LEU 8 Cb 0.49 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2q89 h LEU 8 CO 0.02 0.68 -0.00 0.11 0.09 0.00 0.00 178.44 179.34 2q89 h LYS 9 N 0.35 0.16 0.00 1.13 1.57 -0.77 -0.02 116.57 118.99 2q89 h LYS 9 Ca 0.05 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2q89 h LYS 9 Cb 0.68 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2q89 h LYS 9 CO 0.05 0.42 0.00 0.39 -0.57 0.00 0.00 179.45 179.74 2q89 n GLU 10 N -4.83 0.09 0.04 3.15 -0.58 -0.69 -2.52 120.64 115.30 2q89 n GLU 10 Ca -0.06 0.13 -0.14 0.00 -0.42 0.00 0.00 57.16 56.66 2q89 n GLU 10 Cb 0.20 -1.61 -0.14 0.00 -0.57 0.00 0.00 31.44 29.32 2q89 n GLU 10 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2q89 h GLN 11 N 0.00 0.17 0.00 3.49 4.15 -0.65 -3.49 115.11 118.77 2q89 h GLN 11 Ca 0.00 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.14 2q89 h GLN 11 Cb 0.52 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.31 2q89 h GLN 11 CO 0.00 0.98 0.00 0.41 -1.93 0.00 0.00 178.83 178.29 2q89 n GLY 12 N 1.62 1.26 3.28 2.39 0.00 -0.03 -5.03 105.19 108.68 2q89 n GLY 12 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 2q89 n GLY 12 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2q89 s PHE 13 N -2.32 -0.09 -0.02 1.61 -0.12 -1.18 -2.31 117.98 113.55 2q89 s PHE 13 Ca 0.00 -0.24 0.06 0.00 -0.05 0.00 0.00 56.93 56.70 2q89 s PHE 13 Cb 0.00 0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.52 2q89 s PHE 13 CO 0.00 -0.64 -0.19 0.00 -0.05 0.00 0.00 175.22 174.34 2q89 s ALA 14 N -3.72 2.49 -0.22 1.99 0.00 -0.85 -4.80 121.76 116.65 2q89 s ALA 14 Ca 0.03 -1.08 -0.22 0.00 0.00 0.00 0.00 51.96 50.68 2q89 s ALA 14 Cb 0.03 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 2q89 s ALA 14 CO -0.11 0.55 0.72 1.03 0.00 0.00 0.00 175.76 177.95 2q89 s ARG 15 N -0.89 4.19 0.05 0.00 0.52 -1.26 -0.71 118.95 120.85 2q89 s ARG 15 Ca 0.12 0.75 0.09 0.00 -0.52 0.00 0.00 55.73 56.17 2q89 s ARG 15 Cb -0.10 -3.62 -0.03 0.00 0.52 0.00 0.00 34.95 31.72 2q89 s ARG 15 CO 0.01 -0.38 -0.23 0.96 0.02 0.00 0.00 175.30 175.68 2q89 s ILE 16 N 2.38 2.41 -0.18 1.52 -4.36 -0.02 -0.17 121.20 122.78 2q89 s ILE 16 Ca 0.31 -1.34 -0.08 0.00 -0.26 0.00 0.00 60.65 59.28 2q89 s ILE 16 Cb -0.16 -1.98 -0.04 0.00 1.25 0.00 0.00 42.46 41.53 2q89 s ILE 16 CO 0.09 0.33 0.07 0.00 0.24 0.00 0.00 174.94 175.67 2q89 s ALA 17 N -0.88 3.42 0.20 2.27 0.00 -0.68 -0.36 121.76 125.73 2q89 s ALA 17 Ca 0.13 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.36 2q89 s ALA 17 Cb -0.10 -1.93 -0.05 0.00 0.00 0.00 0.00 23.12 21.04 2q89 s ALA 17 CO 0.04 0.17 0.05 0.96 0.00 0.00 0.00 175.76 176.98 2q89 s ILE 18 N 0.37 0.49 -0.07 0.00 -4.36 0.64 -2.15 121.20 116.13 2q89 s ILE 18 Ca 0.03 -1.98 0.01 0.00 -0.26 0.00 0.00 60.65 58.45 2q89 s ILE 18 Cb -0.12 -2.31 -0.01 0.00 1.25 0.00 0.00 42.46 41.27 2q89 s ILE 18 CO 0.00 -0.27 0.15 0.00 0.24 0.00 0.00 174.94 175.05 2q89 n ALA 19 N -0.30 2.21 -2.80 2.27 0.00 -1.26 -1.47 120.51 119.17 2q89 n ALA 19 Ca -0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 53.44 53.27 2q89 n ALA 19 Cb 0.65 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 20.06 2q89 n ALA 19 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2q89 n ASN 20 N -0.80 -6.80 -3.53 0.00 5.15 -1.26 -4.79 115.26 103.23 2q89 n ASN 20 Ca 0.00 -0.08 -0.29 0.00 -0.60 0.00 0.00 54.58 53.62 2q89 n ASN 20 Cb 0.02 -4.59 -0.13 0.00 -0.53 0.00 0.00 39.78 34.55 2q89 n ASN 20 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2q89 s GLU 21 N -3.04 0.68 0.46 1.20 2.12 -0.77 -4.81 118.70 114.54 2q89 s GLU 21 Ca 0.01 -1.39 -0.24 0.00 0.36 0.00 0.00 54.97 53.71 2q89 s GLU 21 Cb -0.00 -1.54 -0.07 0.00 0.26 0.00 0.00 34.13 32.78 2q89 s GLU 21 CO 0.62 -1.17 1.30 -2.14 -0.54 0.00 0.00 175.26 173.34 2q89 s PRO 22 N 1.04 3.69 -0.17 4.30 0.02 -0.28 -1.05 135.00 142.56 2q89 s PRO 22 Ca 0.17 2.13 0.12 0.00 0.02 0.00 0.00 61.00 63.44 2q89 s PRO 22 Cb -0.22 -2.55 0.65 0.00 0.02 0.00 0.00 34.50 32.40 2q89 s PRO 22 CO -0.04 -0.72 1.51 -0.35 -0.33 0.00 0.00 177.00 177.07 2q89 n PRO 23 N -0.32 3.96 0.03 5.54 -0.04 -1.26 -4.07 135.00 138.84 2q89 n PRO 23 Ca 0.06 -2.51 -0.12 0.00 -0.04 0.00 0.00 63.50 60.89 2q89 n PRO 23 Cb 0.45 -2.05 -0.09 0.00 -0.04 0.00 0.00 33.50 31.77 2q89 n PRO 23 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2q89 h PHE 24 N 3.28 -0.14 -3.96 0.54 -1.00 -1.46 -1.42 116.94 112.78 2q89 h PHE 24 Ca 0.00 -0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.54 2q89 h PHE 24 Cb 1.60 0.05 -0.20 0.00 3.61 0.00 0.00 35.95 41.01 2q89 h PHE 24 CO 0.83 0.35 -0.72 0.95 -1.61 0.00 0.00 178.31 178.12 2q89 s THR 25 N -3.67 0.46 -0.06 -1.55 -4.23 -0.77 -1.68 115.64 104.14 2q89 s THR 25 Ca -0.14 -1.26 -0.20 0.00 -1.18 0.00 0.00 61.69 58.90 2q89 s THR 25 Cb 0.01 -0.81 0.04 0.00 1.34 0.00 0.00 72.50 73.08 2q89 s THR 25 CO 0.56 -0.54 0.46 0.00 -0.54 0.00 0.00 174.62 174.56 2q89 s ALA 26 N -2.00 -1.18 -0.12 3.99 0.00 -0.23 -1.12 121.76 121.09 2q89 s ALA 26 Ca -0.06 0.85 -0.01 0.00 0.00 0.00 0.00 51.96 52.74 2q89 s ALA 26 Cb -0.06 -0.12 0.03 0.00 0.00 0.00 0.00 23.12 22.98 2q89 s ALA 26 CO -0.02 -0.29 -0.03 0.08 0.00 0.00 0.00 175.76 175.50 2q89 s VAL 27 N -0.97 0.79 0.73 0.00 1.01 -1.26 -0.92 120.40 119.77 2q89 s VAL 27 Ca -0.10 -0.28 -0.11 0.00 0.00 0.00 0.00 61.98 61.48 2q89 s VAL 27 Cb -0.03 -0.95 0.03 0.00 0.00 0.00 0.00 36.38 35.43 2q89 s VAL 27 CO 0.05 0.20 1.09 -0.83 0.00 0.00 0.00 175.10 175.61 2q89 s GLY 28 N 1.79 1.63 0.57 4.51 0.00 -0.94 -4.92 107.32 109.96 2q89 s GLY 28 Ca 0.03 -0.22 0.26 0.00 0.00 0.00 0.00 44.72 44.79 2q89 s GLY 28 CO -0.07 0.16 2.13 0.00 0.00 0.00 0.00 173.10 175.31 2q89 h ALA 29 N -0.78 1.88 -0.86 3.20 0.00 -2.01 0.12 119.26 120.81 2q89 h ALA 29 Ca -0.45 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.49 2q89 h ALA 29 Cb 1.25 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 2q89 h ALA 29 CO 0.61 -0.22 0.56 0.22 0.00 0.00 0.00 179.25 180.42 2q89 h ASP 30 N 0.00 0.92 0.00 0.00 3.58 -2.05 -3.46 116.42 115.40 2q89 h ASP 30 Ca 0.07 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.51 2q89 h ASP 30 Cb 0.36 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.20 2q89 h ASP 30 CO -0.00 0.63 0.00 0.61 -2.88 0.00 0.00 179.24 177.60 2q89 n GLY 31 N -1.41 1.47 3.75 -0.78 0.00 0.41 -5.09 105.19 103.55 2q89 n GLY 31 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2q89 n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q89 s LYS 32 N -0.34 4.17 -0.32 1.61 -2.85 -1.26 -4.75 119.74 115.99 2q89 s LYS 32 Ca 0.00 2.48 -0.15 0.00 -1.00 0.00 0.00 55.97 57.31 2q89 s LYS 32 Cb 0.00 -3.05 -0.02 0.00 -2.06 0.00 0.00 37.83 32.70 2q89 s LYS 32 CO 0.00 -0.55 0.35 0.08 0.10 0.00 0.00 175.35 175.33 2q89 s VAL 33 N -0.14 5.18 0.00 1.79 1.01 -1.26 -2.21 120.40 124.77 2q89 s VAL 33 Ca 0.61 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.76 2q89 s VAL 33 Cb -0.46 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2q89 s VAL 33 CO 0.48 -0.01 0.00 -1.54 0.00 0.00 0.00 175.10 174.03 2q89 n SER 34 N 5.35 1.37 0.00 3.32 3.41 -0.10 -4.79 113.62 122.18 2q89 n SER 34 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2q89 n SER 34 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2q89 n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q89 n GLY 35 N 4.33 1.88 0.26 5.00 0.00 -1.26 -1.06 105.19 114.33 2q89 n GLY 35 Ca 0.00 -1.85 -0.06 0.00 0.00 0.00 0.00 46.02 44.11 2q89 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q89 h ALA 36 N 0.00 0.81 0.05 4.61 0.00 -0.83 -2.31 119.26 121.60 2q89 h ALA 36 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2q89 h ALA 36 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2q89 h ALA 36 CO 0.00 0.24 -0.02 0.00 0.00 0.00 0.00 179.25 179.46 2q89 h ALA 37 N 1.24 -0.07 -0.26 0.00 0.00 -1.57 -2.51 119.26 116.08 2q89 h ALA 37 Ca 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2q89 h ALA 37 Cb -0.09 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2q89 h ALA 37 CO -0.05 -0.33 -0.07 -1.35 0.00 0.00 0.00 179.25 177.45 2q89 h PRO 38 N -0.48 0.42 -0.25 0.00 0.11 -1.73 -1.09 132.00 128.97 2q89 h PRO 38 Ca -0.01 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 65.98 2q89 h PRO 38 Cb 0.43 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 2q89 h PRO 38 CO 0.01 0.50 0.06 -0.44 -0.21 0.00 0.00 178.00 177.93 2q89 h ASP 39 N 0.40 0.38 -0.03 -2.05 5.19 -1.43 0.41 116.42 119.28 2q89 h ASP 39 Ca 0.08 -0.23 -0.00 0.00 -0.62 0.00 0.00 57.03 56.26 2q89 h ASP 39 Cb 0.38 