#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fpa s MET 1 N 0.00 4.27 -0.75 1.57 1.00 -1.26 -4.92 119.30 119.21 3fpa s MET 1 Ca 0.00 0.70 0.03 0.00 0.00 0.00 0.00 55.69 56.42 3fpa s MET 1 Cb 0.00 -3.32 0.29 0.00 0.00 0.00 0.00 34.83 31.80 3fpa s MET 1 CO 0.00 0.44 1.04 0.25 0.00 0.00 0.00 175.02 176.75 3fpa n THR 2 N 2.49 3.49 -4.09 2.05 -2.24 -1.26 -5.04 114.28 109.68 3fpa n THR 2 Ca -0.08 -5.53 -0.35 0.00 -2.27 0.00 0.00 64.05 55.82 3fpa n THR 2 Cb 0.51 -1.87 -0.08 0.00 -2.10 0.00 0.00 70.33 66.78 3fpa n THR 2 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3fpa s ILE 3 N -3.21 4.86 -0.18 2.28 1.01 -1.26 -2.27 121.20 122.43 3fpa s ILE 3 Ca 0.40 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 61.03 3fpa s ILE 3 Cb 0.17 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.53 3fpa s ILE 3 CO -0.03 0.56 -0.17 -0.76 0.00 0.00 0.00 174.94 174.53 3fpa s LEU 4 N -0.47 2.28 0.14 2.97 1.43 0.69 -3.89 118.68 121.84 3fpa s LEU 4 Ca 0.10 -0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 3fpa s LEU 4 Cb -0.12 -1.52 -0.07 0.00 0.03 0.00 0.00 46.19 44.51 3fpa s LEU 4 CO 0.02 0.02 1.00 -0.69 0.23 0.00 0.00 176.35 176.93 3fpa s VAL 5 N 1.19 4.27 -0.39 -1.59 1.01 -0.54 -1.16 120.40 123.19 3fpa s VAL 5 Ca 0.02 1.94 -0.04 0.00 0.00 0.00 0.00 61.98 63.90 3fpa s VAL 5 Cb -0.14 -4.24 0.09 0.00 0.00 0.00 0.00 36.38 32.09 3fpa s VAL 5 CO -0.08 0.33 0.17 -0.69 0.00 0.00 0.00 175.10 174.82 3fpa s VAL 6 N -0.20 3.47 0.35 2.92 1.01 0.24 0.31 120.40 128.51 3fpa s VAL 6 Ca 0.47 -1.72 0.02 0.00 0.00 0.00 0.00 61.98 60.76 3fpa s VAL 6 Cb -0.25 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 32.93 3fpa s VAL 6 CO 0.31 -0.50 0.20 1.07 0.00 0.00 0.00 175.10 176.18 3fpa n THR 7 N 4.69 0.00 -3.97 3.92 5.66 0.20 -3.87 114.28 120.90 3fpa n THR 7 Ca -0.07 -1.47 -0.11 0.00 -3.05 0.00 0.00 64.05 59.36 3fpa n THR 7 Cb 0.42 -0.06 -0.03 0.00 -1.55 0.00 0.00 70.33 69.11 3fpa n THR 7 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 3fpa s GLY 8 N -3.19 0.75 0.00 1.09 0.00 -1.26 -0.52 107.32 104.19 3fpa s GLY 8 Ca 0.15 -1.00 0.28 0.00 0.00 0.00 0.00 44.72 44.15 3fpa s GLY 8 CO 0.10 -0.63 1.86 -1.30 0.00 0.00 0.00 173.10 173.13 3fpa n THR 9 N -0.48 0.00 -3.51 0.90 -2.24 -0.72 -3.50 114.28 104.73 3fpa n THR 9 Ca -0.03 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3fpa n THR 9 Cb 0.61 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 3fpa n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fpa n GLY 10 N 1.47 0.71 3.86 3.38 0.00 -1.26 -4.75 105.19 108.61 3fpa n GLY 10 Ca 0.08 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 3fpa n GLY 10 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3fpa s THR 11 N -2.11 4.98 -0.16 2.61 -1.32 -1.26 -3.84 115.64 114.54 3fpa s THR 11 Ca 0.00 0.53 0.00 0.00 -1.21 0.00 0.00 61.69 61.01 3fpa s THR 11 Cb 0.00 -3.66 0.00 0.00 -1.51 0.00 0.00 72.50 67.33 3fpa s THR 11 CO 0.00 0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.17 3fpa n GLY 12 N 0.52 0.51 0.38 6.08 0.00 -1.26 -4.95 105.19 106.47 3fpa n GLY 12 Ca -0.04 -0.92 0.11 0.00 0.00 0.00 0.00 46.02 45.17 3fpa n GLY 12 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3fpa n VAL 13 N -2.95 0.00 0.00 1.61 0.24 -1.26 -4.97 118.33 111.00 3fpa n VAL 13 Ca -0.02 