#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fr2 s LEU 5 N 0.00 4.40 0.36 -2.67 2.96 -1.26 -4.30 118.68 118.16 2fr2 s LEU 5 Ca 0.00 2.01 -0.28 0.00 -0.22 0.00 0.00 54.13 55.63 2fr2 s LEU 5 Cb 0.00 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 43.00 2fr2 s LEU 5 CO 0.00 -0.39 1.47 0.00 -1.32 0.00 0.00 176.35 176.11 2fr2 s ALA 6 N 0.70 3.58 0.40 5.97 0.00 -1.26 -4.89 121.76 126.26 2fr2 s ALA 6 Ca 0.56 1.51 0.16 0.00 0.00 0.00 0.00 51.96 54.18 2fr2 s ALA 6 Cb -0.29 -3.59 1.03 0.00 0.00 0.00 0.00 23.12 20.27 2fr2 s ALA 6 CO 0.31 -0.97 1.85 -1.35 0.00 0.00 0.00 175.76 175.60 2fr2 h PRO 7 N 3.34 0.45 0.00 0.00 0.11 -1.94 -0.95 132.00 133.01 2fr2 h PRO 7 Ca -0.50 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2fr2 h PRO 7 Cb 1.23 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2fr2 h PRO 7 CO 0.66 0.30 -0.02 0.00 -0.21 0.00 0.00 178.00 178.73 2fr2 h ALA 8 N 1.61 1.14 -0.13 -0.75 0.00 -1.96 -2.35 119.26 116.83 2fr2 h ALA 8 Ca 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2fr2 h ALA 8 Cb 1.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2fr2 h ALA 8 CO -0.20 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.36 2fr2 n LEU 9 N -3.31 2.23 -0.26 0.00 4.77 -0.36 -4.58 117.00 115.50 2fr2 n LEU 9 Ca -0.02 -0.84 -0.02 0.00 -0.03 0.00 0.00 56.01 55.10 2fr2 n LEU 9 Cb 0.15 -0.07 0.10 0.00 -2.33 0.00 0.00 43.42 41.26 2fr2 n LEU 9 CO 0.24 0.42 1.14 -0.61 -1.33 0.00 0.00 177.39 177.25 2fr2 h GLN 10 N 3.22 0.80 0.00 3.23 5.75 -1.52 -0.61 115.11 125.99 2fr2 h GLN 10 Ca 0.00 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 2fr2 h GLN 10 Cb 0.70 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.06 2fr2 h GLN 10 CO 0.00 0.53 -0.14 0.00 -2.65 0.00 0.00 178.83 176.57 2fr2 h ALA 11 N 1.34 1.52 -0.59 3.38 0.00 -1.85 -2.19 119.26 120.87 2fr2 h ALA 11 Ca 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2fr2 h ALA 11 Cb 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2fr2 h ALA 11 CO -0.15 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.56 2fr2 n LEU 12 N -4.01 3.32 0.11 0.00 4.77 -0.28 -4.46 117.00 116.44 2fr2 n LEU 12 Ca -0.02 -1.63 0.09 0.00 -0.03 0.00 0.00 56.01 54.41 2fr2 n LEU 12 Cb 0.23 -0.39 0.56 0.00 -2.33 0.00 0.00 43.42 41.49 2fr2 n LEU 12 CO 0.33 0.82 1.13 0.77 -1.33 0.00 0.00 177.39 179.10 2fr2 h SER 13 N 3.70 0.19 0.12 -1.43 4.64 -0.84 -0.43 113.55 119.50 2fr2 h SER 13 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fr2 h SER 13 Cb 0.84 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2fr2 h SER 13 CO 0.00 0.13 0.00 -2.65 -0.87 0.00 0.00 176.83 173.44 2fr2 n PRO 14 N -4.49 0.14 0.19 4.77 -0.02 -1.26 -1.54 135.00 132.79 2fr2 n PRO 14 Ca 0.02 0.59 0.07 0.00 -2.02 0.00 0.00 63.50 62.16 2fr2 n PRO 14 Cb 0.18 -1.91 0.34 0.00 -0.02 0.00 0.00 33.50 32.10 2fr2 n PRO 14 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2fr2 h LEU 15 N 0.00 0.00 -9.67 2.45 4.07 -1.42 -3.46 115.31 107.29 2fr2 h LEU 15 Ca 0.00 0.00 -0.54 0.00 0.08 0.00 0.00 57.88 57.42 2fr2 h LEU 15 Cb 0.06 0.00 0.07 0.00 1.08 0.00 0.00 40.66 41.87 2fr2 h LEU 15 CO 0.00 0.34 0.88 0.18 -1.08 0.00 0.00 178.44 178.76 2fr2 n LEU 16 N -3.47 3.84 0.00 1.67 4.77 -0.59 -4.49 117.00 118.74 2fr2 n LEU 16 Ca 0.00 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.09 2fr2 n LEU 16 Cb 0.50 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 2fr2 n LEU 16 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2fr2 n GLY 17 N 3.01 0.57 3.64 -0.72 0.00 -0.41 -4.95 105.19 106.33 2fr2 n GLY 17 Ca 0.13 -2.18 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 2fr2 n GLY 17 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fr2 s SER 18 N -4.00 4.90 0.02 1.61 0.01 -1.26 -1.23 113.70 113.75 2fr2 s SER 18 Ca 0.00 -0.03 0.04 0.00 1.31 0.00 0.00 55.95 57.27 2fr2 s SER 18 Cb 0.00 -1.25 -0.02 0.00 0.21 0.00 0.00 66.02 64.97 2fr2 s SER 18 CO 0.00 0.31 -0.11 0.26 0.41 0.00 0.00 173.24 174.10 2fr2 s TRP 19 N -0.99 1.00 -0.03 2.43 0.52 0.17 -0.19 118.94 121.85 2fr2 s TRP 19 Ca 0.17 -0.30 -0.05 0.00 0.02 0.00 0.00 56.10 55.94 2fr2 s TRP 19 Cb -0.11 -0.61 0.01 0.00 -1.15 0.00 0.00 33.47 31.60 2fr2 s TRP 19 CO 0.07 0.00 0.13 0.00 0.02 0.00 0.00 176.95 177.17 2fr2 s ALA 20 N -0.68 -0.31 0.00 0.98 0.00 -0.44 -0.92 121.76 120.39 2fr2 s ALA 20 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.11 2fr2 s ALA 20 Cb -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2fr2 s ALA 20 CO 0.01 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.05 2fr2 n GLY 21 N 2.36 1.55 3.33 0.00 0.00 0.03 -0.62 105.19 111.84 2fr2 n GLY 21 Ca -0.17 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 2fr2 n GLY 21 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2fr2 s ARG 22 N 4.22 0.68 0.00 1.61 3.52 -0.83 -1.19 118.95 126.95 2fr2 s ARG 22 Ca 0.00 0.23 0.00 0.00 -0.13 0.00 0.00 55.73 55.83 2fr2 s ARG 22 Cb 0.00 0.32 0.00 0.00 -1.56 0.00 0.00 34.95 33.71 2fr2 s ARG 22 CO 0.00 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 174.74 2fr2 n GLY 23 N 1.86 3.57 3.22 8.12 0.00 0.23 -1.79 105.19 120.40 2fr2 n GLY 23 Ca -0.18 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 2fr2 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr2 s ALA 24 N -1.57 -0.63 0.09 4.61 0.00 -0.27 -1.59 121.76 122.39 2fr2 s ALA 24 Ca 0.00 0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.05 2fr2 s ALA 24 Cb 0.00 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.30 