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 39.78 2q89 h ASP 39 CO 0.02 0.51 0.02 0.58 -3.12 0.00 0.00 179.24 177.24 2q89 h VAL 40 N 0.23 1.06 -0.60 -1.35 2.07 -1.40 -0.77 116.25 115.49 2q89 h VAL 40 Ca 0.08 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.45 2q89 h VAL 40 Cb 0.28 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 2q89 h VAL 40 CO 0.00 0.05 0.36 0.00 0.02 0.00 0.00 177.57 178.00 2q89 h ALA 41 N 0.94 0.78 0.03 1.67 0.00 -1.13 -1.27 119.26 120.27 2q89 h ALA 41 Ca 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2q89 h ALA 41 Cb 0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2q89 h ALA 41 CO -0.00 0.09 -0.01 -0.09 0.00 0.00 0.00 179.25 179.23 2q89 h ARG 42 N 0.71 -0.04 -0.26 0.00 2.43 -0.06 -1.30 114.38 115.87 2q89 h ARG 42 Ca 0.24 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.44 2q89 h ARG 42 Cb 0.04 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2q89 h ARG 42 CO -0.11 -0.02 0.11 1.49 -1.51 0.00 0.00 179.97 179.93 2q89 h GLU 43 N -0.04 0.24 -0.18 0.20 4.57 -0.91 -1.99 114.58 116.47 2q89 h GLU 43 Ca -0.00 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2q89 h GLU 43 Cb 0.03 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 2q89 h GLU 43 CO 0.00 0.16 0.06 0.82 -1.18 0.00 0.00 179.01 178.87 2q89 h ILE 44 N 0.24 1.19 -0.39 2.32 2.04 -1.11 -2.01 117.51 119.79 2q89 h ILE 44 Ca 0.11 -0.59 0.04 0.00 1.00 0.00 0.00 64.86 65.42 2q89 h ILE 44 Cb 0.05 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 2q89 h ILE 44 CO -0.09 0.18 0.15 -0.26 0.00 0.00 0.00 178.15 178.14 2q89 h PHE 45 N 0.12 0.28 -0.67 1.37 0.04 -1.22 -0.65 116.94 116.21 2q89 h PHE 45 Ca 0.06 0.02 0.13 0.00 2.80 0.00 0.00 57.97 60.98 2q89 h PHE 45 Cb 0.23 -0.07 -0.13 0.00 2.20 0.00 0.00 35.95 38.19 2q89 h PHE 45 CO 0.00 0.12 -0.20 -0.22 -0.60 0.00 0.00 178.31 177.41 2q89 h LYS 46 N 0.32 -0.03 0.00 1.51 3.64 -0.93 0.11 116.57 121.19 2q89 h LYS 46 Ca 0.18 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 2q89 h LYS 46 Cb 0.14 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2q89 h LYS 46 CO -0.16 -0.02 -0.13 0.00 -2.27 0.00 0.00 179.45 176.86 2q89 h ARG 47 N -0.03 0.00 -0.03 1.90 3.08 -0.55 -1.87 114.38 116.88 2q89 h ARG 47 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 2q89 h ARG 47 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2q89 h ARG 47 CO -0.70 0.13 0.00 1.28 -1.07 0.00 0.00 179.97 179.61 2q89 n LEU 48 N -4.32 0.59 0.00 3.04 4.77 0.10 -4.89 117.00 116.29 2q89 n LEU 48 Ca -0.03 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 2q89 n LEU 48 Cb 0.21 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2q89 n LEU 48 CO 0.35 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2q89 n GLY 49 N 1.01 0.73 3.45 -0.72 0.00 -0.70 -4.93 105.19 104.03 2q89 n GLY 49 Ca 0.19 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2q89 n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q89 s VAL 50 N -2.00 5.23 0.35 1.61 1.01 0.14 -4.63 120.40 122.10 2q89 s VAL 50 Ca 0.00 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.36 2q89 s VAL 50 Cb 0.00 -3.98 0.17 0.00 0.00 0.00 0.00 36.38 32.57 2q89 s VAL 50 CO 0.00 -0.37 1.90 0.00 0.00 0.00 0.00 175.10 176.62 2q89 h ALA 51 N 8.67 1.41 -2.87 5.51 0.00 -1.73 -2.58 119.26 127.67 2q89 h ALA 51 Ca -0.27 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 2q89 h ALA 51 Cb 1.12 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.68 2q89 h ALA 51 CO 0.76 0.42 -0.08 0.34 0.00 0.00 0.00 179.25 180.69 2q89 s ASP 52 N -6.74 0.08 -0.04 0.00 -1.08 -0.98 -4.85 116.67 103.06 2q89 s ASP 52 Ca -0.08 -1.03 0.06 0.00 -0.52 0.00 0.00 52.55 50.98 2q89 s ASP 52 Cb 0.16 0.63 -0.02 0.00 -1.46 0.00 0.00 42.92 42.23 2q89 s ASP 52 CO 0.76 -1.23 -0.21 0.68 0.52 0.00 0.00 175.17 175.68 2q89 s VAL 53 N -3.68 2.44 -0.24 1.11 -7.23 -1.26 -2.01 120.40 109.53 2q89 s VAL 53 Ca 0.23 -0.95 -0.05 0.00 -1.81 0.00 0.00 61.98 59.39 2q89 s VAL 53 Cb -0.01 -1.90 -0.01 0.00 0.56 0.00 0.00 36.38 35.02 2q89 s VAL 53 CO 0.11 0.58 -0.01 -0.69 -0.31 0.00 0.00 175.10 174.79 2q89 s VAL 54 N -0.56 3.59 -0.05 1.32 1.01 0.11 -4.92 120.40 120.90 2q89 s VAL 54 Ca 0.08 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 2q89 s VAL 54 Cb -0.11 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 2q89 s VAL 54 CO 0.00 0.35 0.16 0.00 0.00 0.00 0.00 175.10 175.62 2q89 s ALA 55 N 1.50 3.92 -0.07 5.51 0.00 -1.26 -0.84 121.76 130.52 2q89 s ALA 55 Ca 0.05 -0.72 0.05 0.00 0.00 0.00 0.00 51.96 51.34 2q89 s ALA 55 Cb -0.15 -1.91 -0.01 0.00 0.00 0.00 0.00 23.12 21.05 2q89 s ALA 55 CO -0.01 0.70 -0.22 -1.12 0.00 0.00 0.00 175.76 175.11 2q89 s SER 56 N -1.61 3.35 -0.12 0.00 0.01 0.52 -4.93 113.70 110.92 2q89 s SER 56 Ca 0.23 -0.44 -0.17 0.00 1.31 0.00 0.00 55.95 56.88 2q89 s SER 56 Cb -0.12 -0.98 -0.04 0.00 0.21 0.00 0.00 66.02 65.09 2q89 s SER 56 CO 0.13 0.25 0.45 -0.63 0.41 0.00 0.00 173.24 173.85 2q89 s ILE 57 N -0.16 5.20 0.28 1.44 1.01 -1.25 -0.26 121.20 127.46 2q89 s ILE 57 Ca -0.03 0.89 -0.12 0.00 0.00 0.00 0.00 60.65 61.39 2q89 s ILE 57 Cb -0.14 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.55 2q89 s ILE 57 CO 0.04 0.34 0.52 -0.94 0.00 0.00 0.00 174.94 174.90 2q89 s SER 58 N 0.54 0.09 0.58 3.58 1.04 -0.54 -4.97 113.70 114.03 2q89 s SER 58 Ca 0.24 -1.03 -0.12 0.00 0.48 0.00 0.00 55.95 55.52 2q89 s SER 58 Cb -0.15 0.64 -0.05 0.00 0.10 0.00 0.00 66.02 66.56 2q89 s SER 58 CO 0.09 -1.24 1.00 -1.61 0.98 0.00 0.00 173.24 172.46 2q89 s GLU 59 N -3.66 3.69 0.45 4.02 2.02 -1.26 -4.09 118.70 119.87 2q89 s GLU 59 Ca 0.23 0.76 0.12 0.00 0.02 0.00 0.00 54.97 56.10 2q89 s GLU 59 Cb -0.01 -2.12 1.05 0.00 0.10 0.00 0.00 34.13 33.15 2q89 s GLU 59 CO 0.11 -0.46 2.06 1.88 0.02 0.00 0.00 175.26 178.87 2q89 h TYR 60 N 0.05 0.32 0.00 1.61 0.05 -1.93 -2.23 116.97 114.84 2q89 h TYR 60 Ca -0.45 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.34 2q89 h TYR 60 Cb 1.19 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.82 2q89 h TYR 60 CO 0.65 0.18 0.00 0.78 -1.05 0.00 0.00 178.16 178.72 2q89 h GLY 61 N 0.33 0.00 0.30 3.88 0.00 -1.25 -3.06 103.07 103.28 2q89 h GLY 61 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2q89 h GLY 61 CO -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 176.54 176.10 2q89 n ALA 62 N -1.85 3.40 0.07 3.60 0.00 -0.84 -4.60 120.51 120.30 2q89 n ALA 62 Ca 0.03 -0.43 -0.11 0.00 0.00 0.00 0.00 53.44 52.93 2q89 n ALA 62 Cb 0.34 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 18.65 2q89 n ALA 62 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2q89 h MET 63 N 0.90 -0.25 -0.12 0.00 2.07 -1.61 -1.46 114.93 114.45 2q89 h MET 63 Ca 0.00 0.02 -0.00 0.00 -2.07 0.00 0.00 59.70 57.64 2q89 h MET 63 Cb 0.53 0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 30.31 2q89 h MET 63 CO 0.00 0.15 0.07 0.82 1.07 0.00 0.00 176.91 179.02 2q89 h ILE 64 N -0.84 1.09 -0.83 -1.22 2.04 -1.81 -0.87 117.51 115.06 2q89 h ILE 64 Ca -0.03 -0.26 0.14 0.00 1.00 0.00 0.00 64.86 65.72 2q89 h ILE 64 Cb 0.52 1.04 -0.09 0.00 -0.74 0.00 0.00 36.82 37.55 2q89 h ILE 64 CO 0.04 0.08 0.42 -0.65 0.00 0.00 0.00 178.15 178.05 2q89 h PRO 65 N 0.10 0.60 -0.53 2.37 0.11 -1.81 -0.31 132.00 132.52 2q89 h PRO 65 Ca 0.04 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 2q89 h PRO 65 Cb 0.08 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 2q89 h PRO 65 CO -0.01 0.40 0.07 0.78 -0.21 0.00 0.00 178.00 179.03 2q89 h GLY 66 N 0.62 0.91 0.65 -0.55 0.00 -0.98 -1.54 103.07 102.19 2q89 h GLY 66 Ca 0.45 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 2q89 h GLY 66 CO -0.35 0.53 -0.01 -2.00 0.00 0.00 0.00 176.54 174.71 2q89 h LEU 67 N 0.80 0.07 -1.90 3.11 5.85 -0.28 -0.88 115.31 122.09 2q89 h LEU 67 Ca 0.17 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 2q89 h LEU 67 Cb 0.38 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 2q89 h LEU 67 CO 0.01 0.43 -0.12 1.56 -0.34 0.00 0.00 178.44 179.98 2q89 h GLN 68 N -0.29 0.00 -0.00 1.25 4.20 -1.00 -0.85 115.11 118.41 2q89 h GLN 68 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2q89 h GLN 68 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2q89 h GLN 68 CO 0.00 0.12 -0.11 0.00 -0.67 0.00 0.00 178.83 178.18 2q89 n ALA 69 N -2.35 2.68 -1.36 3.87 0.00 -0.59 -4.94 120.51 117.83 2q89 n ALA 69 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2q89 n ALA 69 Cb 0.22 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2q89 n ALA 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q89 n