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 3fpa n VAL 13 Cb 0.05 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.43 3fpa n VAL 13 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fpa n GLY 14 N 1.41 1.26 0.20 7.63 0.00 -1.26 -4.01 105.19 110.42 3fpa n GLY 14 Ca 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 3fpa n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fpa h LYS 15 N 1.49 0.20 -0.36 1.61 1.57 -1.92 0.24 116.57 119.39 3fpa h LYS 15 Ca 0.00 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3fpa h LYS 15 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 3fpa h LYS 15 CO 0.00 0.13 0.10 1.15 -0.57 0.00 0.00 179.45 180.26 3fpa h THR 16 N 0.20 1.22 -0.02 -0.16 2.02 -1.96 -1.26 112.91 112.95 3fpa h THR 16 Ca 0.26 -0.71 -0.10 0.00 0.77 0.00 0.00 66.41 66.62 3fpa h THR 16 Cb 0.36 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 3fpa h THR 16 CO -0.36 0.25 -0.46 1.62 0.37 0.00 0.00 175.52 176.94 3fpa h VAL 17 N 0.43 1.33 -0.41 3.16 3.04 -1.90 -2.29 116.25 119.62 3fpa h VAL 17 Ca 0.12 -1.60 -0.12 0.00 -1.01 0.00 0.00 66.70 64.09 3fpa h VAL 17 Cb 0.27 1.84 -0.01 0.00 -2.01 0.00 0.00 31.29 31.38 3fpa h VAL 17 CO -0.00 0.46 -0.22 0.58 -1.01 0.00 0.00 177.57 177.38 3fpa h VAL 18 N 0.04 1.27 -0.54 1.51 2.07 -0.71 -0.63 116.25 119.25 3fpa h VAL 18 Ca -0.00 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 3fpa h VAL 18 Cb 0.83 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.77 3fpa h VAL 18 CO 0.06 0.45 0.29 0.00 0.02 0.00 0.00 177.57 178.40 3fpa h ALA 20 N 1.13 1.14 -0.03 0.00 0.00 -1.30 0.29 119.26 120.49 3fpa h ALA 20 Ca 0.19 -0.18 -0.24 0.00 0.00 0.00 0.00 54.91 54.68 3fpa h ALA 20 Cb 0.06 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.57 3fpa h ALA 20 CO -0.03 0.62 -0.95 0.00 0.00 0.00 0.00 179.25 178.89 3fpa h ALA 21 N 1.26 0.28 -0.39 0.00 0.00 -0.84 -1.04 119.26 118.54 3fpa h ALA 21 Ca 0.25 -0.68 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 3fpa h ALA 21 Cb 0.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3fpa h ALA 21 CO -0.02 0.74 -0.09 1.25 0.00 0.00 0.00 179.25 181.13 3fpa h LEU 22 N 0.34 0.75 -0.18 0.00 5.85 -0.91 -1.51 115.31 119.65 3fpa h LEU 22 Ca -0.09 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.27 3fpa h LEU 22 Cb 1.58 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 3fpa h LEU 22 CO 0.18 0.94 0.11 0.00 -0.34 0.00 0.00 178.44 179.33 3fpa h ALA 23 N 0.84 0.22 -0.21 1.25 0.00 -0.89 0.13 119.26 120.61 3fpa h ALA 23 Ca 0.10 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3fpa h ALA 23 Cb 0.60 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3fpa h ALA 23 CO 0.04 -0.28 0.12 1.03 0.00 0.00 0.00 179.25 180.15 3fpa h SER 24 N 0.22 0.20 -0.71 0.00 0.87 -1.14 0.51 113.55 113.50 3fpa h SER 24 Ca 0.06 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.63 3fpa h SER 24 Cb -0.01 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 61.88 3fpa h SER 24 CO -0.01 0.15 0.47 0.00 -0.53 0.00 0.00 176.83 176.91 3fpa h ALA 25 N 1.09 0.91 -0.43 6.23 0.00 -1.09 -0.91 119.26 125.06 3fpa h ALA 25 Ca 0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3fpa h ALA 25 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3fpa h ALA 25 CO -0.03 0.32 0.13 0.00 0.00 0.00 0.00 179.25 179.66 3fpa