2fr2 s ALA 24 CO 0.00 -0.34 -0.11 0.20 0.00 0.00 0.00 175.76 175.52 2fr2 s GLY 25 N -1.76 0.82 0.10 0.00 0.00 0.03 -1.80 107.32 104.71 2fr2 s GLY 25 Ca -0.09 -1.09 -0.23 0.00 0.00 0.00 0.00 44.72 43.31 2fr2 s GLY 25 CO -0.00 -1.15 0.56 -1.59 0.00 0.00 0.00 173.10 170.91 2fr2 s LYS 26 N -2.39 1.16 -0.13 2.90 -2.85 -0.14 -1.55 119.74 116.74 2fr2 s LYS 26 Ca 0.02 -0.37 -0.30 0.00 -1.00 0.00 0.00 55.97 54.32 2fr2 s LYS 26 Cb -0.05 0.53 0.12 0.00 -2.06 0.00 0.00 37.83 36.37 2fr2 s LYS 26 CO 0.01 -0.47 0.96 -0.47 0.10 0.00 0.00 175.35 175.48 2fr2 s TYR 27 N -3.15 -0.38 0.65 1.78 5.04 -1.26 -4.31 117.35 115.72 2fr2 s TYR 27 Ca -0.02 0.60 0.34 0.00 -2.44 0.00 0.00 57.07 55.56 2fr2 s TYR 27 Cb -0.00 0.46 1.89 0.00 0.35 0.00 0.00 41.96 44.65 2fr2 s TYR 27 CO -0.07 -0.39 2.10 -1.35 -1.34 0.00 0.00 175.55 174.50 2fr2 h PRO 28 N 2.50 0.00 -0.31 4.97 0.11 -1.99 -1.96 132.00 135.33 2fr2 h PRO 28 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 2fr2 h PRO 28 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fr2 h PRO 28 CO 0.31 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.35 2fr2 n THR 29 N -3.18 0.45 -4.25 -1.15 -2.24 -1.26 -4.97 114.28 97.68 2fr2 n THR 29 Ca -0.01 -0.72 -0.14 0.00 -2.27 0.00 0.00 64.05 60.91 2fr2 n THR 29 Cb 0.28 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.43 2fr2 n THR 29 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 2fr2 s ILE 30 N -1.42 0.43 0.24 2.28 -4.36 -0.74 -5.15 121.20 112.49 2fr2 s ILE 30 Ca 0.33 -1.98 -0.25 0.00 -0.26 0.00 0.00 60.65 58.49 2fr2 s ILE 30 Cb 0.20 -2.37 -0.09 0.00 1.25 0.00 0.00 42.46 41.45 2fr2 s ILE 30 CO 0.28 -0.21 0.84 -0.13 0.24 0.00 0.00 174.94 175.96 2fr2 s ARG 31 N -4.02 4.53 0.78 0.37 0.52 -1.26 -4.45 118.95 115.42 2fr2 s ARG 31 Ca 0.32 1.18 -0.14 0.00 -0.52 0.00 0.00 55.73 56.57 2fr2 s ARG 31 Cb 0.07 -3.01 0.04 0.00 0.52 0.00 0.00 34.95 32.58 2fr2 s ARG 31 CO 0.09 0.42 1.02 -2.30 0.02 0.00 0.00 175.30 174.54 2fr2 n PRO 32 N 1.00 0.27 -3.88 3.54 -0.02 -1.26 -4.81 135.00 129.84 2fr2 n PRO 32 Ca -0.02 0.16 -0.09 0.00 -2.02 0.00 0.00 63.50 61.53 2fr2 n PRO 32 Cb 0.50 -2.28 -0.05 0.00 -0.02 0.00 0.00 33.50 31.65 2fr2 n PRO 32 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2fr2 s PHE 33 N -2.02 0.15 0.21 6.00 -0.12 -0.59 -5.01 117.98 116.60 2fr2 s PHE 33 Ca 0.72 -0.51 0.07 0.00 -0.05 0.00 0.00 56.93 57.16 2fr2 s PHE 33 Cb -0.31 0.24 -0.05 0.00 -0.63 0.00 0.00 43.02 42.27 2fr2 s PHE 33 CO 0.52 -0.91 -0.12 -1.21 -0.05 0.00 0.00 175.22 173.45 2fr2 s GLU 34 N -3.94 1.33 0.05 1.99 2.02 -1.26 -0.79 118.70 118.10 2fr2 s GLU 34 Ca 0.15 -1.61 -0.18 0.00 0.02 0.00 0.00 54.97 53.35 2fr2 s GLU 34 Cb -0.00 -1.05 0.04 0.00 0.10 0.00 0.00 34.13 33.21 2fr2 s GLU 34 CO 0.02 0.14 0.42 1.52 0.02 0.00 0.00 175.26 177.38 2fr2 s TYR 35 N -3.03 -0.27 0.17 1.61 -0.85 -0.62 -4.25 117.35 110.11 2fr2 s TYR 35 Ca 0.23 0.23 -0.06 0.00 -0.52 0.00 0.00 57.07 56.94 2fr2 s TYR 35 Cb 0.00 0.23 -0.06 0.00 0.38 0.00 0.00 41.96 42.51 2fr2 s TYR 35 CO 0.07 -0.58 0.43 -0.51 -1.52 0.00 0.00 175.55 173.44 2fr2 s LEU 36 N -2.03 4.23 -0.00 -3.49 1.43 0.68 -0.60 118.68 118.90 2fr2 s LEU 36 Ca -0.05 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 2fr2 s LEU 36 Cb -0.01 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2fr2 s LEU 36 CO -0.03 0.01 0.00 -0.70 0.23 0.00 0.00 176.35 175.86 2fr2 s GLU 37 N -2.73 0.03 -0.05 1.70 2.12 -0.34 -0.94 118.70 118.50 2fr2 s GLU 37 Ca 0.43 0.02 0.03 0.00 0.36 0.00 0.00 54.97 55.81 2fr2 s GLU 37 Cb -0.12 -0.07 0.01 0.00 0.26 0.00 0.00 34.13 34.21 2fr2 s GLU 37 CO 0.24 -0.02 -0.13 -1.21 -0.54 0.00 0.00 175.26 173.60 2fr2 s GLU 38 N 0.17 1.58 0.02 4.30 2.02 -0.42 -0.79 118.70 125.58 2fr2 s GLU 38 Ca -0.01 -0.45 0.05 0.00 0.02 0.00 0.00 54.97 54.58 2fr2 s GLU 38 Cb -0.02 -1.35 -0.02 0.00 0.10 0.00 0.00 34.13 32.84 2fr2 s GLU 38 CO -0.00 0.10 -0.14 0.08 0.02 0.00 0.00 175.26 175.32 2fr2 s VAL 39 N 0.40 1.12 -0.06 2.63 1.01 -0.09 -1.11 120.40 124.30 2fr2 s VAL 39 Ca -0.09 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2fr2 s VAL 39 Cb -0.13 -0.98 0.01 0.00 0.00 0.00 0.00 36.38 35.28 2fr2 s VAL 39 CO 0.03 0.14 -0.12 -0.69 0.00 0.00 0.00 175.10 174.46 2fr2 s VAL 40 N -0.62 1.12 -0.13 2.92 1.01 -0.36 -0.66 120.40 123.68 2fr2 s VAL 40 Ca 0.03 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2fr2 s VAL 40 Cb -0.07 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.27 2fr2 s VAL 40 CO 0.01 0.35 -0.08 -0.36 0.00 0.00 0.00 175.10 175.02 2fr2 s PHE 41 N 0.59 2.93 0.12 5.22 0.08 -0.37 -1.84 117.98 124.71 2fr2 s PHE 41 Ca -0.13 -0.36 0.01 0.00 0.12 0.00 0.00 56.93 56.56 2fr2 s PHE 41 Cb -0.15 -1.88 -0.00 0.00 -0.57 0.00 0.00 43.02 40.42 2fr2 s PHE 41 CO 0.03 -0.04 0.14 0.00 -0.10 0.00 0.00 175.22 175.25 2fr2 n ALA 42 N 3.31 0.02 -3.39 5.36 0.00 -0.54 -1.28 120.51 124.00 2fr2 n ALA 42 Ca -0.18 -0.58 -0.09 0.00 0.00 0.00 0.00 53.44 52.59 2fr2 n ALA 42 Cb 0.53 0.47 -0.04 0.00 0.00 0.00 0.00 19.45 20.41 2fr2 n ALA 42 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2fr2 s HIS 43 N -3.60 -0.02 -0.15 0.00 -3.43 -1.26 -0.52 115.29 106.32 2fr2 s HIS 43 Ca 0.11 -0.35 0.15 0.00 -0.80 0.00 0.00 55.06 54.17 2fr2 s HIS 43 Cb 0.00 0.41 0.38 0.00 -1.43 0.00 0.00 32.58 31.94 2fr2 s HIS 43 CO 0.08 -1.00 1.19 1.33 -2.00 0.00 0.00 174.74 174.34 2fr2 n VAL 44 N -0.37 1.65 -0.60 -5.38 0.24 -1.26 -4.96 118.33 107.63 2fr2 n VAL 44 