GLY 70 N 1.37 0.42 0.09 0.00 0.00 -0.32 -4.96 105.19 101.79 2q89 n GLY 70 Ca 0.11 -0.97 -0.04 0.00 0.00 0.00 0.00 46.02 45.12 2q89 n GLY 70 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2q89 h ARG 71 N 0.00 0.00 -4.81 1.61 3.08 -1.35 -3.47 114.38 109.44 2q89 h ARG 71 Ca 0.00 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.78 2q89 h ARG 71 Cb 0.40 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.30 2q89 h ARG 71 CO 0.00 0.78 -0.71 -1.01 -1.07 0.00 0.00 179.97 177.97 2q89 s HIS 72 N -2.78 1.03 -0.16 3.04 3.76 -1.25 -4.98 115.29 113.94 2q89 s HIS 72 Ca 0.01 -0.84 0.19 0.00 -0.15 0.00 0.00 55.06 54.27 2q89 s HIS 72 Cb 0.09 -0.56 -0.08 0.00 1.11 0.00 0.00 32.58 33.14 2q89 s HIS 72 CO 0.80 -0.06 0.93 -0.44 -0.85 0.00 0.00 174.74 175.12 2q89 h ASP 73 N 2.95 0.00 -4.75 1.40 3.32 -0.91 -3.44 116.42 115.00 2q89 h ASP 73 Ca -0.36 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.70 2q89 h ASP 73 Cb 1.18 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.55 2q89 h ASP 73 CO 0.63 0.39 0.32 0.00 -1.72 0.00 0.00 179.24 178.86 2q89 s ALA 74 N -3.06 -1.78 -0.28 3.45 0.00 -0.94 -4.58 121.76 114.57 2q89 s ALA 74 Ca -0.02 1.16 -0.10 0.00 0.00 0.00 0.00 51.96 53.00 2q89 s ALA 74 Cb 0.09 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 2q89 s ALA 74 CO 0.80 -0.49 0.17 0.42 0.00 0.00 0.00 175.76 176.66 2q89 s ILE 75 N -2.01 5.11 -0.49 0.00 1.01 -0.17 -1.69 121.20 122.95 2q89 s ILE 75 Ca -0.04 0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.72 2q89 s ILE 75 Cb -0.00 -3.44 0.16 0.00 0.01 0.00 0.00 42.46 39.19 2q89 s ILE 75 CO 0.00 0.25 0.35 0.42 0.00 0.00 0.00 174.94 175.96 2q89 s THR 76 N 1.73 1.20 0.00 2.92 -4.23 -0.91 -1.30 115.64 115.05 2q89 s THR 76 Ca 0.07 -2.97 0.00 0.00 -1.18 0.00 0.00 61.69 57.61 2q89 s THR 76 Cb -0.16 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.86 2q89 s THR 76 CO 0.09 -1.08 0.15 0.00 -0.54 0.00 0.00 174.62 173.24 2q89 n ALA 77 N 2.87 0.57 -1.20 3.99 0.00 -1.25 -4.23 120.51 121.26 2q89 n ALA 77 Ca 0.21 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2q89 n ALA 77 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2q89 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q89 n GLY 78 N 0.00 0.53 3.55 0.00 0.00 -1.26 -4.74 105.19 103.28 2q89 n GLY 78 Ca 0.00 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 44.80 2q89 n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2q89 s LEU 79 N 0.00 3.26 0.43 0.99 2.96 -1.26 -4.77 118.68 120.29 2q89 s LEU 79 Ca 0.00 -0.29 -0.26 0.00 -0.22 0.00 0.00 54.13 53.36 2q89 s LEU 79 Cb 0.00 -2.55 -0.09 0.00 0.50 0.00 0.00 46.19 44.05 2q89 s LEU 79 CO 0.00 -2.28 1.46 -0.36 -1.32 0.00 0.00 176.35 173.84 2q89 s PHE 80 N 8.29 2.46 -0.01 5.38 0.08 -1.26 -3.98 117.98 128.95 2q89 s PHE 80 Ca 0.60 1.22 -0.30 0.00 0.12 0.00 0.00 56.93 58.57 2q89 s PHE 80 Cb -0.09 -3.97 -0.05 0.00 -0.57 0.00 0.00 43.02 38.34 2q89 s PHE 80 CO 0.10 -3.03 1.33 -1.64 -0.10 0.00 0.00 175.22 171.89 2q89 s MET 81 N -2.36 4.31 0.02 0.44 -1.94 0.15 -4.91 119.30 115.01 2q89 s MET 81 Ca 0.59 1.88 0.01 0.00 -1.71 0.00 0.00 55.69 56.45 2q89 s MET 81 Cb -0.45 -3.54 -0.01 0.00 2.01 0.00 0.00 34.83 32.84 2q89 s MET 81 CO 0.59 -0.51 -0.04 0.15 -0.01 0.00 0.00 175.02 175.19 2q89 s LYS 82 N 2.21 0.33 0.23 2.03 1.02 -1.26 -4.78 119.74 119.52 2q89 s LYS 82 Ca 0.61 -0.44 -0.17 0.00 0.02 0.00 0.00 55.97 55.99 2q89 s LYS 82 Cb -0.30 -0.13 0.24 0.00 -0.52 0.00 0.00 37.83 37.12 2q89 s LYS 82 CO 0.25 0.02 1.56 -1.35 -0.92 0.00 0.00 175.35 174.92 2q89 h PRO 83 N 5.18 -0.04 -0.14 -1.68 0.11 -1.75 0.42 132.00 134.11 2q89 h PRO 83 Ca -0.31 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.73 2q89 h PRO 83 Cb 1.20 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2q89 h PRO 83 CO 0.45 -0.02 -0.27 1.05 -0.21 0.00 0.00 178.00 179.00 2q89 h GLU 84 N -0.04 0.26 -0.18 1.05 9.09 -1.97 -1.42 114.58 121.38 2q89 h GLU 84 Ca 0.34 -0.09 -0.16 0.00 0.05 0.00 0.00 59.36 59.50 2q89 h GLU 84 Cb 0.60 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 2q89 h GLU 84 CO -0.91 0.51 -0.51 0.00 0.05 0.00 0.00 179.01 178.16 2q89 h ARG 85 N 0.23 0.66 -0.43 1.06 3.08 -1.46 -3.27 114.38 114.25 2q89 h ARG 85 Ca 0.04 -0.47 0.05 0.00 0.07 0.00 0.00 59.98 59.66 2q89 h ARG 85 Cb 0.60 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 2q89 h ARG 85 CO 0.04 1.09 0.29 0.00 -1.07 0.00 0.00 179.97 180.32 2q89 h ALA 87 N 1.76 1.00 0.00 0.00 0.00 -1.33 -3.28 119.26 117.41 2q89 h ALA 87 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2q89 h ALA 87 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2q89 h ALA 87 CO -0.04 0.00 -1.86 0.00 0.00 0.00 0.00 179.25 177.34 2q89 n ALA 88 N -1.94 2.79 -2.24 0.00 0.00 -0.44 -5.02 120.51 113.66 2q89 n ALA 88 Ca 0.02 -0.47 -0.13 0.00 0.00 0.00 0.00 53.44 52.86 2q89 n ALA 88 Cb 0.34 -0.67 -0.10 0.00 0.00 0.00 0.00 19.45 19.01 2q89 n ALA 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2q89 s VAL 89 N -3.34 0.37 -0.52 0.00 -7.23 -0.88 -4.64 120.40 104.16 2q89 s VAL 89 Ca -0.07 -1.98 -0.13 0.00 -1.81 0.00 0.00 61.98 57.99 2q89 s VAL 89 Cb 0.13 -2.37 0.13 0.00 0.56 0.00 0.00 36.38 34.82 2q89 s VAL 89 CO 0.82 -0.20 0.44 0.00 -0.31 0.00 0.00 175.10 175.85 2q89 s ALA 90 N -3.88 3.55 0.47 1.32 0.00 0.19 -4.72 121.76 118.68 2q89 s ALA 90 Ca 0.32 -2.56 -0.20 0.00 0.00 0.00 0.00 51.96 49.52 2q89 s ALA 90 Cb 0.07 -3.09 -0.09 0.00 0.00 0.00 0.00 23.12 20.01 2q89 s ALA 90 CO 0.09 -1.98 0.99 0.71 0.00 0.00 0.00 175.76 175.56 2q89 s TYR 91 N 1.46 3.21 1.05 0.00 2.02 -1.26 -0.52 117.35 123.31 2q89 s TYR 91 Ca 0.05 1.58 -0.17 0.00 -0.37 0.00 0.00 57.07 58.15 2q89 s TYR 91 Cb -0.28 -2.92 0.24 0.00 -0.40 0.00 0.00 41.96 38.60 2q89 s TYR 91 CO 0.01 -0.42 1.28 -1.54 -1.57 0.00 0.00 175.55 173.31 2q89 s SER 92 N -2.25 2.33 0.98 2.29 1.04 0.32 -4.94 113.70 113.48 2q89 s SER 92 Ca 0.63 0.31 -0.12 0.00 0.48 0.00 0.00 55.95 57.25 2q89 s SER 92 Cb -0.12 -0.36 0.18 0.00 0.10 0.00 0.00 66.02 65.82 2q89 s SER 92 CO 0.18 -3.22 1.08 -1.10 0.98 0.00 0.00 173.24 171.17 2q89 s GLN 93 N -5.80 0.54 0.57 4.02 -1.52 -1.26 -4.74 119.66 111.47 2q89 s GLN 93 Ca 0.74 0.73 -0.21 0.00 -1.95 0.00 0.00 55.36 54.68 2q89 s GLN 93 Cb -0.05 -1.73 -0.04 0.00 -0.22 0.00 0.00 33.01 30.97 2q89 s GLN 93 CO 0.54 -2.71 1.33 -2.14 -0.25 0.00 0.00 175.29 172.06 2q89 s PRO 94 N -4.86 3.03 0.09 2.91 0.02 -1.26 -4.57 135.00 130.37 2q89 s PRO 94 Ca 0.65 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.83 2q89 s PRO 94 Cb -0.20 -2.16 0.00 0.00 0.02 0.00 0.00 34.50 32.17 2q89 s PRO 94 CO 0.58 -1.25 0.00 -0.89 -0.33 0.00 0.00 177.00 175.11 2q89 n ILE 95 N -1.22 0.22 -3.89 2.83 5.41 -0.66 -4.83 119.36 117.22 2q89 n ILE 95 Ca 0.12 0.07 -0.35 0.00 1.00 0.00 0.00 62.75 63.58 2q89 n ILE 95 Cb 0.46 -0.65 -0.14 0.00 -0.71 0.00 0.00 39.64 38.60 2q89 n ILE 95 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2q89 s LEU 96 N -5.85 3.61 -0.06 1.39 1.43 -1.26 -4.75 118.68 113.19 2q89 s LEU 96 Ca 0.00 -0.96 -0.02 0.00 -1.03 0.00 0.00 54.13 52.12 2q89 s LEU 96 Cb 0.00 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 2q89 s LEU 96 CO 0.00 -0.19 0.04 0.00 0.23 0.00 0.00 176.35 176.42 2q89 s ASP 98 N -1.16 -0.54 0.62 0.00 2.15 0.40 -4.67 116.67 113.47 2q89 s ASP 98 Ca 0.16 0.09 0.01 0.00 0.43 0.00 0.00 52.55 53.24 2q89 s ASP 98 Cb -0.12 0.55 0.10 0.00 -0.30 0.00 0.00 42.92 43.16 2q89 s ASP 98 CO 0.06 -0.85 0.74 0.00 -0.17 0.00 0.00 175.17 174.95 2q89 n ALA 99 N -0.19 0.28 -2.78 3.66 0.00 -1.26 -1.26 120.51 118.96 2q89 n ALA 99 Ca -0.15 -1.52 -0.31 0.00 0.00 0.00 0.00 53.44 51.45 2q89 n ALA 99 Cb 0.63 0.28 -0.07 0.00 0.00 0.00 0.00 19.45 20.30 2q89 n ALA 99 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2q89 s GLU 100 N -4.40 2.97 0.12 0.00 0.41 -1.26 -1.78 118.70 114.77 2q89 s GLU 100 Ca 0.50 -0.60 0.03 0.00 -0.41 0.00 0.00 54.97 54.49 2q89 s GLU 100 Cb -0.03 -2.79 -0.04 0.00 -1.78 0.00 0.00 34.13 29.49 2q89 s GLU 100 CO 0.33 0.60 -0.08 0.00 -0.49 0.00 0.00 175.26 175.62 2q89 s ALA 101 N -1.31 1.23 -0.11 5.21 0.00 0.94 -0.04 121.76 127.69 2q89 s ALA 101 Ca 0.27 -1.42 -0.01 0.00 0.00 0.00 0.00 51.96 50.80 2q89 s ALA 101 Cb -0.12 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.07 2q89 s ALA 101 CO 0.19 -0.16 -0.09 -0.06 0.00 0.00 0.00 175.76 175.64 2q89 s PHE 102 N -3.46 2.90 -0.18 0.00 0.08 0.17 -2.71 117.98 114.78 2q89 s PHE 102 Ca 0.14 -0.31 -0.12 0.00 0.12 0.00 0.00 56.93 56.76 2q89 s PHE 102 Cb 0.04 -1.82 -0.05 0.00 -0.57 0.00 0.00 43.02 40.62 2q89 s PHE 102 CO -0.02 0.03 0.22 0.00 -0.10 0.00 0.00 175.22 175.34 2q89 s ALA 103 N -0.07 3.64 0.03 5.36 0.00 0.19 -0.96 121.76 129.95 2q89 s ALA 103 Ca -0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 2q89 s ALA 103 Cb -0.14 -2.29 0.01 0.00 0.00 0.00 0.00 23.12 20.70 2q89 s ALA 103 CO 0.03 0.11 0.22 -1.17 0.00 0.00 0.00 175.76 174.96 2q89 s LEU 104 N 0.44 1.23 0.41 0.00 2.96 0.47 -1.40 118.68 122.79 2q89 s LEU 104 Ca 0.12 -0.25 -0.26 0.00 -0.22 0.00 0.00 54.13 53.52 2q89 s LEU 104 Cb -0.12 1.04 -0.09 0.00 0.50 0.00 0.00 46.19 47.52 2q89 s LEU 104 CO 0.01 -0.53 1.35 -0.54 -1.32 0.00 0.00 176.35 175.32 2q89 s LYS 105 N -2.24 3.94 0.21 1.98 -0.14 -1.26 0.90 119.74 123.13 2q89 s LYS 105 Ca -0.07 2.26 -0.32 0.00 -1.36 0.00 0.00 55.97 56.47 2q89 s LYS 105 Cb -0.02 -2.77 -0.13 0.00 -1.68 0.00 0.00 37.83 33.22 2q89 s LYS 105 CO -0.02 -0.55 1.52 1.17 -0.76 0.00 0.00 175.35 176.71 2q89 n LYS 106 N 0.12 2.19 -0.12 1.68 4.81 0.90 -0.86 118.16 126.88 2q89 n LYS 106 Ca 0.04 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 2q89 n LYS 106 Cb 0.43 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 32.96 2q89 n LYS 106 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2q89 n GLY 107 N 2.81 2.06 3.51 3.14 0.00 -1.26 -4.52 105.19 110.93 2q89 n GLY 107 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 2q89 n GLY 107 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2q89 n ASN 108 N 0.00 -6.00 0.26 1.61 5.15 -0.04 -4.86 115.26 111.38 2q89 n ASN 108 Ca 0.00 -0.61 0.09 0.00 -0.60 0.00 0.00 54.58 53.46 2q89 n ASN 108 Cb 0.00 -3.09 0.68 0.00 -0.53 0.00 0.00 39.78 36.84 2q89 n ASN 108 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2q89 h PRO 109 N 0.03 0.00 -0.02 1.20 0.13 -1.79 -1.91 132.00 129.64 2q89 h PRO 109 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2q89 h PRO 109 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2q89 h PRO 109 CO 0.34 0.04 -0.17 1.28 -0.23 0.00 0.00 178.00 179.27 2q89 n LEU 110 N -4.30 1.70 -3.26 1.56 4.32 -1.26 -4.97 117.00 110.79 2q89 n LEU 110 Ca -0.03 -0.55 -0.19 0.00 -0.02 0.00 0.00 56.01 55.22 2q89 n LEU 110 Cb 0.13 -0.04 0.08 0.00 -1.62 0.00 0.00 43.42 41.96 2q89 n LEU 110 CO 0.33 0.30 0.17 0.61 -1.22 0.00 0.00 177.39 177.57 2q89 n GLY 111 N 1.30 -0.35 3.54 -0.72 0.00 -0.72 -4.96 105.19 103.28 2q89 n GLY 111 Ca 0.14 0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 2q89 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q89 s LEU 112 N -6.37 4.36 0.00 0.99 1.43 -1.26 -4.82 118.68 113.01 2q89 s LEU 112 Ca 0.29 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.24 2q89 s LEU 112 Cb -0.13 -2.84 0.00 0.00 0.03 0.00 0.00 46.19 43.25 2q89 s LEU 112 CO 0.66 -0.80 0.00 0.29 0.23 0.00 0.00 176.35 176.73 2q89 n LYS 113 N 6.42 2.75 -4.27 1.70 5.02 -1.26 -5.04 118.16 123.48 2q89 n LYS 113 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 2q89 n LYS 113 Cb 0.48 -0.75 -0.10 0.00 -0.02 0.00 0.00 35.03 34.64 2q89 n LYS 113 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2q89 s SER 114 N -1.07 1.06 0.42 4.39 1.04 -1.26 -1.44 113.70 116.83 2q89 s SER 114 Ca 0.00 -1.29 0.18 0.00 0.48 0.00 0.00 55.95 55.32 2q89 s SER 114 Cb 0.00 0.17 0.94 0.00 0.10 0.00 0.00 66.02 67.23 2q89 s SER 114 CO 0.00 -0.67 1.89 1.88 0.98 0.00 0.00 173.24 177.32 2q89 h TYR 115 N 2.56 0.00 -0.68 5.02 -1.99 -1.93 -2.85 116.97 117.10 2q89 h TYR 115 Ca -0.37 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.32 2q89 h TYR 115 Cb 1.23 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.93 2q89 h TYR 115 CO 0.48 0.28 0.29 -0.22 -0.00 0.00 0.00 178.16 178.99 2q89 h LYS 116 N 0.00 1.01 -1.01 4.88 3.64 -1.90 -2.41 116.57 120.78 2q89 h LYS 116 Ca -0.00 -0.17 0.13 0.00 -1.27 0.00 0.00 60.65 59.33 2q89 h LYS 116 Cb 0.57 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.14 2q89 h LYS 116 CO 0.04 0.83 0.63 -0.44 -2.27 0.00 0.00 179.45 178.24 2q89 h ASP 117 N 0.96 0.92 -0.32 4.20 3.32 -1.88 0.41 116.42 124.04 2q89 h ASP 117 Ca 0.23 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.31 2q89 h ASP 117 Cb 0.18 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2q89 h ASP 117 CO -0.02 0.47 0.10 0.40 -1.72 0.00 0.00 179.24 178.47 2q89 h ILE 118 N 0.97 1.20 -0.98 0.35 2.04 -1.50 -2.96 117.51 116.63 2q89 h ILE 118 Ca 0.51 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.72 2q89 h ILE 118 Cb 0.54 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.61 2q89 h ILE 118 CO -0.28 0.22 0.64 0.00 0.00 0.00 0.00 178.15 178.73 2q89 h ALA 119 N 0.94 1.25 0.00 1.87 0.00 -0.77 -2.81 119.26 119.74 2q89 h ALA 119 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2q89 h ALA 119 Cb 0.24 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2q89 h ALA 119 CO -0.00 0.65 0.00 -0.25 0.00 0.00 0.00 179.25 179.65 2q89 n ASP 120 N -4.38 0.00 -4.15 0.00 8.00 0.03 -4.54 116.55 111.50 2q89 n ASP 120 Ca 0.11 0.37 -0.34 0.00 0.71 0.00 0.00 54.79 55.64 2q89 n ASP 120 Cb 0.02 -0.45 -0.14 0.00 -0.02 0.00 0.00 41.12 40.53 2q89 n ASP 120 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2q89 s ASN 121 N -2.90 4.83 0.00 -2.24 3.84 -1.06 -5.00 114.94 112.42 2q89 s ASN 121 Ca 0.15 -1.32 0.11 0.00 0.21 0.00 0.00 52.86 52.01 2q89 s ASN 121 Cb 0.17 -1.69 0.47 0.00 -0.55 0.00 0.00 41.25 39.65 2q89 s ASN 121 CO 0.45 -0.26 1.33 -2.65 -2.79 0.00 0.00 177.10 173.18 2q89 n PRO 122 N 4.59 0.02 0.07 0.43 -0.02 -1.26 -1.75 135.00 137.08 2q89 n PRO 122 Ca -0.13 0.30 0.03 0.00 -2.02 0.00 0.00 63.50 61.68 2q89 n PRO 122 Cb 0.43 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.37 2q89 n PRO 122 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2q89 h ASP 123 N 0.00 0.00 -2.90 2.55 3.32 -1.94 -3.47 116.42 113.98 2q89 h ASP 123 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2q89 h ASP 123 Cb 0.17 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.69 2q89 h ASP 123 CO 0.00 0.43 0.90 0.00 -1.72 0.00 0.00 179.24 178.85 2q89 s ALA 124 N -3.03 3.65 -0.12 3.45 0.00 -0.72 -4.96 121.76 120.03 2q89 s ALA 124 Ca -0.01 0.49 -0.03 0.00 0.00 0.00 0.00 51.96 52.42 2q89 s ALA 124 Cb 0.09 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 2q89 s ALA 124 CO 0.79 -1.17 -0.02 0.15 0.00 0.00 0.00 175.76 175.52 2q89 s LYS 125 N 3.46 3.36 -0.18 0.00 1.02 -1.26 -4.91 119.74 121.24 2q89 s LYS 125 Ca 0.56 -0.47 -0.04 0.00 0.02 0.00 0.00 55.97 56.04 2q89 s LYS 125 Cb -0.23 -2.86 -0.02 0.00 -0.52 0.00 0.00 37.83 34.20 2q89 s LYS 125 CO 0.16 0.45 -0.03 -1.50 -0.92 0.00 0.00 175.35 173.51 2q89 s ILE 126 N -0.19 3.85 0.11 2.17 2.07 -0.31 -0.99 121.20 127.92 2q89 s ILE 126 Ca 0.04 -0.36 -0.24 0.00 -1.41 0.00 0.00 60.65 58.68 2q89 s ILE 126 Cb -0.13 -2.71 -0.07 0.00 0.13 0.00 0.00 42.46 39.68 2q89 s ILE 126 CO 0.02 0.46 0.72 -0.83 -1.91 0.00 0.00 174.94 173.41 2q89 s GLY 127 N 0.71 2.83 -0.02 1.50 0.00 0.15 -0.29 107.32 112.20 2q89 s GLY 127 Ca -0.01 0.26 -0.29 0.00 0.00 0.00 0.00 44.72 44.68 2q89 s GLY 127 CO 0.02 0.82 0.66 0.00 0.00 0.00 0.00 173.10 174.60 2q89 s ALA 128 N -0.87 -1.71 0.48 3.20 0.00 -0.60 -1.39 121.76 120.87 2q89 s ALA 128 Ca 0.35 1.16 -0.23 0.00 0.00 0.00 0.00 51.96 53.23 2q89 s ALA 128 Cb -0.22 0.14 -0.07 0.00 0.00 0.00 0.00 23.12 22.98 2q89 s ALA 128 CO 0.24 -0.43 1.30 -2.14 0.00 0.00 0.00 175.76 174.72 2q89 s PRO 129 N -1.61 3.57 0.05 0.00 0.02 -1.26 -0.44 135.00 135.34 2q89 s PRO 129 Ca -0.09 2.11 -0.31 0.00 0.02 0.00 0.00 61.00 62.73 2q89 s PRO 129 Cb -0.00 -2.46 -0.06 0.00 0.02 0.00 0.00 34.50 32.00 2q89 s PRO 129 CO 0.06 -0.81 1.32 0.20 -0.33 0.00 0.00 177.00 177.45 2q89 s GLY 130 N -0.97 2.07 0.00 0.52 0.00 -1.26 -2.95 107.32 104.73 2q89 s GLY 130 Ca 0.65 0.93 0.00 0.00 0.00 0.00 0.00 44.72 46.30 2q89 s GLY 130 CO 0.45 2.30 0.00 0.61 0.00 0.00 0.00 173.10 176.46 2q89 n GLY 131 N 3.45 0.90 3.85 0.20 0.00 -1.26 -0.91 105.19 111.41 2q89 n GLY 131 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 2q89 n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q89 n GLY 132 N -2.21 -0.12 0.26 -0.02 0.00 -1.15 -4.49 105.19 97.47 2q89 n GLY 132 Ca 0.00 -1.92 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 2q89 n GLY 132 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2q89 h THR 133 N -1.02 1.28 -0.57 2.61 1.35 -1.96 -3.02 112.91 111.58 2q89 h THR 133 Ca -0.36 -1.46 -0.08 0.00 -0.55 0.00 0.00 66.41 63.96 2q89 h THR 133 Cb 1.20 1.33 -0.02 0.00 -1.73 0.00 0.00 68.15 68.92 2q89 h THR 133 CO 0.33 0.49 0.06 -0.33 -0.25 0.00 0.00 175.52 175.83 2q89 h GLU 134 N 0.72 