Ca -0.07 -2.53 0.00 0.00 -2.04 0.00 0.00 64.34 59.70 2fr2 n VAL 44 Cb 0.62 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.01 2fr2 n VAL 44 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fr2 n GLY 45 N -0.81 0.78 3.82 7.63 0.00 -1.26 -5.06 105.19 110.29 2fr2 n GLY 45 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 2fr2 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fr2 s LYS 46 N -0.40 2.48 0.00 1.61 1.02 -1.26 -4.27 119.74 118.92 2fr2 s LYS 46 Ca 0.00 -1.56 -0.03 0.00 0.02 0.00 0.00 55.97 54.40 2fr2 s LYS 46 Cb 0.00 -2.29 -0.13 0.00 -0.52 0.00 0.00 37.83 34.89 2fr2 s LYS 46 CO 0.00 -0.08 2.26 -2.30 -0.92 0.00 0.00 175.35 174.30 2fr2 n PRO 47 N -1.40 1.16 -3.80 -1.68 -0.02 -1.26 -4.49 135.00 123.51 2fr2 n PRO 47 Ca 0.01 -0.48 -0.12 0.00 -2.02 0.00 0.00 63.50 60.88 2fr2 n PRO 47 Cb 0.62 -1.65 -0.09 0.00 -0.02 0.00 0.00 33.50 32.37 2fr2 n PRO 47 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2fr2 s PHE 48 N 1.37 -0.08 0.00 6.00 -0.12 -1.26 -1.78 117.98 122.10 2fr2 s PHE 48 Ca 0.32 0.05 -0.10 0.00 -0.05 0.00 0.00 56.93 57.15 2fr2 s PHE 48 Cb 0.16 0.04 -0.05 0.00 -0.63 0.00 0.00 43.02 42.54 2fr2 s PHE 48 CO 0.00 -0.39 0.33 -0.51 -0.05 0.00 0.00 175.22 174.60 2fr2 s LEU 49 N -1.56 4.41 0.35 -1.99 1.43 0.07 -4.52 118.68 116.88 2fr2 s LEU 49 Ca -0.11 0.74 -0.19 0.00 -1.03 0.00 0.00 54.13 53.53 2fr2 s LEU 49 Cb -0.05 -2.61 -0.10 0.00 0.03 0.00 0.00 46.19 43.46 2fr2 s LEU 49 CO 0.01 0.29 0.85 0.42 0.23 0.00 0.00 176.35 178.15 2fr2 s THR 50 N -1.20 4.48 -0.07 5.49 -4.23 0.32 -0.54 115.64 119.90 2fr2 s THR 50 Ca 0.25 1.33 -0.03 0.00 -1.18 0.00 0.00 61.69 62.06 2fr2 s THR 50 Cb -0.14 -3.69 0.04 0.00 1.34 0.00 0.00 72.50 70.05 2fr2 s THR 50 CO 0.13 -0.15 0.16 -0.47 -0.54 0.00 0.00 174.62 173.75 2fr2 s TYR 51 N -1.96 -0.18 0.01 3.99 5.04 -0.30 -1.46 117.35 122.48 2fr2 s TYR 51 Ca 0.55 0.51 0.03 0.00 -2.44 0.00 0.00 57.07 55.72 2fr2 s TYR 51 Cb -0.12 -0.07 -0.01 0.00 0.35 0.00 0.00 41.96 42.11 2fr2 s TYR 51 CO 0.17 -0.17 -0.08 0.95 -1.34 0.00 0.00 175.55 175.07 2fr2 s THR 52 N 1.19 0.65 -0.01 4.34 -4.23 -0.77 -1.03 115.64 115.78 2fr2 s THR 52 Ca -0.09 -0.57 0.02 0.00 -1.18 0.00 0.00 61.69 59.87 2fr2 s THR 52 Cb -0.11 -0.59 0.00 0.00 1.34 0.00 0.00 72.50 73.13 2fr2 s THR 52 CO -0.06 0.03 -0.07 -1.58 -0.54 0.00 0.00 174.62 172.40 2fr2 s GLN 53 N -0.60 0.64 -0.03 3.99 0.74 0.01 -1.22 119.66 123.19 2fr2 s GLN 53 Ca 0.00 -0.22 0.03 0.00 0.05 0.00 0.00 55.36 55.22 2fr2 s GLN 53 Cb -0.05 -0.62 -0.00 0.00 1.10 0.00 0.00 33.01 33.43 2fr2 s GLN 53 CO 0.00 0.10 -0.13 -1.14 -0.55 0.00 0.00 175.29 173.58 2fr2 s GLN 54 N 0.07 1.28 0.21 1.67 2.00 -0.27 -1.87 119.66 122.76 2fr2 s GLN 54 Ca -0.01 -0.45 0.11 0.00 -2.00 0.00 0.00 55.36 53.01 2fr2 s GLN 54 Cb -0.05 -1.16 -0.04 0.00 0.80 0.00 0.00 33.01 32.55 2fr2 s GLN 54 CO -0.00 0.20 -0.16 0.95 -0.50 0.00 0.00 175.29 175.77 2fr2 s THR 55 N 0.04 2.76 0.13 -0.34 -4.23 0.27 -1.30 115.64 112.97 2fr2 s THR 55 Ca -0.02 -1.97 -0.13 0.00 -1.18 0.00 0.00 61.69 58.39 2fr2 s THR 55 Cb -0.09 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.39 2fr2 s THR 55 CO 0.01 -0.20 0.33 0.00 -0.54 0.00 0.00 174.62 174.22 2fr2 s ARG 56 N -2.99 1.05 0.38 3.99 1.70 -0.11 -0.96 118.95 122.02 2fr2 s ARG 56 Ca 0.25 -0.88 -0.27 0.00 -0.47 0.00 0.00 55.73 54.36 2fr2 s ARG 56 Cb -0.07 0.42 -0.09 0.00 -0.57 0.00 0.00 34.95 34.63 2fr2 s ARG 56 CO 0.14 -0.39 1.31 0.00 -1.08 0.00 0.00 175.30 175.27 2fr2 s ALA 57 N -3.86 3.34 0.20 7.88 0.00 0.67 -0.23 121.76 129.76 2fr2 s ALA 57 Ca 0.07 1.25 -0.09 0.00 0.00 0.00 0.00 51.96 53.18 2fr2 s ALA 57 Cb 0.03 -3.49 0.12 0.00 0.00 0.00 0.00 23.12 19.78 2fr2 s ALA 57 CO -0.09 -0.76 1.73 0.28 0.00 0.00 0.00 175.76 176.92 2fr2 h VAL 58 N 2.66 1.26 0.15 0.00 2.07 -1.90 -1.71 116.25 118.78 2fr2 h VAL 58 Ca -0.49 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 2fr2 h VAL 58 Cb 1.24 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2fr2 h VAL 58 CO 0.63 0.35 -0.07 0.00 0.02 0.00 0.00 177.57 178.51 2fr2 h ALA 59 N 1.10 -0.20 0.00 1.67 0.00 -1.94 -3.40 119.26 116.50 2fr2 h ALA 59 Ca 0.23 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2fr2 h ALA 59 Cb 0.32 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2fr2 h ALA 59 CO -0.01 -0.41 -1.20 -0.40 0.00 0.00 0.00 179.25 177.23 2fr2 n ASP 60 N -5.00 4.12 0.00 0.00 5.68 -1.25 -5.03 116.55 115.07 2fr2 n ASP 60 Ca -0.09 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.20 2fr2 n ASP 60 Cb 0.24 0.97 0.00 0.00 -1.14 0.00 0.00 41.12 41.19 2fr2 n ASP 60 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2fr2 n GLY 61 N 2.46 0.83 3.69 6.12 0.00 -0.64 -5.00 105.19 112.65 2fr2 n GLY 61 Ca -0.02 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 2fr2 n GLY 61 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fr2 s LYS 62 N -0.59 4.18 0.03 1.61 -2.85 -1.26 -4.51 119.74 116.35 2fr2 s LYS 62 Ca 0.00 2.40 -0.39 0.00 -1.00 0.00 0.00 55.97 56.98 2fr2 s LYS 62 Cb 0.00 -3.54 -0.19 0.00 -2.06 0.00 0.00 37.83 32.04 2fr2 s LYS 62 CO 0.00 -0.75 1.17 -2.30 0.10 0.00 0.00 175.35 173.58 2fr2 n PRO 63 N 5.42 0.43 0.00 1.78 -0.02 -1.26 -0.24 135.00 141.11 2fr2 n PRO 63 Ca 0.16 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2fr2 n PRO 63 Cb 0.40 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 2fr2 n PRO 63 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2fr2 n LEU 64 N 1.90 0.00 -4.90 2.45 4.77 -0.13 -4.82 117.00 116.26 2fr2 n LEU 64 Ca 0.19 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.96 2fr2 n LEU 64 Cb 0.12 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 2fr2 n LEU 64 CO 0.62 0.00 -0.09 -2.28 -1.33 0.00 0.00 177.39 174.31 2fr2 s HIS 65 N 1.05 3.21 0.17 -1.77 5.04 -1.26 -4.94 115.29 116.80 2fr2 s HIS 65 Ca 0.00 -0.11 -0.10 0.00 -1.54 0.00 0.00 55.06 53.31 2fr2 s HIS 65 Cb 0.00 -1.56 -0.01 0.00 0.04 0.00 0.00 32.58 31.05 2fr2 s HIS 65 CO 0.00 0.40 0.32 -1.54 -2.34 0.00 0.00 174.74 171.58 2fr2 s SER 66 N -3.94 0.00 0.07 9.88 1.04 -1.26 -0.56 113.70 118.93 2fr2 s SER 66 Ca 0.35 -0.85 -0.16 0.00 0.48 0.00 0.00 55.95 55.77 2fr2 s SER 66 Cb -0.08 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.53 2fr2 s SER 66 CO 0.27 -0.93 0.38 -1.83 0.98 0.00 0.00 173.24 172.11 2fr2 s GLU 67 N -3.97 0.95 -0.11 4.02 -1.05 -0.78 -4.16 118.70 113.60 2fr2 s GLU 67 Ca 0.17 -0.54 -0.19 0.00 -0.15 0.00 0.00 54.97 54.26 2fr2 s GLU 67 Cb 0.03 0.42 0.05 0.00 -0.44 0.00 0.00 34.13 34.18 2fr2 s GLU 67 CO 0.01 -0.34 0.48 -0.08 0.95 0.00 0.00 175.26 176.28 2fr2 s THR 68 N -3.02 0.02 0.00 1.83 -1.32 -0.89 -0.81 115.64 111.44 2fr2 s THR 68 Ca -0.02 -0.14 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 2fr2 s THR 68 Cb 0.00 -0.73 0.00 0.00 -1.51 0.00 0.00 72.50 70.26 2fr2 s THR 68 CO -0.06 -0.08 0.00 0.61 -2.21 0.00 0.00 174.62 172.88 2fr2 n GLY 69 N 1.98 -0.62 3.02 6.08 0.00 -0.20 -0.82 105.19 114.64 2fr2 n GLY 69 Ca -0.17 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 2fr2 n GLY 69 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fr2 s TYR 70 N -2.67 -0.09 -0.44 1.61 2.02 0.15 -1.15 117.35 116.78 2fr2 s TYR 70 Ca 0.00 0.23 -0.09 0.00 -0.37 0.00 0.00 57.07 56.84 2fr2 s TYR 70 Cb 0.00 0.02 0.09 0.00 -0.40 0.00 0.00 41.96 41.68 2fr2 s TYR 70 CO 0.00 -0.11 0.29 -1.17 -1.57 0.00 0.00 175.55 172.99 2fr2 s LEU 71 N -0.23 5.34 0.07 -1.29 2.96 0.30 -0.72 118.68 125.12 2fr2 s LEU 71 Ca -0.03 -1.68 -0.23 0.00 -0.22 0.00 0.00 54.13 51.97 2fr2 s LEU 71 Cb -0.02 -1.99 -0.06 0.00 0.50 0.00 0.00 46.19 44.62 2fr2 s LEU 71 CO 0.00 -0.59 0.70 -0.13 -1.32 0.00 0.00 176.35 175.01 2fr2 s ARG 72 N 1.39 4.42 -0.35 1.98 0.52 0.19 -0.75 118.95 126.35 2fr2 s ARG 72 Ca 0.04 0.96 -0.11 0.00 -0.52 0.00 0.00 55.73 56.11 2fr2 s ARG 72 Cb -0.24 -3.31 0.01 0.00 0.52 0.00 0.00 34.95 31.93 2fr2 s ARG 72 CO 0.01 0.43 0.19 0.08 0.02 0.00 0.00 175.30 176.02 2fr2 s VAL 73 N -0.52 4.61 0.00 3.52 1.01 -0.73 -1.04 120.40 127.24 2fr2 s VAL 73 Ca 0.35 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2fr2 s VAL 73 Cb -0.20 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2fr2 s VAL 73 CO 0.22 -0.11 0.70 0.00 0.00 0.00 0.00 175.10 175.91 2fr2 s ARG 75 N -1.93 1.15 0.10 0.00 0.52 -1.26 -5.06 118.95 112.47 2fr2 s ARG 75 Ca 0.00 -1.22 -0.36 0.00 -0.52 0.00 0.00 55.73 53.63 2fr2 s ARG 75 Cb 0.00 -1.36 -0.17 0.00 0.52 0.00 0.00 34.95 33.94 2fr2 s ARG 75 CO 0.00 0.30 1.16 -2.30 0.02 0.00 0.00 175.30 174.48 2fr2 n PRO 76 N 0.88 0.76 0.00 3.54 -0.02 -1.26 -1.89 135.00 137.01 2fr2 n PRO 76 Ca -0.18 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2fr2 n PRO 76 Cb 0.54 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 2fr2 n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fr2 n GLY 77 N 2.06 0.99 3.24 -1.23 0.00 -1.26 -5.05 105.19 103.95 2fr2 n GLY 77 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2fr2 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr2 s VAL 79 N -0.40 1.09 -0.21 0.00 -7.23 -0.16 -2.36 120.40 111.13 2fr2 s VAL 79 Ca 0.05 -1.13 0.01 0.00 -1.81 0.00 0.00 61.98 59.10 2fr2 s VAL 79 Cb -0.10 -1.02 0.05 0.00 0.56 0.00 0.00 36.38 35.87 2fr2 s VAL 79 CO 0.00 -0.11 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.00 2fr2 s GLU 80 N -1.41 1.78 -0.25 4.82 2.02 -0.21 -1.41 118.70 124.05 2fr2 s GLU 80 Ca -0.00 -0.90 -0.13 0.00 0.02 0.00 0.00 54.97 53.96 2fr2 s GLU 80 Cb -0.09 -2.47 -0.04 0.00 0.10 0.00 0.00 34.13 31.63 2fr2 s GLU 80 CO 0.02 -0.51 0.29 -1.17 0.02 0.00 0.00 175.26 173.90 2fr2 s LEU 81 N 1.41 4.08 -0.19 1.80 2.96 0.64 -0.64 118.68 128.73 2fr2 s LEU 81 Ca -0.04 0.23 0.01 0.00 -0.22 0.00 0.00 54.13 54.12 2fr2 s LEU 81 Cb -0.17 -2.30 0.03 0.00 0.50 0.00 0.00 46.19 44.24 2fr2 s LEU 81 CO -0.07 -0.07 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.02 2fr2 s VAL 82 N 1.59 2.05 0.02 1.68 1.01 0.10 -0.86 120.40 125.99 2fr2 s VAL 82 Ca 0.12 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2fr2 s VAL 82 Cb -0.15 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 2fr2 s VAL 82 CO 0.08 0.44 -0.07 -0.76 0.00 0.00 0.00 175.10 174.79 2fr2 s LEU 83 N 1.27 2.12 0.01 3.92 1.43 0.32 -0.68 118.68 127.07 2fr2 s LEU 83 Ca 0.03 -0.31 0.03 0.00 -1.03 0.00 0.00 54.13 52.84 2fr2 s LEU 83 Cb -0.14 -0.27 -0.03 0.00 0.03 0.00 0.00 46.19 45.77 2fr2 s LEU 83 CO -0.12 -0.04 -0.04 0.00 0.23 0.00 0.00 176.35 176.39 2fr2 s ALA 84 N -0.69 3.13 -0.01 4.21 0.00 0.00 -1.10 121.76 127.30 2fr2 s ALA 84 Ca -0.03 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 50.99 2fr2 s ALA 84 Cb -0.06 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.83 2fr2 s ALA 84 CO 0.00 0.63 -0.17 -1.01 0.00 0.00 0.00 175.76 175.21 2fr2 s HIS 85 N -1.05 1.52 -1.22 0.00 3.76 -0.21 -2.10 115.29 115.99 2fr2 s HIS 85 Ca 0.18 -0.29 0.16 0.00 -0.15 0.00 0.00 55.06 54.96 2fr2 s HIS 85 Cb -0.11 -0.97 0.74 0.00 1.11 0.00 0.00 32.58 33.34 2fr2 s HIS 