0.97 -0.04 4.72 3.07 -1.90 -0.59 114.58 121.53 2q89 h GLU 134 Ca 0.08 -0.28 0.02 0.00 -0.50 0.00 0.00 59.36 58.68 2q89 h GLU 134 Cb 0.87 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 2q89 h GLU 134 CO 0.08 0.94 -0.05 1.49 -1.40 0.00 0.00 179.01 180.07 2q89 h GLU 135 N 0.86 -0.06 -0.88 2.33 4.81 -1.79 -1.02 114.58 118.82 2q89 h GLU 135 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2q89 h GLU 135 Cb 0.46 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 2q89 h GLU 135 CO 0.02 -0.04 0.57 -0.22 -0.73 0.00 0.00 179.01 178.60 2q89 h LYS 136 N -0.07 1.18 -0.30 1.92 1.63 -1.37 -1.44 116.57 118.12 2q89 h LYS 136 Ca 0.04 -0.08 -0.09 0.00 -0.85 0.00 0.00 60.65 59.66 2q89 h LYS 136 Cb 0.12 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 31.47 2q89 h LYS 136 CO -0.08 0.80 -0.20 -0.07 -3.45 0.00 0.00 179.45 176.44 2q89 h LEU 137 N 1.20 0.56 0.27 5.20 3.38 -0.90 0.89 115.31 125.91 2q89 h LEU 137 Ca 0.32 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2q89 h LEU 137 Cb -0.11 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.49 2q89 h LEU 137 CO -0.07 0.77 -0.13 0.00 0.09 0.00 0.00 178.44 179.10 2q89 h ALA 138 N 1.28 -0.36 -0.61 1.53 0.00 -0.86 -1.33 119.26 118.91 2q89 h ALA 138 Ca 0.08 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.93 2q89 h ALA 138 Cb 0.63 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 2q89 h ALA 138 CO 0.04 -0.58 0.19 -0.07 0.00 0.00 0.00 179.25 178.83 2q89 h LEU 139 N -0.60 0.13 -1.51 0.00 3.38 -1.13 -1.39 115.31 114.19 2q89 h LEU 139 Ca -0.04 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2q89 h LEU 139 Cb 0.44 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2q89 h LEU 139 CO 0.06 0.08 -0.21 -0.33 0.09 0.00 0.00 178.44 178.12 2q89 h GLU 140 N 0.34 0.05 0.00 1.13 5.08 -0.76 -1.82 114.58 118.60 2q89 h GLU 140 Ca 0.31 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2q89 h GLU 140 Cb 0.43 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2q89 h GLU 140 CO -0.35 0.26 0.00 0.00 -1.00 0.00 0.00 179.01 177.92 2q89 n ALA 141 N -2.49 2.20 0.00 3.43 0.00 -0.51 -4.91 120.51 118.23 2q89 n ALA 141 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2q89 n ALA 141 Cb 0.28 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2q89 n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q89 n GLY 142 N 1.16 1.34 3.68 0.00 0.00 -0.68 -4.74 105.19 105.95 2q89 n GLY 142 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2q89 n GLY 142 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q89 s VAL 143 N -2.00 4.14 0.57 1.61 1.01 -0.59 -4.80 120.40 120.35 2q89 s VAL 143 Ca 0.00 1.47 -0.19 0.00 0.00 0.00 0.00 61.98 63.25 2q89 s VAL 143 Cb 0.00 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 2q89 s VAL 143 CO 0.00 -0.02 1.22 -2.84 0.00 0.00 0.00 175.10 173.46 2q89 s PRO 144 N 2.42 3.07 0.29 2.72 0.02 -1.26 -4.15 135.00 138.10 2q89 s PRO 144 Ca 0.57 1.86 0.01 0.00 0.02 0.00 0.00 61.00 63.47 2q89 s PRO 144 Cb -0.26 -2.01 0.69 0.00 0.02 0.00 0.00 34.50 32.95 2q89 s PRO 144 CO 0.22 -1.14 1.65 -0.09 -0.33 0.00 0.00 177.00 177.31 2q89 h ARG 145 N 1.06 0.19 0.00 5.54 9.65 -1.94 0.12 114.38 128.99 2q89 h ARG 145 Ca -0.50 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.36 2q89 h ARG 145 Cb 1.29 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.83 2q89 h ARG 145 CO 0.56 0.13 0.00 -0.40 2.80 0.00 0.00 179.97 183.06 2q89 n ASP 146 N -5.24 0.00 -0.21 -3.80 5.75 -1.26 -1.80 116.55 110.00 2q89 n ASP 146 Ca 0.21 -0.86 0.03 0.00 -0.01 0.00 0.00 54.79 54.16 2q89 n ASP 146 Cb 0.67 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.77 2q89 n ASP 146 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2q89 n ARG 147 N -0.93 0.97 -3.52 0.11 1.74 0.38 -4.88 116.66 110.53 2q89 n ARG 147 Ca 0.16 -0.71 -0.42 0.00 -0.77 0.00 0.00 57.85 56.11 2q89 n ARG 147 Cb 0.07 -1.05 -0.10 0.00 -1.02 0.00 0.00 32.46 30.36 2q89 n ARG 147 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2q89 s VAL 148 N -0.75 4.75 -0.25 1.55 1.01 -0.74 -1.16 120.40 124.81 2q89 s VAL 148 Ca 0.07 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 60.86 2q89 s VAL 148 Cb 0.05 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2q89 s VAL 148 CO 0.11 -0.44 0.21 -0.63 0.00 0.00 0.00 175.10 174.36 2q89 s ILE 149 N 1.56 5.31 0.05 2.22 -1.09 0.60 -4.94 121.20 124.91 2q89 s ILE 149 Ca 0.03 0.27 -0.31 0.00 -2.23 0.00 0.00 60.65 58.42 2q89 s ILE 149 Cb -0.22 -3.55 -0.07 0.00 -1.58 0.00 0.00 42.46 37.04 2q89 s ILE 149 CO 0.06 0.30 1.50 -0.69 -1.23 0.00 0.00 174.94 174.87 2q89 s VAL 150 N 1.33 3.36 -0.15 2.92 1.01 -1.26 -1.56 120.40 126.05 2q89 s VAL 150 Ca 0.09 0.82 0.02 0.00 0.00 0.00 0.00 61.98 62.91 2q89 s VAL 150 Cb -0.14 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2q89 s VAL 150 CO 0.07 0.01 -0.19 -0.69 0.00 0.00 0.00 175.10 174.29 2q89 s VAL 151 N 2.28 1.92 0.20 2.92 1.01 0.42 -4.87 120.40 124.29 2q89 s VAL 151 Ca 0.68 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 61.69 2q89 s VAL 151 Cb -0.36 -1.73 0.13 0.00 0.00 0.00 0.00 36.38 34.42 2q89 s VAL 151 CO 0.29 0.52 1.77 1.55 0.00 0.00 0.00 175.10 179.23 2q89 h PRO 152 N 7.65 1.08 -3.11 2.72 0.13 -1.95 -3.35 132.00 135.17 2q89 h PRO 152 Ca -0.38 -0.19 0.05 0.00 -0.87 0.00 0.00 66.00 64.61 2q89 h PRO 152 Cb 1.16 -0.18 -0.06 0.00 0.13 0.00 0.00 31.00 32.06 2q89 h PRO 152 CO 0.57 0.88 0.17 0.16 -0.23 0.00 0.00 178.00 179.55 2q89 s ASP 153 N -6.24 -0.22 0.30 1.44 1.47 -1.26 -4.93 116.67 107.22 2q89 s ASP 153 Ca -0.13 -0.68 0.01 0.00 1.18 0.00 0.00 52.55 52.94 2q89 s ASP 153 Cb 0.15 0.71 0.55 0.00 -0.34 0.00 0.00 42.92 43.98 2q89 s ASP 153 CO 0.82 -1.32 1.90 1.23 0.68 0.00 0.00 175.17 178.48 2q89 h GLY 154 N 2.04 1.37 1.66 2.12 0.00 -1.91 -1.77 103.07 106.60 2q89 h GLY 154 Ca -0.20 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.61 2q89 h GLY 154 CO 0.25 0.27 -0.34 1.46 0.00 0.00 0.00 176.54 178.18 2q89 h GLN 155 N 1.01 0.38 -0.23 4.80 4.20 -1.97 -1.76 115.11 121.54 2q89 h GLN 155 Ca 0.41 -0.16 -0.20 0.00 0.06 0.00 0.00 58.65 58.76 2q89 h GLN 155 Cb 0.28 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2q89 h GLN 155 CO -0.17 0.68 -0.63 0.77 -0.67 0.00 0.00 178.83 178.81 2q89 h SER 156 N 0.33 0.91 -0.44 1.46 0.02 -1.79 -2.72 113.55 111.32 2q89 h SER 156 Ca 0.04 -0.53 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 2q89 h SER 156 Cb 0.76 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2q89 h SER 156 CO 0.06 1.32 0.23 1.23 -1.14 0.00 0.00 176.83 178.53 2q89 h GLY 157 N 0.72 0.66 0.75 -3.77 0.00 -1.13 0.89 103.07 101.18 2q89 h GLY 157 Ca -0.01 -0.30 0.03 0.00 0.00 0.00 0.00 47.33 47.05 2q89 h GLY 157 CO 0.13 0.29 0.03 -2.00 0.00 0.00 0.00 176.54 175.00 2q89 h LEU 158 N 0.57 -0.01 -0.71 3.11 5.85 -1.38 -0.91 115.31 121.84 2q89 h LEU 158 Ca 0.15 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 2q89 h LEU 158 Cb 0.07 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2q89 h LEU 158 CO -0.02 0.03 0.25 0.50 -0.34 0.00 0.00 178.44 178.85 2q89 h LYS 159 N 0.12 1.08 -0.45 1.25 1.63 -1.24 -0.97 116.57 117.98 2q89 h LYS 159 Ca 0.10 -0.22 -0.03 0.00 -0.85 0.00 0.00 60.65 59.65 2q89 h LYS 159 Cb 0.10 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 2q89 h LYS 159 CO -0.13 0.91 0.14 0.52 -3.45 0.00 0.00 179.45 177.44 2q89 h MET 160 N 1.03 0.65 -0.21 1.90 2.86 -0.65 -0.26 114.93 120.24 2q89 h MET 160 Ca 0.23 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 2q89 h MET 160 Cb 0.26 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2q89 h MET 160 CO -0.01 0.57 -0.04 1.25 1.06 0.00 0.00 176.91 179.73 2q89 h LEU 161 N 0.64 0.40 -1.69 1.22 6.46 -0.76 0.17 115.31 121.75 2q89 h LEU 161 Ca 0.15 -0.36 -0.03 0.00 -0.12 0.00 0.00 57.88 57.52 2q89 h LEU 161 Cb 0.19 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 2q89 h LEU 161 CO -0.01 0.67 -0.13 1.56 -0.62 0.00 0.00 178.44 179.91 2q89 h GLN 162 N 0.13 0.03 0.00 1.25 4.20 -0.84 -2.62 115.11 117.26 2q89 h GLN 162 Ca 0.05 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2q89 h GLN 162 Cb 0.49 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.27 2q89 h GLN 162 CO 0.02 0.16 -0.40 -0.25 -0.67 0.00 0.00 178.83 177.69 2q89 n ASP 163 N -4.37 0.42 -0.17 1.46 8.00 -0.14 -4.95 116.55 116.81 2q89 n ASP 163 Ca -0.02 -0.02 -0.02 0.00 0.71 0.00 0.00 54.79 55.44 2q89 n ASP 163 Cb 0.21 0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.36 2q89 n ASP 163 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2q89 n GLY 