85 CO 0.09 -0.02 1.48 -0.35 -0.85 0.00 0.00 174.74 175.09 2fr2 n PRO 86 N 2.62 0.12 0.00 8.40 -0.04 -1.26 -1.72 135.00 143.11 2fr2 n PRO 86 Ca -0.15 0.18 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 2fr2 n PRO 86 Cb 0.54 -1.50 0.68 0.00 -0.04 0.00 0.00 33.50 33.18 2fr2 n PRO 86 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2fr2 n SER 87 N -1.39 0.00 0.00 3.54 3.41 -1.26 -4.89 113.62 113.03 2fr2 n SER 87 Ca 0.06 -0.98 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 2fr2 n SER 87 Cb 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2fr2 n SER 87 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fr2 n GLY 88 N 0.65 1.12 3.08 5.00 0.00 -0.70 -4.57 105.19 109.77 2fr2 n GLY 88 Ca 0.17 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 2fr2 n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fr2 s ILE 89 N -2.00 1.06 0.18 -0.61 1.01 -1.20 -0.44 121.20 119.21 2fr2 s ILE 89 Ca 0.00 -0.55 0.09 0.00 0.00 0.00 0.00 60.65 60.19 2fr2 s ILE 89 Cb 0.00 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 2fr2 s ILE 89 CO 0.00 0.31 -0.07 0.42 0.00 0.00 0.00 174.94 175.60 2fr2 s THR 90 N -0.12 3.31 -0.05 2.92 -4.23 -0.13 -1.04 115.64 116.31 2fr2 s THR 90 Ca 0.01 -1.63 -0.02 0.00 -1.18 0.00 0.00 61.69 58.87 2fr2 s THR 90 Cb -0.07 -2.66 0.03 0.00 1.34 0.00 0.00 72.50 71.14 2fr2 s THR 90 CO 0.00 -0.13 0.11 -0.70 -0.54 0.00 0.00 174.62 173.37 2fr2 s GLU 91 N -2.90 0.07 -0.17 3.99 2.12 -0.26 -0.85 118.70 120.69 2fr2 s GLU 91 Ca 0.26 0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.88 2fr2 s GLU 91 Cb -0.09 -0.15 0.02 0.00 0.26 0.00 0.00 34.13 34.18 2fr2 s GLU 91 CO 0.16 -0.14 -0.17 0.42 -0.54 0.00 0.00 175.26 174.99 2fr2 s ILE 92 N 0.93 1.85 -0.01 -3.70 1.01 0.31 -0.52 121.20 121.07 2fr2 s ILE 92 Ca -0.07 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.79 2fr2 s ILE 92 Cb -0.10 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 2fr2 s ILE 92 CO -0.04 0.49 -0.11 -1.61 0.00 0.00 0.00 174.94 173.67 2fr2 s GLU 93 N 1.37 2.45 0.05 2.79 2.02 -0.04 -1.36 118.70 125.98 2fr2 s GLU 93 Ca 0.05 -0.76 0.08 0.00 0.02 0.00 0.00 54.97 54.36 2fr2 s GLU 93 Cb -0.13 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.66 2fr2 s GLU 93 CO -0.12 0.60 -0.23 0.08 0.02 0.00 0.00 175.26 175.61 2fr2 s VAL 94 N -0.91 1.88 -0.30 2.63 1.01 -0.46 -0.26 120.40 123.99 2fr2 s VAL 94 Ca 0.15 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2fr2 s VAL 94 Cb -0.11 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.65 2fr2 s VAL 94 CO 0.05 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.03 2fr2 n GLY 95 N 1.78 -0.78 3.23 4.51 0.00 -0.50 -1.32 105.19 112.11 2fr2 n GLY 95 Ca -0.17 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 2fr2 n GLY 95 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fr2 s THR 96 N -3.93 0.05 0.16 2.61 -4.23 -0.58 -0.99 115.64 108.73 2fr2 s THR 96 Ca 0.00 -1.81 -0.06 0.00 -1.18 0.00 0.00 61.69 58.65 2fr2 s THR 96 Cb 0.00 -2.17 -0.02 0.00 1.34 0.00 0.00 72.50 71.65 2fr2 s THR 96 CO 0.00 -0.25 0.20 -0.72 -0.54 0.00 0.00 174.62 173.31 2fr2 s TYR 97 N -4.07 0.63 0.01 3.99 -0.85 -1.02 -1.38 117.35 114.66 2fr2 s TYR 97 Ca 0.28 -0.99 0.00 0.00 -0.52 0.00 0.00 57.07 55.84 2fr2 s TYR 97 Cb 0.06 -0.24 -0.01 0.00 0.38 0.00 0.00 41.96 42.15 2fr2 s TYR 97 CO 0.05 -0.66 -0.02 0.45 -1.52 0.00 0.00 175.55 173.86 2fr2 s SER 98 N -3.02 0.15 -0.17 -0.18 0.15 -0.35 -4.81 113.70 105.48 2fr2 s SER 98 Ca 0.22 -0.26 -0.03 0.00 0.70 0.00 0.00 55.95 56.59 2fr2 s SER 98 Cb 0.05 0.05 -0.02 0.00 -1.71 0.00 0.00 66.02 64.39 2fr2 s SER 98 CO 0.02 -0.15 -0.06 -0.69 1.20 0.00 0.00 173.24 173.56 2fr2 s VAL 99 N -0.74 3.50 -0.42 4.45 1.01 -1.26 -1.38 120.40 125.56 2fr2 s VAL 99 Ca -0.08 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2fr2 s VAL 99 Cb -0.05 -2.54 0.13 0.00 0.00 0.00 0.00 36.38 33.92 2fr2 s VAL 99 CO -0.00 0.48 0.20 -0.89 0.00 0.00 0.00 175.10 174.88 2fr2 s THR 100 N 0.72 1.51 0.00 3.92 2.01 0.34 -5.02 115.64 119.13 2fr2 s THR 100 Ca -0.03 -2.42 0.00 0.00 0.31 0.00 0.00 61.69 59.56 2fr2 s THR 100 Cb -0.15 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.29 2fr2 s THR 100 CO 0.02 -0.82 0.00 0.61 -0.69 0.00 0.00 174.62 173.74 2fr2 n GLY 101 N 3.79 3.70 0.28 4.40 0.00 -1.26 -1.40 105.19 114.70 2fr2 n GLY 101 Ca 0.06 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.17 2fr2 n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fr2 n ASP 102 N 5.94 0.80 -4.54 1.61 8.00 -1.26 -4.75 116.55 122.36 2fr2 n ASP 102 Ca 0.00 -1.92 -0.35 0.00 0.71 0.00 0.00 54.79 53.23 2fr2 n ASP 102 Cb 0.00 -0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 40.89 2fr2 n ASP 102 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2fr2 s VAL 103 N -1.81 4.36 -0.13 2.53 1.01 -0.49 -1.89 120.40 123.98 2fr2 s VAL 103 Ca 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 2fr2 s VAL 103 Cb 0.07 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 2fr2 s VAL 103 CO 0.10 0.43 -0.13 -0.63 0.00 0.00 0.00 175.10 174.87 2fr2 s ILE 104 N 0.74 3.09 -0.16 2.22 1.01 0.29 -0.50 121.20 127.88 2fr2 s ILE 104 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.02 2fr2 s ILE 104 Cb -0.14 -2.29 0.00 0.00 0.01 0.00 0.00 42.46 40.04 2fr2 s ILE 104 CO 0.02 0.53 -0.16 -1.61 0.00 0.00 0.00 174.94 173.72 2fr2 s GLU 105 N 0.29 3.17 -0.09 2.79 2.02 -0.48 -0.60 118.70 125.81 2fr2 s GLU 105 Ca -0.10 -0.76 0.04 0.00 0.02 0.00 0.00 54.97 54.17 2fr2 s GLU 105 Cb -0.16 -2.64 -0.00 0.00 0.10 0.00 0.00 34.13 31.43 2fr2 s GLU 105 CO 0.05 -0.05 -0.23 -0.51 0.02 0.00 0.00 175.26 174.54 2fr2 s LEU 106 N 0.96 2.14 -0.13 1.80 1.02 -0.32 -1.21 118.68 122.95 2fr2 s LEU 106 Ca -0.03 -0.53 0.00 0.00 0.02 0.00 0.00 54.13 53.60 2fr2 s LEU 106 Cb -0.15 -1.42 0.02 0.00 0.02 0.00 0.00 46.19 44.67 2fr2 s LEU 106 CO -0.03 0.18 -0.12 -1.61 0.02 0.00 0.00 176.35 174.80 2fr2 s GLU 107 N 0.20 1.95 0.11 1.70 0.41 -0.48 -0.68 118.70 121.92 2fr2 s GLU 107 Ca -0.14 -0.43 0.04 0.00 -0.41 0.00 0.00 54.97 54.03 2fr2 s GLU 107 Cb -0.17 -1.83 -0.04 0.00 -1.78 0.00 0.00 34.13 30.31 2fr2 s GLU 107 CO 0.07 -0.21 -0.10 -0.51 -0.49 0.00 0.00 175.26 174.02 2fr2 s LEU 108 N 1.47 2.46 -0.12 1.80 1.02 -0.03 -1.53 118.68 123.75 2fr2 s LEU 108 Ca 0.03 -0.90 -0.27 0.00 0.02 0.00 0.00 54.13 53.00 2fr2 s LEU 108 Cb -0.13 -0.30 0.07 0.00 0.02 0.00 0.00 46.19 45.85 2fr2 s LEU 108 CO -0.08 -0.31 0.65 -0.55 0.02 0.00 0.00 176.35 176.09 2fr2 s SER 109 N -2.76 -0.64 0.60 2.29 0.15 -0.44 -1.04 113.70 111.86 2fr2 s SER 109 Ca 0.10 0.90 0.39 0.00 0.70 0.00 0.00 55.95 58.04 2fr2 s SER 109 Cb -0.00 0.82 1.86 0.00 -1.71 0.00 0.00 66.02 66.99 2fr2 s SER 109 CO -0.00 -0.46 2.16 0.71 1.20 0.00 0.00 173.24 176.84 2fr2 h THR 110 N 3.44 0.00 0.00 6.45 1.35 -1.05 -1.18 112.91 121.93 2fr2 h THR 110 Ca -0.28 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2fr2 h THR 110 Cb 1.15 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 2fr2 h THR 110 CO 0.28 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.09 2fr2 n ARG 111 N -3.08 0.06 -2.61 4.72 1.74 -1.26 -1.49 116.66 114.73 2fr2 n ARG 111 Ca -0.01 0.06 -0.41 0.00 -0.77 0.00 0.00 57.85 56.72 2fr2 n ARG 111 Cb 0.20 -1.57 0.02 0.00 -1.02 0.00 0.00 32.46 30.09 2fr2 n ARG 111 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2fr2 n ALA 112 N -1.56 6.09 -2.16 7.54 0.00 -1.11 -4.71 120.51 124.59 2fr2 n ALA 112 Ca 0.06 -4.59 -0.11 0.00 0.00 0.00 0.00 53.44 48.81 2fr2 n ALA 112 Cb 0.35 -2.16 -0.01 0.00 0.00 0.00 0.00 19.45 17.63 2fr2 n ALA 112 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2fr2 n ASP 113 N -0.09 -3.64 -0.94 0.00 2.03 -1.25 -4.50 116.55 108.17 2fr2 n ASP 113 Ca 0.47 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.79 2fr2 n ASP 113 Cb 0.26 -2.83 0.00 0.00 -0.72 0.00 0.00 41.12 37.83 2fr2 n ASP 113 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2fr2 n GLY 114 N -1.04 1.56 3.35 0.27 0.00 -0.56 -4.90 105.19 103.87 2fr2 n GLY 114 Ca -0.13 -2.02 -0.15 0.00 0.00 0.00 0.00 46.02 43.72 2fr2 n GLY 114 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fr2 s SER 115 N -1.00 -0.38 -0.05 1.61 0.15 -0.46 -4.85 113.70 108.73 2fr2 s SER 115 Ca 0.00 0.33 0.02 0.00 0.70 0.00 0.00 55.95 57.00 2fr2 s SER 115 Cb 0.00 0.40 0.01 0.00 -1.71 0.00 0.00 66.02 64.72 2fr2 s SER 115 CO 0.00 -0.52 -0.10 -0.63 1.20 0.00 0.00 173.24 173.19 2fr2 s ILE 116 N -1.31 0.93 -0.02 6.45 1.01 -1.26 -0.53 121.20 126.47 2fr2 s ILE 116 Ca -0.12 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.18 2fr2 s ILE 116 Cb -0.03 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 2fr2 s ILE 116 CO 0.06 0.30 -0.11 -0.83 0.00 0.00 0.00 174.94 174.36 2fr2 s GLY 117 N 0.54 1.64 -0.16 6.18 0.00 -0.03 -4.95 107.32 110.54 2fr2 s GLY 117 Ca -0.10 -1.02 0.01 0.00 0.00 0.00 0.00 44.72 43.61 2fr2 s GLY 117 CO 0.02 -0.85 -0.18 1.08 0.00 0.00 0.00 173.10 173.17 2fr2 s LEU 118 N -1.11 1.98 0.87 0.66 1.43 -1.26 -0.95 118.68 120.29 2fr2 s LEU 118 Ca 0.14 -0.58 -0.10 0.00 -1.03 0.00 0.00 54.13 52.56 2fr2 s LEU 118 Cb -0.11 -1.37 0.12 0.00 0.03 0.00 0.00 46.19 44.86 2fr2 s LEU 118 CO 0.04 -0.00 1.12 0.00 0.23 0.00 0.00 176.35 177.74 2fr2 s ALA 119 N 1.24 1.70 0.45 4.21 0.00 0.42 -4.90 121.76 124.88 2fr2 s ALA 119 Ca 0.02 0.45 0.22 0.00 0.00 0.00 0.00 51.96 52.66 2fr2 s ALA 119 Cb -0.13 -3.38 1.21 0.00 0.00 0.00 0.00 23.12 20.81 2fr2 s ALA 119 CO -0.10 -2.44 1.84 -1.35 0.00 0.00 0.00 175.76 173.71 2fr2 h PRO 120 N -1.63 0.28 -0.53 0.00 0.11 -2.00 -1.50 132.00 126.72 2fr2 h PRO 120 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2fr2 h PRO 120 Cb 1.26 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2fr2 h PRO 120 CO 0.45 0.18 0.00 0.25 -0.21 0.00 0.00 178.00 178.68 2fr2 n THR 121 N -4.46 0.75 -2.29 -1.15 -2.24 -1.26 -4.99 114.28 98.64 2fr2 n THR 121 Ca 0.21 -0.88 -0.32 0.00 -2.27 0.00 0.00 64.05 60.79 2fr2 n THR 121 Cb 0.83 0.74 -0.02 0.00 -2.10 0.00 0.00 70.33 69.78 2fr2 n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fr2 s ALA 122 N -1.21 2.95 0.59 6.98 0.00 -0.57 -5.05 121.76 125.46 2fr2 s ALA 122 Ca 0.41 0.27 -0.17 0.00 0.00 0.00 0.00 51.96 52.46 2fr2 s ALA 122 Cb 0.23 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 20.15 2fr2 s ALA 122 CO 0.30 -0.43 1.12 0.15 0.00 0.00 0.00 175.76 176.91 2fr2 s LYS 123 N -4.04 3.11 -1.14 0.00 1.02 -1.26 -4.91 119.74 112.51 2fr2 s LYS 123 Ca 0.61 1.51 -0.20 0.00 0.02 0.00 0.00 55.97 57.91 2fr2 s LYS 123 Cb -0.12 -1.98 0.07 0.00 -0.52 0.00 0.00 37.83 35.28 2fr2 s LYS 123 CO 0.33 -1.02 1.54 -1.21 -0.92 0.00 0.00 175.35 174.07 2fr2 s GLU 124 N -3.64 3.80 -0.12 1.68 8.01 -1.26 -4.97 118.70 122.19 2fr2 s GLU 124 Ca 0.70 -1.66 -0.17 0.00 0.01 0.00 0.00 54.97 53.86 2fr2 s GLU 124 Cb -0.22 -5.38 -0.04 0.00 -4.31 0.00 0.00 34.13 24.18 2fr2 s GLU 124 CO 0.33 -2.16 0.43 0.08 0.01 0.00 0.00 175.26 173.95 2fr2 s VAL 125 N 4.21 5.20 