164 N 1.47 0.50 0.15 0.44 0.00 -0.88 -4.93 105.19 101.95 2q89 n GLY 164 Ca 0.06 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 2q89 n GLY 164 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2q89 h ARG 165 N 0.00 0.37 -5.75 1.61 2.47 -1.24 -3.46 114.38 108.39 2q89 h ARG 165 Ca -0.04 -0.40 -0.48 0.00 -1.26 0.00 0.00 59.98 57.79 2q89 h ARG 165 Cb 0.27 0.11 -0.17 0.00 -1.65 0.00 0.00 29.97 28.53 2q89 h ARG 165 CO 0.06 1.08 -0.76 0.96 0.56 0.00 0.00 179.97 181.87 2q89 s ILE 166 N -3.26 1.73 -0.06 2.04 -4.36 -1.10 -4.87 121.20 111.31 2q89 s ILE 166 Ca -0.05 -1.99 0.22 0.00 -0.26 0.00 0.00 60.65 58.57 2q89 s ILE 166 Cb 0.09 -1.87 -0.31 0.00 1.25 0.00 0.00 42.46 41.62 2q89 s ILE 166 CO 0.86 -0.42 0.54 0.47 0.24 0.00 0.00 174.94 176.63 2q89 n ASP 167 N 0.10 0.09 -3.73 4.36 8.00 -0.16 -4.46 116.55 120.76 2q89 n ASP 167 Ca -0.12 0.02 -0.13 0.00 0.71 0.00 0.00 54.79 55.28 2q89 n ASP 167 Cb 0.58 1.84 -0.10 0.00 -0.02 0.00 0.00 41.12 43.42 2q89 n ASP 167 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2q89 s VAL 168 N -3.50 -0.00 -0.10 2.53 0.11 -1.11 -4.32 120.40 114.00 2q89 s VAL 168 Ca -0.07 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.01 2q89 s VAL 168 Cb 0.14 -0.58 -0.02 0.00 -1.53 0.00 0.00 36.38 34.39 2q89 s VAL 168 CO 0.90 0.01 -0.15 -0.47 -3.33 0.00 0.00 175.10 172.05 2q89 s TYR 169 N 0.40 2.73 -0.14 1.54 5.04 -0.49 0.32 117.35 126.75 2q89 s TYR 169 Ca -0.02 -0.55 0.00 0.00 -2.44 0.00 0.00 57.07 54.07 2q89 s TYR 169 Cb -0.04 -1.75 0.02 0.00 0.35 0.00 0.00 41.96 40.54 2q89 s TYR 169 CO -0.02 -0.12 -0.13 0.45 -1.34 0.00 0.00 175.55 174.39 2q89 s SER 170 N 0.01 2.61 0.37 4.32 0.15 -0.48 0.56 113.70 121.24 2q89 s SER 170 Ca -0.05 -0.46 0.06 0.00 0.70 0.00 0.00 55.95 56.20 2q89 s SER 170 Cb -0.14 -1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 63.01 2q89 s SER 170 CO 0.04 -0.06 0.23 -0.76 1.20 0.00 0.00 173.24 173.89 2q89 s LEU 171 N 1.51 1.87 0.68 3.45 1.43 -1.10 -4.57 118.68 121.94 2q89 s LEU 171 Ca 0.05 -1.77 -0.17 0.00 -1.03 0.00 0.00 54.13 51.21 2q89 s LEU 171 Cb -0.13 0.33 0.01 0.00 0.03 0.00 0.00 46.19 46.43 2q89 s LEU 171 CO -0.10 -1.05 1.25 -2.84 0.23 0.00 0.00 176.35 173.84 2q89 s PRO 172 N -3.50 2.40 0.23 1.29 0.02 -1.26 -0.04 135.00 134.15 2q89 s PRO 172 Ca 0.33 1.93 -0.08 0.00 0.02 0.00 0.00 61.00 63.21 2q89 s PRO 172 Cb 0.02 -1.84 0.38 0.00 0.02 0.00 0.00 34.50 33.08 2q89 s PRO 172 CO 0.23 -1.68 1.65 0.28 -0.33 0.00 0.00 177.00 177.16 2q89 h VAL 173 N 0.23 0.43 -0.59 3.83 2.07 -1.60 -0.85 116.25 119.77 2q89 h VAL 173 Ca -0.50 -0.05 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 2q89 h VAL 173 Cb 1.32 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2q89 h VAL 173 CO 0.52 0.02 0.04 -0.07 0.02 0.00 0.00 177.57 178.10 2q89 h LEU 174 N 0.14 0.98 -0.14 2.57 3.38 -1.92 0.02 115.31 120.35 2q89 h LEU 174 Ca 0.38 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2q89 h LEU 174 Cb 0.64 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2q89 h LEU 174 CO -0.58 1.01 0.04 0.28 0.09 0.00 0.00 178.44 179.28 2q89 h SER 175 N 0.93 0.20 -0.30 -0.43 0.02 -1.45 -1.56 113.55 110.96 2q89 h SER 175 Ca 0.18 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 2q89 h SER 175 Cb 0.49 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2q89 h SER 175 CO 0.02 0.35 0.14 0.40 -1.14 0.00 0.00 176.83 176.60 2q89 h ILE 176 N 0.04 1.15 -0.52 3.27 1.08 -1.05 -1.52 117.51 119.96 2q89 h ILE 176 Ca 0.04 -0.44 0.05 0.00 -0.39 0.00 0.00 64.86 64.13 2q89 h ILE 176 Cb 0.22 0.89 -0.05 0.00 -3.07 0.00 0.00 36.82 34.81 2q89 h ILE 176 CO -0.00 0.16 0.25 0.78 -0.69 0.00 0.00 178.15 178.65 2q89 h ASN 177 N 0.35 0.34 -0.44 1.72 2.35 -0.97 0.00 115.58 118.93 2q89 h ASN 177 Ca 0.10 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 2q89 h ASN 177 Cb 0.12 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 2q89 h ASN 177 CO -0.01 0.24 0.12 -0.78 -1.65 0.00 0.00 177.43 175.34 2q89 h ASP 178 N 0.48 0.66 -0.36 5.81 1.82 -1.16 -2.07 116.42 121.60 2q89 h ASP 178 Ca 0.24 -0.22 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 2q89 h ASP 178 Cb 0.17 -0.17 -0.02 0.00 0.68 0.00 0.00 39.33 39.99 2q89 h ASP 178 CO -0.18 0.71 0.16 0.25 -1.61 0.00 0.00 179.24 178.57 2q89 h LEU 179 N 0.58 0.48 -0.35 2.28 5.85 -0.88 -2.82 115.31 120.45 2q89 h LEU 179 Ca 0.14 -0.14 -0.19 0.00 0.84 0.00 0.00 57.88 58.53 2q89 h LEU 179 Cb 0.29 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2q89 h LEU 179 CO -0.00 0.49 -0.65 0.58 -0.34 0.00 0.00 178.44 178.52 2q89 h VAL 180 N 0.43 1.31 0.00 1.05 2.07 -0.98 -2.12 116.25 118.02 2q89 h VAL 180 Ca 0.12 -1.90 -0.03 0.00 0.82 0.00 0.00 66.70 65.71 2q89 h VAL 180 Cb 0.14 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 2q89 h VAL 180 CO -0.01 0.60 -0.16 0.77 0.02 0.00 0.00 177.57 178.78 2q89 h SER 181 N 0.49 0.00 0.66 0.57 4.64 -1.38 -1.93 113.55 116.60 2q89 h SER 181 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2q89 h SER 181 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2q89 h SER 181 CO 0.13 0.16 -0.72 0.29 -0.87 0.00 0.00 176.83 175.82 2q89 n LYS 182 N -3.61 0.24 0.08 4.77 5.02 -1.07 -4.39 118.16 119.19 2q89 n LYS 182 Ca -0.01 0.04 -0.07 0.00 -2.02 0.00 0.00 58.31 56.25 2q89 n LYS 182 Cb 0.29 -1.62 0.06 0.00 -0.02 0.00 0.00 35.03 33.74 2q89 n LYS 182 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2q89 h ALA 183 N 2.61 0.68 -5.90 7.82 0.00 -0.64 -3.48 119.26 120.36 2q89 h ALA 183 Ca 0.00 -0.62 -0.40 0.00 0.00 0.00 0.00 54.91 53.89 2q89 h ALA 183 Cb 0.69 -0.08 0.11 0.00 0.00 0.00 0.00 17.79 18.52 2q89 h ALA 183 CO 0.00 0.80 -0.72 -1.71 0.00 0.00 0.00 179.25 177.62 2q89 n ASN 184 N -3.80 -4.99 -4.02 0.00 2.85 -1.23 -4.99 115.26 99.08 2q89 n ASN 184 Ca -0.03 -0.61 -0.31 0.00 -0.11 0.00 0.00 54.58 53.52 2q89 n ASN 184 Cb 0.70 -4.82 -0.15 0.00 1.24 0.00 0.00 39.78 36.75 2q89 n ASN 184 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2q89 s ASP 185 N -3.59 4.09 0.19 1.20 -1.08 -1.26 -4.99 116.67 111.24 2q89 s ASP 185 Ca 0.45 -1.24 0.24 0.00 -0.52 0.00 0.00 52.55 51.47 2q89 s ASP 185 Cb -0.20 -1.38 0.91 0.00 -1.46 0.00 0.00 42.92 40.78 2q89 s ASP 185 CO 0.75 -0.20 1.71 -0.81 0.52 0.00 0.00 175.17 177.15 2q89 n PRO 186 N 4.55 0.18 0.03 4.34 -0.04 -1.26 -3.00 135.00 139.80 2q89 n PRO 186 Ca -0.14 0.31 0.12 0.00 -0.04 0.00 0.00 63.50 63.76 2q89 n PRO 186 Cb 0.43 -1.78 0.26 0.00 -0.04 0.00 0.00 33.50 32.37 2q89 n PRO 186 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2q89 n ASN 187 N -2.10 0.56 -4.90 3.54 5.03 -1.26 -4.80 115.26 111.33 2q89 n ASN 187 Ca 0.04 0.05 -0.33 0.00 0.87 0.00 0.00 54.58 55.21 2q89 n ASN 187 Cb 0.28 0.07 -0.05 0.00 -1.02 0.00 0.00 39.78 39.07 2q89 n ASN 187 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2q89 s VAL 188 N -3.09 5.29 -0.06 2.41 1.01 -1.16 -0.07 120.40 124.73 2q89 s VAL 188 Ca 0.09 -0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 2q89 s VAL 188 Cb 0.15 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.95 2q89 s VAL 188 CO 0.69 0.20 0.22 -0.70 0.00 0.00 0.00 175.10 175.50 2q89 s GLU 189 N -2.25 0.35 -0.11 2.72 2.12 0.26 -4.69 118.70 117.11 2q89 s GLU 189 Ca 0.34 0.11 -0.10 0.00 0.36 0.00 0.00 54.97 55.68 2q89 s GLU 189 Cb -0.13 0.16 -0.05 0.00 0.26 0.00 0.00 34.13 34.38 2q89 s GLU 189 CO 0.22 -0.06 0.22 0.08 -0.54 0.00 0.00 175.26 175.18 2q89 s VAL 190 N -0.34 5.36 -0.24 3.70 1.01 -1.26 -0.39 120.40 128.24 2q89 s VAL 190 Ca -0.04 0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.36 2q89 s VAL 190 Cb -0.03 -3.51 0.05 0.00 0.00 0.00 0.00 36.38 32.89 2q89 s VAL 190 CO 0.01 0.55 -0.11 -0.22 0.00 0.00 0.00 175.10 175.33 2q89 s LEU 191 N -0.62 2.94 -0.08 3.92 0.20 -0.14 -5.00 118.68 119.90 2q89 s LEU 191 Ca 0.16 -1.19 -0.07 0.00 0.69 0.00 0.00 54.13 53.72 2q89 s LEU 191 Cb -0.13 -1.42 0.03 0.00 -0.43 0.00 0.00 46.19 44.24 2q89 s LEU 191 CO 0.05 -0.17 0.22 0.00 -0.29 0.00 0.00 176.35 176.16 2q89 s ALA 192 N 1.23 -0.52 0.65 5.97 0.00 -1.26 -0.66 121.76 127.17 2q89 s ALA 192 Ca -0.06 0.66 -0.09 0.00 0.00 0.00 0.00 51.96 52.48 2q89 s ALA 192 Cb -0.18 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.55 2q89 s ALA 192 CO -0.07 -0.12 1.01 -1.25 0.00 0.00 0.00 175.76 175.34 2q89 s PRO 193 N 0.32 2.93 0.19 0.00 0.04 -1.26 -5.08 135.00 132.13 2q89 s PRO 193 Ca -0.02 0.29 -0.31 0.00 0.04 0.00 0.00 61.00 61.00 2q89 s PRO 193 Cb -0.03 -2.13 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 2q89 s PRO 193 CO -0.01 -0.87 1.57 0.08 0.04 0.00 0.00 177.00 177.81 2q89 s VAL 194 N -3.20 2.51 0.20 -0.36 1.01 0.94 -4.96 120.40 116.55 2q89 s VAL 194 Ca 0.56 0.38 -0.30 0.00 0.00 0.00 0.00 61.98 62.62 2q89 s VAL 194 Cb -0.11 -3.24 -0.09 0.00 0.00 0.00 0.00 36.38 32.94 2q89 s VAL 194 CO 0.49 0.04 1.32 -1.61 0.00 0.00 0.00 175.10 175.34 2q89 s GLU 195 N 0.86 4.38 0.00 2.72 0.41 -0.52 -3.01 118.70 123.54 2q89 s GLU 195 Ca 0.69 2.07 0.00 0.00 -0.41 0.00 0.00 54.97 57.32 2q89 s GLU 195 Cb -0.45 -3.19 0.00 0.00 -1.78 0.00 0.00 34.13 28.72 2q89 s GLU 195 CO 0.34 -0.27 0.00 0.41 -0.49 0.00 0.00 175.26 175.25 2q89 n GLY 196 N 2.38 1.80 3.81 -1.39 0.00 -1.26 -4.30 105.19 106.23 2q89 n GLY 196 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2q89 n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q89 s ALA 197 N -3.50 3.57 0.81 4.61 0.00 -1.16 -5.04 121.76 121.04 2q89 s ALA 197 Ca 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 51.96 51.89 2q89 s ALA 197 Cb 0.00 -2.65 0.08 0.00 0.00 0.00 0.00 23.12 20.55 2q89 s ALA 197 CO 0.00 0.40 1.12 -2.14 0.00 0.00 0.00 175.76 175.13 2q89 s PRO 198 N -1.28 1.89 -0.14 0.00 0.02 -1.26 -4.89 135.00 129.34 2q89 s PRO 198 Ca 0.31 1.33 -0.10 0.00 0.02 0.00 0.00 61.00 62.57 2q89 s PRO 198 Cb -0.19 -1.84 -0.05 0.00 0.02 0.00 0.00 34.50 32.44 2q89 s PRO 198 CO 0.20 -1.94 0.19 0.08 -0.33 0.00 0.00 177.00 175.20 2q89 s VAL 199 N -2.75 5.39 0.15 3.83 1.01 -1.26 -4.39 120.40 122.39 2q89 s VAL 199 Ca 0.64 0.33 0.09 0.00 0.00 0.00 0.00 61.98 63.04 2q89 s VAL 199 Cb -0.20 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2q89 s VAL 199 CO 0.55 0.51 -0.16 -0.31 0.00 0.00 0.00 175.10 175.69 2q89 s TYR 200 N -0.29 2.52 0.06 5.22 2.02 -0.39 -4.98 117.35 121.51 2q89 s TYR 200 Ca 0.14 -0.27 0.07 0.00 -0.37 0.00 0.00 57.07 56.64 2q89 s TYR 200 Cb -0.12 -1.29 -0.03 0.00 -0.40 0.00 0.00 41.96 40.12 2q89 s TYR 200 CO 0.03 0.45 -0.19 0.00 -1.57 0.00 0.00 175.55 174.26 2q89 s ASP 202 N -1.41 4.85 0.33 0.00 -4.77 -0.31 -0.67 116.67 114.69 2q89 s ASP 202 Ca 0.06 -0.84 -0.04 0.00 -3.30 0.00 0.00 52.55 48.42 2q89 s ASP 202 Cb -0.09 0.41 0.00 0.00 -1.09 0.00 0.00 42.92 42.15 2q89 s ASP 202 CO 0.02 -1.55 0.48 -0.83 0.70 0.00 0.00 175.17 174.00 2q89 s GLY 203 N -4.74 1.31 0.02 2.12 0.00 -1.26 -1.66 107.32 103.11 2q89 s GLY 203 Ca 0.64 -1.40 -0.30 0.00 0.00 0.00 0.00 44.72 43.66 2q89 s GLY 203 CO 0.41 -0.93 1.19 0.00 0.00 0.00 0.00 173.10 173.77 2q89 s ALA 204 N -3.18 3.41 -0.17 3.20 0.00 -1.26 -4.64 121.76 119.12 2q89 s ALA 204 Ca 0.29 0.76 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 2q89 s ALA 204 Cb -0.00 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 2q89 s ALA 204 CO 0.18 -0.53 0.09 0.00 0.00 0.00 0.00 175.76 175.49 2q89 s ALA 205 N 1.44 3.54 0.33 0.00 0.00 -0.42 -0.52 121.76 126.13 2q89 s ALA 205 Ca 0.58 -0.72 0.09 0.00 0.00 0.00 0.00 51.96 51.91 2q89 s ALA 205 Cb -0.27 -1.97 -0.06 0.00 0.00 0.00 0.00 23.12 20.82 2q89 s ALA 205 CO 0.27 0.26 -0.09 -0.06 0.00 0.00 0.00 175.76 176.13 2q89 s PHE 206 N 0.11 2.30 0.47 0.00 0.40 0.32 -1.00 117.98 120.58 2q89 s PHE 206 Ca 0.07 -0.53 -0.24 0.00 -0.60 0.00 0.00 56.93 55.63 2q89 s PHE 206 Cb -0.12 -1.30 -0.07 0.00 0.51 0.00 0.00 43.02 42.04 2q89 s PHE 206 CO 0.00 0.53 1.32 1.03 0.70 0.00 0.00 175.22 178.80 2q89 s ARG 207 N -3.63 3.61 0.26 0.44 0.52 -1.26 0.52 118.95 119.42 2q89 s ARG 207 Ca 0.32 2.17 -0.03 0.00 -0.52 0.00 0.00 55.73 57.67 2q89 s ARG 207 Cb 0.02 -2.52 0.53 0.00 0.52 0.00 0.00 34.95 33.51 2q89 s ARG 207 CO 0.15 -0.79 1.69 0.87 0.02 0.00 0.00 175.30 177.24 2q89 h LYS 208 N 2.11 0.30 0.00 3.54 1.79 -1.88 0.23 116.57 122.66 2q89 h LYS 208 Ca -0.50 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.95 2q89 h LYS 208 Cb 1.27 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 2q89 h LYS 208 CO 0.60 0.20 0.00 0.41 -1.08 0.00 0.00 179.45 179.58 2q89 n GLY 209 N -1.35 -0.84 1.73 3.86 0.00 -1.26 -2.77 105.19 104.55 2q89 n GLY 209 Ca 0.16 -0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 2q89 n GLY 209 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q89 n ASP 210 N -1.26 3.99 0.14 1.61 8.00 0.80 -4.27 116.55 125.56 2q89 n ASP 210 Ca 0.09 -3.75 0.04 0.00 0.71 0.00 0.00 54.79 51.87 2q89 n ASP 210 Cb 0.13 -0.70 0.44 0.00 -0.02 0.00 0.00 41.12 40.97 2q89 n ASP 210 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2q89 h GLU 211 N 1.34 0.20 -0.62 -1.24 -0.00 -1.57 -1.70 114.58 110.99 2q89 h GLU 211 Ca 0.40 -0.04 -0.08 0.00 -0.00 0.00 0.00 59.36 59.64 2q89 h GLU 211 Cb 1.76 -0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 30.46 2q89 h GLU 211 CO 0.81 0.30 0.06 0.00 -0.00 0.00 0.00 179.01 180.18 2q89 h ALA 212 N 1.73 0.93 -0.24 1.06 0.00 -1.87 0.11 119.26 120.97 2q89 h ALA 212 Ca 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2q89 h ALA 212 Cb 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2q89 h ALA 212 CO 0.01 0.65 0.10 1.25 0.00 0.00 0.00 179.25 181.27 2q89 h LEU 213 N 0.97 0.33 -0.60 0.00 5.85 -1.73 -2.63 115.31 117.49 2q89 h LEU 213 Ca 0.19 -0.15 0.10 0.00 0.84 0.00 0.00 57.88 58.85 2q89 h LEU 213 Cb 0.48 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 2q89 h LEU 213 CO 0.02 0.39 0.20 -0.09 -0.34 0.00 0.00 178.44 178.62 2q89 h ARG 214 N 0.24 0.36 -0.54 1.25 1.12 -0.96 -1.09 114.38 114.76 2q89 h ARG 214 Ca 0.08 -0.02 0.05 0.00 -1.11 0.00 0.00 59.98 58.98 2q89 h ARG 214 Cb 0.16 -0.08 -0.05 0.00 -0.01 0.00 0.00 29.97 29.99 2q89 h ARG 214 CO -0.01 0.24 0.27 -0.44 -3.11 0.00 0.00 179.97 176.92 2q89 h ASP 215 N 0.37 0.37 -0.17 -3.80 3.32 -0.72 -0.37 116.42 115.43 2q89 h ASP 215 Ca 0.31 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.38 2q89 h ASP 215 Cb 0.40 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2q89 h ASP 215 CO -0.33 0.25 0.04 0.00 -1.72 0.00 0.00 179.24 177.49 2q89 h ALA 216 N 1.30 0.22 -0.80 3.45 0.00 -1.02 -0.45 119.26 121.96 2q89 h ALA 216 Ca 0.24 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.14 2q89 h ALA 216 Cb 0.17 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.81 2q89 h ALA 216 CO -0.18 -0.15 0.41 0.35 0.00 0.00 0.00 179.25 179.68 2q89 h PHE 217 N 0.08 0.73 -0.18 0.00 3.04 -1.09 -2.24 116.94 117.29 2q89 h PHE 217 Ca 0.05 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.94 2q89 h PHE 217 Cb 0.25 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.54 2q89 h PHE 217 CO 0.01 0.22 -0.31 -0.44 -2.02 0.00 0.00 178.31 175.76 2q89 h ASP 218 N 0.64 0.36 -0.73 0.41 3.32 -0.65 -0.67 116.42 119.09 2q89 h ASP 218 Ca 0.42 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 2q89 h ASP 218 Cb 0.52 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 2q89 h ASP 218 CO -0.32 0.66 0.38 0.58 -1.72 0.00 0.00 179.24 178.82 2q89 h VAL 219 N 0.31 1.23 -0.15 -1.35 2.07 -0.48 -1.27 116.25 116.61 2q89 h VAL 219 Ca 0.04 -0.60 -0.12 0.00 0.82 0.00 0.00 66.70 66.85 2q89 h VAL 219 Cb 0.70 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2q89 h VAL 219 CO 0.05 0.26 -0.36 -0.33 0.02 0.00 0.00 177.57 177.21 2q89 h GLU 220 N 1.01 0.51 -0.62 1.57 4.39 -1.33 -2.73 114.58 117.38 2q89 h GLU 220 Ca 0.25 -0.35 0.12 0.00 0.34 0.00 0.00 59.36 59.72 2q89 h GLU 220 Cb 0.07 0.05 -0.09 0.00 -0.10 0.00 0.00 28.75 28.68 2q89 h GLU 220 CO -0.04 0.96 0.13 1.25 -1.16 0.00 0.00 179.01 180.16 2q89 h LEU 221 N 0.14 -0.01 -0.94 1.33 5.85 -1.00 0.69 115.31 121.37 2q89 h LEU 221 Ca -0.00 0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2q89 h LEU 221 Cb 0.97 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 2q89 h LEU 221 CO 0.08 -0.00 0.45 0.00 -0.34 0.00 0.00 178.44 178.62 2q89 h ALA 222 N 1.50 1.18 -0.20 1.25 0.00 -1.21 -0.07 119.26 121.71 2q89 h ALA 222 Ca 0.33 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 2q89 h ALA 222 Cb 0.50 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2q89 h ALA 222 CO -0.42 0.65 -0.46 0.87 0.00 0.00 0.00 179.25 179.88 2q89 h LYS 223 N 1.20 0.52 -0.43 0.00 1.57 -1.05 -1.30 116.57 117.08 2q89 h LYS 223 Ca 0.30 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 2q89 h LYS 223 Cb 0.06 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2q89 h LYS 223 CO -0.04 0.87 0.17 -0.07 -0.57 0.00 0.00 179.45 179.81 2q89 h LEU 224 N 0.42 0.60 -0.53 2.94 4.07 -0.42 -2.43 115.31 119.96 2q89 h LEU 224 Ca 0.03 -0.17 -0.02 0.00 0.08 0.00 0.00 57.88 57.80 2q89 h LEU 224 Cb 0.97 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.53 2q89 h LEU 224 CO 0.09 0.60 0.25 0.11 -1.08 0.00 0.00 178.44 178.41 2q89 h LYS 225 N 0.55 0.76 -0.67 1.13 1.57 -0.92 -0.49 