0.00 2.63 1.01 -1.26 -1.12 120.40 131.07 2fr2 s VAL 125 Ca 0.48 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.31 2fr2 s VAL 125 Cb 0.01 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2fr2 s VAL 125 CO -0.02 0.36 0.00 0.35 0.00 0.00 0.00 175.10 175.80 2fr2 n THR 126 N 3.48 0.00 -3.63 3.92 -2.24 0.40 -4.96 114.28 111.25 2fr2 n THR 126 Ca -0.09 -0.29 -0.16 0.00 -2.27 0.00 0.00 64.05 61.24 2fr2 n THR 126 Cb 0.52 0.80 -0.07 0.00 -2.10 0.00 0.00 70.33 69.47 2fr2 n THR 126 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fr2 s ALA 127 N -1.37 -1.31 -0.02 6.98 0.00 -0.85 -4.89 121.76 120.31 2fr2 s ALA 127 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.78 2fr2 s ALA 127 Cb 0.00 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.21 2fr2 s ALA 127 CO 0.00 -0.34 0.01 -0.51 0.00 0.00 0.00 175.76 174.92 2fr2 s LEU 128 N -1.34 1.41 -0.03 0.00 1.43 -1.26 -1.04 118.68 117.86 2fr2 s LEU 128 Ca -0.11 0.01 0.07 0.00 -1.03 0.00 0.00 54.13 53.06 2fr2 s LEU 128 Cb -0.02 -0.09 -0.02 0.00 0.03 0.00 0.00 46.19 46.09 2fr2 s LEU 128 CO 0.06 -0.08 -0.24 -1.81 0.23 0.00 0.00 176.35 174.52 2fr2 s ASP 129 N 0.69 2.84 -0.05 2.29 1.11 -0.17 -0.64 116.67 122.74 2fr2 s ASP 129 Ca -0.06 -0.45 0.04 0.00 0.18 0.00 0.00 52.55 52.26 2fr2 s ASP 129 Cb -0.09 -0.44 0.00 0.00 1.07 0.00 0.00 42.92 43.46 2fr2 s ASP 129 CO -0.02 0.28 -0.16 -0.13 1.18 0.00 0.00 175.17 176.32 2fr2 s ARG 130 N -0.45 1.83 -0.17 8.23 0.52 -0.21 -0.72 118.95 127.98 2fr2 s ARG 130 Ca 0.06 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 54.70 2fr2 s ARG 130 Cb -0.10 -1.55 0.03 0.00 0.52 0.00 0.00 34.95 33.84 2fr2 s ARG 130 CO 0.00 0.18 -0.14 -1.12 0.02 0.00 0.00 175.30 174.24 2fr2 s SER 131 N 0.21 2.97 0.04 0.23 0.01 -0.25 -0.85 113.70 116.06 2fr2 s SER 131 Ca -0.07 -0.63 0.07 0.00 1.31 0.00 0.00 55.95 56.63 2fr2 s SER 131 Cb -0.13 -1.25 -0.03 0.00 0.21 0.00 0.00 66.02 64.81 2fr2 s SER 131 CO 0.03 -0.07 -0.19 -0.31 0.41 0.00 0.00 173.24 173.12 2fr2 s TYR 132 N 1.42 2.54 -0.07 2.43 2.02 0.14 -1.29 117.35 124.55 2fr2 s TYR 132 Ca 0.03 -0.27 0.00 0.00 -0.37 0.00 0.00 57.07 56.47 2fr2 s TYR 132 Cb -0.14 -1.46 0.02 0.00 -0.40 0.00 0.00 41.96 39.99 2fr2 s TYR 132 CO -0.10 0.25 -0.04 0.50 -1.57 0.00 0.00 175.55 174.59 2fr2 s ARG 133 N -1.43 0.91 -0.25 -0.62 3.52 -0.04 -1.17 118.95 119.86 2fr2 s ARG 133 Ca 0.14 -0.07 -0.04 0.00 -0.13 0.00 0.00 55.73 55.63 2fr2 s ARG 133 Cb -0.10 -1.04 0.01 0.00 -1.56 0.00 0.00 34.95 32.26 2fr2 s ARG 133 CO 0.05 -0.18 -0.01 0.42 -0.81 0.00 0.00 175.30 174.77 2fr2 s ILE 134 N 1.41 3.44 -0.33 4.11 1.09 0.23 -0.68 121.20 130.46 2fr2 s ILE 134 Ca -0.03 -0.71 0.02 0.00 -1.10 0.00 0.00 60.65 58.83 2fr2 s ILE 134 Cb -0.13 -2.69 0.10 0.00 -1.06 0.00 0.00 42.46 38.68 2fr2 s ILE 134 CO -0.03 0.24 0.08 -0.62 -0.10 0.00 0.00 174.94 174.52 2fr2 s ASP 135 N 1.44 4.39 1.70 3.58 2.15 0.47 -0.55 116.67 129.85 2fr2 s ASP 135 Ca 0.03 -1.96 0.00 0.00 0.43 0.00 0.00 52.55 51.06 2fr2 s ASP 135 Cb -0.16 -1.26 0.00 0.00 -0.30 0.00 0.00 42.92 41.20 2fr2 s ASP 135 CO -0.02 -0.39 0.00 0.61 -0.17 0.00 0.00 175.17 175.20 2fr2 n GLY 136 N 4.48 3.75 1.60 2.66 0.00 -0.79 -1.49 105.19 115.40 2fr2 n GLY 136 Ca 0.01 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.09 2fr2 n GLY 136 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fr2 n ASP 137 N 9.02 4.78 -4.26 1.61 8.00 -1.26 -4.89 116.55 129.54 2fr2 n ASP 137 Ca 0.00 -2.56 -0.33 0.00 0.71 0.00 0.00 54.79 52.61 2fr2 n ASP 137 Cb 0.00 -0.60 -0.15 0.00 -0.02 0.00 0.00 41.12 40.35 2fr2 n ASP 137 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2fr2 s GLU 138 N -2.10 3.19 -0.15 -1.24 2.12 -0.55 -1.27 118.70 118.70 2fr2 s GLU 138 Ca 0.49 -0.77 -0.01 0.00 0.36 0.00 0.00 54.97 55.04 2fr2 s GLU 138 Cb 0.33 -2.56 -0.01 0.00 0.26 0.00 0.00 34.13 32.15 2fr2 s GLU 138 CO 0.20 0.06 -0.13 -1.17 -0.54 0.00 0.00 175.26 173.69 2fr2 s LEU 139 N 0.69 2.64 0.12 2.70 0.20 0.03 -0.40 118.68 124.67 2fr2 s LEU 139 Ca -0.08 -0.40 0.06 0.00 0.69 0.00 0.00 54.13 54.40 2fr2 s LEU 139 Cb -0.16 -1.61 -0.04 0.00 -0.43 0.00 0.00 46.19 43.95 2fr2 s LEU 139 CO 0.02 0.10 -0.13 -0.94 -0.29 0.00 0.00 176.35 175.10 2fr2 s SER 140 N 0.72 1.95 0.10 3.68 1.04 0.14 -0.18 113.70 121.15 2fr2 s SER 140 Ca -0.06 -0.82 -0.15 0.00 0.48 0.00 0.00 55.95 55.40 2fr2 s SER 140 Cb -0.15 -0.06 0.03 0.00 0.10 0.00 0.00 66.02 65.93 2fr2 s SER 140 CO 0.02 -0.16 0.36 -0.72 0.98 0.00 0.00 173.24 173.71 2fr2 s TYR 141 N -2.24 -0.15 -0.03 5.02 -0.85 -0.60 -0.86 117.35 117.64 2fr2 s TYR 141 Ca 0.09 -0.12 0.04 0.00 -0.52 0.00 0.00 57.07 56.56 2fr2 s TYR 141 Cb -0.04 0.18 -0.00 0.00 0.38 0.00 0.00 41.96 42.48 2fr2 s TYR 141 CO 0.03 -0.63 -0.15 -1.12 -1.52 0.00 0.00 175.55 172.15 2fr2 s SER 142 N -2.59 1.90 -0.10 -0.18 0.01 -0.41 -2.05 113.70 110.28 2fr2 s SER 142 Ca 0.01 -0.30 0.03 0.00 1.31 0.00 0.00 55.95 56.99 2fr2 s SER 142 Cb 0.02 -0.47 0.01 0.00 0.21 0.00 0.00 66.02 65.78 2fr2 s SER 142 CO -0.09 0.14 -0.19 -0.22 0.41 0.00 0.00 173.24 173.28 2fr2 s LEU 143 N 0.01 1.93 0.10 2.44 0.20 0.43 -1.09 118.68 122.68 2fr2 s LEU 143 Ca -0.02 -0.48 0.05 0.00 0.69 0.00 0.00 54.13 54.37 2fr2 s LEU 143 Cb -0.10 -1.23 -0.04 0.00 -0.43 0.00 0.00 46.19 44.39 2fr2 s LEU 143 CO 0.01 0.09 -0.01 -1.10 -0.29 0.00 0.00 176.35 175.06 2fr2 s GLN 144 N 0.60 2.49 -0.00 1.98 1.11 0.10 -1.25 119.66 124.70 2fr2 s GLN 144 Ca -0.14 -0.87 0.02 0.00 0.01 0.00 0.00 55.36 54.38 2fr2 