116.57 118.50 2q89 h LYS 225 Ca 0.14 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 2q89 h LYS 225 Cb 0.19 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 2q89 h LYS 225 CO -0.01 0.63 0.17 1.49 -0.57 0.00 0.00 179.45 181.16 2q89 h GLU 226 N 0.70 1.08 0.00 3.15 4.57 -1.13 -3.11 114.58 119.84 2q89 h GLU 226 Ca 0.18 -0.26 -0.14 0.00 -1.18 0.00 0.00 59.36 57.96 2q89 h GLU 226 Cb 0.12 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2q89 h GLU 226 CO -0.02 0.96 -0.66 0.66 -1.18 0.00 0.00 179.01 178.76 2q89 h SER 227 N 1.01 0.00 0.00 1.04 4.64 -1.44 -3.47 113.55 115.33 2q89 h SER 227 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2q89 h SER 227 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2q89 h SER 227 CO 0.00 0.66 0.00 0.61 -0.87 0.00 0.00 176.83 177.24 2q89 n GLY 228 N 0.95 0.38 0.28 -0.77 0.00 -1.05 -4.97 105.19 100.02 2q89 n GLY 228 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 2q89 n GLY 228 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2q89 h GLU 229 N 3.64 0.59 -0.19 1.61 4.57 -1.67 -2.38 114.58 120.75 2q89 h GLU 229 Ca 0.00 -0.12 0.05 0.00 -1.18 0.00 0.00 59.36 58.11 2q89 h GLU 229 Cb 0.00 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.45 2q89 h GLU 229 CO 0.00 0.59 -0.15 0.35 -1.18 0.00 0.00 179.01 178.62 2q89 h PHE 230 N 0.57 -0.37 -0.60 0.92 3.57 -1.42 -2.04 116.94 117.57 2q89 h PHE 230 Ca 0.13 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.68 2q89 h PHE 230 Cb 0.30 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 2q89 h PHE 230 CO 0.01 -0.22 0.39 0.00 -2.23 0.00 0.00 178.31 176.27 2q89 h ALA 231 N 0.97 1.69 0.00 2.41 0.00 -1.72 -2.21 119.26 120.40 2q89 h ALA 231 Ca 0.12 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2q89 h ALA 231 Cb 0.32 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2q89 h ALA 231 CO -0.29 0.25 -0.47 0.87 0.00 0.00 0.00 179.25 179.62 2q89 h LYS 232 N 0.70 0.00 0.17 0.00 1.79 -0.91 -2.19 116.57 116.12 2q89 h LYS 232 Ca 0.24 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.45 2q89 h LYS 232 Cb 0.09 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.75 2q89 h LYS 232 CO -0.06 0.47 -1.20 0.82 -1.08 0.00 0.00 179.45 178.39 2q89 h ILE 233 N 0.00 1.29 0.00 1.86 2.04 -0.91 -3.41 117.51 118.37 2q89 h ILE 233 Ca -0.00 -2.54 -0.19 0.00 1.00 0.00 0.00 64.86 63.12 2q89 h ILE 233 Cb 0.83 3.01 -0.03 0.00 -0.74 0.00 0.00 36.82 39.88 2q89 h ILE 233 CO 0.06 0.75 -1.80 2.30 0.00 0.00 0.00 178.15 179.46 2q89 n ILE 234 N -3.93 1.01 0.12 -0.67 -5.35 -0.87 -4.47 119.36 105.19 2q89 n ILE 234 Ca -0.18 -0.70 -0.02 0.00 -0.27 0.00 0.00 62.75 61.58 2q89 n ILE 234 Cb 0.93 -0.52 0.08 0.00 -1.74 0.00 0.00 39.64 38.40 2q89 n ILE 234 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2q89 h GLU 235 N 0.00 0.00 -0.01 6.28 5.08 -1.55 -2.24 114.58 122.14 2q89 h GLU 235 Ca -0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2q89 h GLU 235 Cb 1.65 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.90 2q89 h GLU 235 CO 0.03 0.71 0.10 -1.35 -1.00 0.00 0.00 179.01 177.50 2q89 h PRO 236 N 0.00 0.00 0.00 2.33 0.11 -1.79 -1.17 132.00 131.48 2q89 h PRO 236 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2q89 h PRO 236 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2q89 h PRO 236 CO 0.09 0.00 -0.48 0.66 -0.21 0.00 0.00 178.00 178.06 2q89 n TYR 237 N -3.07 0.15 0.00 0.65 4.01 -0.85 -4.96 117.16 113.09 2q89 n TYR 237 Ca -0.03 0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 2q89 n TYR 237 Cb 0.17 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 38.81 2q89 n TYR 237 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2q89 n GLY 238 N 1.45 0.62 3.82 2.72 0.00 -0.44 -4.84 105.19 108.53 2q89 n GLY 238 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2q89 n GLY 238 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q89 s PHE 239 N -2.00 3.22 -0.28 1.61 0.40 -1.16 -4.99 117.98 114.78 2q89 s PHE 239 Ca 0.00 1.47 -0.10 0.00 -0.60 0.00 0.00 56.93 57.70 2q89 s PHE 239 Cb 0.00 -2.89 -0.04 0.00 0.51 0.00 0.00 43.02 40.59 2q89 s PHE 239 CO 0.00 -0.82 0.17 0.45 0.70 0.00 0.00 175.22 175.72 2q89 s SER 240 N -3.10 5.84 0.13 1.36 0.15 -1.26 -4.14 113.70 112.67 2q89 s SER 240 Ca 0.61 -0.08 -0.13 0.00 0.70 0.00 0.00 55.95 57.04 2q89 s SER 240 Cb -0.13 -2.08 -0.02 0.00 -1.71 0.00 0.00 66.02 62.07 2q89 s SER 240 CO 0.38 -0.06 1.53 0.00 1.20 0.00 0.00 173.24 176.29 2q89 h ALA 241 N 8.35 0.56 -0.89 5.45 0.00 -1.92 -3.23 119.26 127.57 2q89 h ALA 241 Ca -0.35 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.28 2q89 h ALA 241 Cb 1.18 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2q89 h ALA 241 CO 0.56 0.44 0.57 -0.22 0.00 0.00 0.00 179.25 180.60 2q89 h LYS 242 N 0.60 1.04 0.05 0.00 3.64 -1.97 -0.93 116.57 119.00 2q89 h LYS 242 Ca 0.10 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 2q89 h LYS 242 Cb 0.63 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 2q89 h LYS 242 CO 0.04 0.69 -0.20 0.00 -2.27 0.00 0.00 179.45 177.71 2q89 h ALA 243 N 1.39 -0.29 -0.87 5.00 0.00 -1.98 0.21 119.26 122.72 2q89 h ALA 243 Ca 0.37 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.28 2q89 h ALA 243 Cb 0.09 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2q89 h ALA 243 CO -0.15 -0.71 0.58 0.00 0.00 0.00 0.00 179.25 178.97 2q89 h ALA 244 N 0.51 1.11 0.00 0.00 0.00 -1.50 -2.27 119.26 117.11 2q89 h ALA 244 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2q89 h ALA 244 Cb 0.39 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2q89 h ALA 244 CO -0.15 0.50 0.00 0.52 0.00 0.00 0.00 179.25 180.12 2q89 h MET 245 N 1.18 0.00 -0.00 0.00 2.07 -0.86 -3.20 114.93 114.12 2q89 h MET 245 Ca 0.32 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.95 2q89 h MET 245 Cb -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.61 2q89 h MET 245 CO -0.07 0.00 -0.14 0.43 1.07 0.00 0.00 176.91 178.20 2q89 n SER 246 N -2.53 0.19 -2.97 1.22 7.64 0.70 -4.93 113.62 112.95 2q89 n SER 246 Ca 0.03 0.11 -0.17 0.00 1.01 0.00 0.00 58.87 59.86 2q89 n SER 246 Cb 0.35 -0.24 -0.06 0.00 -1.01 0.00 0.00 64.21 63.26 2q89 n SER 246 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2q89 n THR 247 N -1.41 0.00 -4.26 0.44 5.66 -1.21 -5.08 114.28 108.43 2q89 n THR 247 Ca 0.08 -1.78 -0.14 0.00 -3.05 0.00 0.00 64.05 59.16 2q89 n THR 247 Cb 0.32 0.76 -0.10 0.00 -1.55 0.00 0.00 70.33 69.76 2q89 n THR 247 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2q89 s THR 248 N -2.84 0.65 0.16 1.09 -4.23 -1.26 -4.79 115.64 104.42 2q89 s THR 248 Ca 0.22 -1.99 -0.17 0.00 -1.18 0.00 0.00 61.69 58.58 2q89 s THR 248 Cb 0.01 -2.24 0.05 0.00 1.34 0.00 0.00 72.50 71.66 2q89 s THR 248 CO 0.16 -0.37 1.70 -0.09 -0.54 0.00 0.00 174.62 175.48 2q89 h ARG 249 N 2.62 0.08 -0.68 3.99 2.43 -1.92 -2.72 114.38 118.19 2q89 h ARG 249 Ca -0.37 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 58.77 2q89 h ARG 249 Cb 1.21 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.71 2q89 h ARG 249 CO 0.62 0.06 0.30 1.49 -1.51 0.00 0.00 179.97 180.93 2q89 h GLU 250 N 0.09 0.97 -0.52 0.20 4.81 -1.96 0.51 114.58 118.67 2q89 h GLU 250 Ca 0.17 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2q89 h GLU 250 Cb 0.24 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2q89 h GLU 250 CO -0.30 0.77 0.27 0.87 -0.73 0.00 0.00 179.01 179.88 2q89 h LYS 251 N 0.96 0.74 0.00 1.92 1.57 -1.94 -1.57 116.57 118.26 2q89 h LYS 251 Ca 0.23 -0.10 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 2q89 h LYS 251 Cb 0.13 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2q89 h LYS 251 CO -0.03 0.60 -0.56 -0.07 -0.57 0.00 0.00 179.45 178.82 2q89 h LEU 252 N 0.70 0.00 -0.00 2.94 3.38 -1.12 -3.02 115.31 118.18 2q89 h LEU 252 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2q89 h LEU 252 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2q89 h LEU 252 CO -0.03 0.56 -0.28 0.00 0.09 0.00 0.00 178.44 178.79 2q89 s ALA 254 N -2.99 3.23 -1.15 0.00 0.00 -0.60 -4.08 121.76 116.16 2q89 s ALA 254 Ca 0.12 0.96 -0.22 0.00 0.00 0.00 0.00 51.96 52.83 2q89 s ALA 254 Cb 0.18 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 2q89 s ALA 254 CO 0.62 -0.44 1.81 0.00 0.00 0.00 0.00 175.76 177.74 2q89 s ALA 255 N -1.36 2.39 -1.35 0.00 0.00 -1.26 -4.73 121.76 115.44 2q89 s ALA 255 Ca 0.54 -2.31 0.11 0.00 0.00 0.00 0.00 51.96 50.30 2q89 s ALA 255 Cb -0.31 -4.63 0.09 0.00 0.00 0.00 0.00 23.12 18.27 2q89 s ALA 255 CO 0.39 -4.33 0.84 1.63 0.00 0.00 0.00 175.76 174.30