s GLN 144 Cb -0.17 -2.51 -0.01 0.00 -1.01 0.00 0.00 33.01 29.32 2fr2 s GLN 144 CO 0.04 0.53 -0.05 1.41 0.01 0.00 0.00 175.29 177.23 2fr2 s MET 145 N -2.33 0.42 -0.25 2.91 1.75 0.41 -1.00 119.30 121.21 2fr2 s MET 145 Ca 0.25 -0.23 -0.05 0.00 -1.25 0.00 0.00 55.69 54.41 2fr2 s MET 145 Cb -0.12 -0.39 -0.01 0.00 2.84 0.00 0.00 34.83 37.16 2fr2 s MET 145 CO 0.18 0.11 0.02 0.50 -0.65 0.00 0.00 175.02 175.17 2fr2 s ARG 146 N -0.24 3.31 0.05 4.11 3.52 -0.21 -1.64 118.95 127.86 2fr2 s ARG 146 Ca 0.01 -0.69 -0.27 0.00 -0.13 0.00 0.00 55.73 54.66 2fr2 s ARG 146 Cb -0.03 -3.19 0.09 0.00 -1.56 0.00 0.00 34.95 30.26 2fr2 s ARG 146 CO -0.00 -0.29 0.76 0.00 -0.81 0.00 0.00 175.30 174.96 2fr2 s ALA 147 N 1.51 -1.73 -1.56 6.12 0.00 -1.16 -0.46 121.76 124.47 2fr2 s ALA 147 Ca 0.04 0.86 -0.06 0.00 0.00 0.00 0.00 51.96 52.80 2fr2 s ALA 147 Cb -0.16 0.51 0.06 0.00 0.00 0.00 0.00 23.12 23.53 2fr2 s ALA 147 CO 0.00 -0.67 0.39 1.33 0.00 0.00 0.00 175.76 176.81 2fr2 n VAL 148 N -0.15 -1.74 -0.95 0.00 0.24 -0.27 -0.70 118.33 114.78 2fr2 n VAL 148 Ca -0.13 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 2fr2 n VAL 148 Cb 0.62 -1.76 0.00 0.00 -1.47 0.00 0.00 33.84 31.23 2fr2 n VAL 148 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fr2 n GLY 149 N -1.95 0.82 3.72 7.63 0.00 -1.26 -5.03 105.19 109.13 2fr2 n GLY 149 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2fr2 n GLY 149 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fr2 s GLN 150 N -0.05 2.84 0.82 1.61 -1.52 0.13 -5.10 119.66 118.38 2fr2 s GLN 150 Ca 0.00 -0.62 -0.11 0.00 -1.95 0.00 0.00 55.36 52.68 2fr2 s GLN 150 Cb 0.00 -2.71 0.08 0.00 -0.22 0.00 0.00 33.01 30.16 2fr2 s GLN 150 CO 0.00 0.61 1.09 -1.25 -0.25 0.00 0.00 175.29 175.49 2fr2 s PRO 151 N -1.85 1.91 -0.03 2.91 0.04 -1.26 -3.01 135.00 133.71 2fr2 s PRO 151 Ca 0.23 0.94 -0.36 0.00 0.04 0.00 0.00 61.00 61.85 2fr2 s PRO 151 Cb -0.12 -1.87 -0.14 0.00 0.04 0.00 0.00 34.50 32.41 2fr2 s PRO 151 CO 0.14 -1.82 1.69 -0.11 0.04 0.00 0.00 177.00 176.94 2fr2 n LEU 152 N -3.61 2.87 -3.79 -3.56 7.94 -1.26 -4.56 117.00 111.03 2fr2 n LEU 152 Ca 0.08 1.05 -0.05 0.00 -1.11 0.00 0.00 56.01 55.97 2fr2 n LEU 152 Cb 0.54 -1.31 -0.02 0.00 0.53 0.00 0.00 43.42 43.16 2fr2 n LEU 152 CO 0.55 -0.35 0.61 0.00 -1.11 0.00 0.00 177.39 177.09 2fr2 s GLN 153 N 2.54 1.44 0.32 1.96 -2.07 -0.65 -4.89 119.66 118.31 2fr2 s GLN 153 Ca 0.89 -0.79 -0.29 0.00 -1.82 0.00 0.00 55.36 53.34 2fr2 s GLN 153 Cb -0.80 0.50 -0.12 0.00 -1.09 0.00 0.00 33.01 31.50 2fr2 s GLN 153 CO 0.50 -0.66 1.50 -0.25 -1.32 0.00 0.00 175.29 175.05 2fr2 n ASP 154 N -0.46 3.55 0.03 12.60 8.00 -1.26 -0.45 116.55 138.56 2fr2 n ASP 154 Ca -0.05 1.18 0.00 0.00 0.71 0.00 0.00 54.79 56.63 2fr2 n ASP 154 Cb 0.60 -1.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 2fr2 n ASP 154 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 2fr2 n HIS 155 N 1.33 -0.49 -4.18 1.24 -0.00 -0.38 -4.71 115.22 108.03 2fr2 n HIS 155 Ca 0.06 0.09 -0.18 0.00 -0.00 0.00 0.00 57.72 57.69 2fr2 n HIS 155 Cb 0.37 0.34 -0.12 0.00 -0.00 0.00 0.00 29.99 30.58 2fr2 n HIS 155 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2fr2 s LEU 156 N -5.82 2.31 -0.15 0.27 1.43 -0.86 -0.96 118.68 114.90 2fr2 s LEU 156 Ca 0.00 -0.67 -0.27 0.00 -1.03 0.00 0.00 54.13 52.16 2fr2 s LEU 156 Cb 0.00 -0.49 0.07 0.00 0.03 0.00 0.00 46.19 45.80 2fr2 s LEU 156 CO 0.00 -0.11 0.68 0.00 0.23 0.00 0.00 176.35 177.15 2fr2 s ALA 157 N -1.57 -1.72 0.17 4.21 0.00 -0.74 -0.43 121.76 121.68 2fr2 s ALA 157 Ca 0.01 1.61 -0.14 0.00 0.00 0.00 0.00 51.96 53.44 2fr2 s ALA 157 Cb -0.08 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.48 2fr2 s ALA 157 CO 0.02 -0.35 0.40 0.00 0.00 0.00 0.00 175.76 175.84 2fr2 s ALA 158 N -0.42 -0.57 -0.08 0.00 0.00 -0.87 -1.11 121.76 118.71 2fr2 s ALA 158 Ca -0.06 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.46 2fr2 s ALA 158 Cb -0.03 0.81 0.02 0.00 0.00 0.00 0.00 23.12 23.92 2fr2 s ALA 158 CO 0.05 -0.71 -0.10 0.08 0.00 0.00 0.00 175.76 175.09 2fr2 s VAL 159 N -3.90 1.02 0.25 0.00 1.01 -0.74 -1.56 120.40 116.48 2fr2 s VAL 159 Ca 0.11 -0.36 0.11 0.00 0.00 0.00 0.00 61.98 61.84 2fr2 s VAL 159 Cb 0.01 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 2fr2 s VAL 159 CO -0.04 0.34 -0.21 -0.76 0.00 0.00 0.00 175.10 174.44 2fr2 s LEU 160 N 1.07 2.54 0.05 3.92 1.43 0.75 -1.96 118.68 126.47 2fr2 s LEU 160 Ca -0.07 -0.97 0.06 0.00 -1.03 0.00 0.00 54.13 52.12 2fr2 s LEU 160 Cb -0.14 -1.09 -0.02 0.00 0.03 0.00 0.00 46.19 44.96 2fr2 s LEU 160 CO -0.01 0.05 -0.18 -1.00 0.23 0.00 0.00 176.35 175.44 2fr2 s HIS 161 N -2.27 1.54 0.21 0.29 3.76 0.21 -0.79 115.29 118.24 2fr2 s HIS 161 Ca 0.26 -0.37 -0.31 0.00 -0.15 0.00 0.00 55.06 54.49 2fr2 s HIS 161 Cb -0.06 -0.90 -0.11 0.00 1.11 0.00 0.00 32.58 32.62 2fr2 s HIS 161 CO 0.13 0.08 1.58 0.50 -0.85 0.00 0.00 174.74 176.17 2fr2 s ARG 162 N -1.26 4.19 0.07 1.40 3.52 -0.39 -1.33 118.95 125.15 2fr2 s ARG 162 Ca 0.04 2.43 -0.15 0.00 -0.13 0.00 0.00 55.73 57.93 2fr2 s ARG 162 Cb -0.09 -3.11 -0.06 0.00 -1.56 0.00 0.00 34.95 30.13 2fr2 s ARG 162 CO 0.02 -0.60 0.48 -0.65 -0.81 0.00 0.00 175.30 173.74 2fr2 s GLN 163 N 0.58 3.98 0.00 5.12 -1.52 0.73 -4.92 119.66 123.63 2fr2 s GLN 163 Ca 0.68 0.47 0.16 0.00 -1.95 0.00 0.00 55.36 54.72 2fr2 s GLN 163 Cb -0.45 -3.11 0.96 0.00 -0.22 0.00 0.00 33.01 30.19 2fr2 s GLN 163 CO 0.36 0.60 1.37 2.89 -0.25 0.00 0.00 175.29 180.27