h ALA 26 N 1.26 0.56 -0.93 0.00 0.00 -0.30 -2.40 119.26 117.45 3fpa h ALA 26 Ca 0.26 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.06 3fpa h ALA 26 Cb -0.11 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.46 3fpa h ALA 26 CO -0.06 0.22 0.60 0.00 0.00 0.00 0.00 179.25 180.01 3fpa h ARG 27 N 0.55 1.02 0.00 0.00 3.08 0.36 0.05 114.38 119.44 3fpa h ARG 27 Ca 0.14 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 3fpa h ARG 27 Cb 0.28 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 3fpa h ARG 27 CO -0.00 0.67 -0.29 1.96 -1.07 0.00 0.00 179.97 181.24 3fpa h GLN 28 N 1.05 0.00 -0.01 0.04 4.20 -0.89 -0.50 115.11 119.00 3fpa h GLN 28 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 3fpa h GLN 28 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 3fpa h GLN 28 CO -0.16 0.29 0.00 0.00 -0.67 0.00 0.00 178.83 178.29 3fpa n ALA 29 N -2.22 2.61 -1.65 3.87 0.00 -0.93 -4.89 120.51 117.30 3fpa n ALA 29 Ca 0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 53.44 53.28 3fpa n ALA 29 Cb 0.52 -1.31 -0.00 0.00 0.00 0.00 0.00 19.45 18.66 3fpa n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 30 N 0.85 0.37 3.70 0.00 0.00 -0.19 -5.04 105.19 104.88 3fpa n GLY 30 Ca 0.15 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 3fpa n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fpa s ILE 31 N -2.02 5.03 0.22 -0.61 1.01 -0.04 -5.00 121.20 119.79 3fpa s ILE 31 Ca 0.00 0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.40 3fpa s ILE 31 Cb 0.00 -3.25 -0.09 0.00 0.01 0.00 0.00 42.46 39.14 3fpa s ILE 31 CO 0.00 0.49 1.20 -0.62 0.00 0.00 0.00 174.94 176.01 3fpa s ASP 32 N 0.02 7.08 -0.05 3.58 3.68 -1.24 -3.53 116.67 126.20 3fpa s ASP 32 Ca 0.07 2.30 0.03 0.00 2.13 0.00 0.00 52.55 57.08 3fpa s ASP 32 Cb -0.12 -2.62 0.01 0.00 -1.45 0.00 0.00 42.92 38.74 3fpa s ASP 32 CO 0.00 -0.36 -0.13 -0.69 0.13 0.00 0.00 175.17 174.12 3fpa s VAL 33 N -0.37 1.19 0.01 1.11 1.01 -1.26 0.05 120.40 122.14 3fpa s VAL 33 Ca 0.51 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 62.02 3fpa s VAL 33 Cb -0.34 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 3fpa s VAL 33 CO 0.39 0.36 -0.21 0.00 0.00 0.00 0.00 175.10 175.64 3fpa s ALA 34 N 0.41 2.43 -0.12 5.51 0.00 -0.54 -4.47 121.76 124.98 3fpa s ALA 34 Ca -0.10 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 50.73 3fpa s ALA 34 Cb -0.14 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.31 3fpa s ALA 34 CO 0.03 0.55 -0.18 0.08 0.00 0.00 0.00 175.76 176.24 3fpa s VAL 35 N -0.78 1.70 -0.18 0.00 1.01 0.61 -1.00 120.40 121.76 3fpa s VAL 35 Ca 0.12 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 3fpa s VAL 35 Cb -0.10 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 3fpa s VAL 35 CO 0.02 0.48 -0.04 0.00 0.00 0.00 0.00 175.10 175.57 3fpa s LYS 37 N 0.84 1.90 0.24 0.00 2.20 -0.19 -1.04 119.74 123.69 3fpa s LYS 37 Ca -0.01 -2.55 -0.04 0.00 -0.36 0.00 0.00 55.97 53.01 3fpa s LYS 37 Cb -0.15 -3.21 0.44 0.00 -1.51 0.00 0.00 37.83 33.40 3fpa s LYS 37 CO 0.02 -1.11 1.74 -1.00 -0.36 0.00 0.00 175.35 174.63 3fpa h PRO 38 N 6.53 0.46 -4.38 4.03 0.13 -1.75 -3.37 132.00 133.65 3fpa h PRO 38 Ca -0.07 -0.03 -0.47 0.00 -0.87 0.00 0.00 66.00 64.56 3fpa h PRO 38 Cb 0.90 -0.10 -0.33 0.00 0.13 0.00 0.00 31.00 31.59 3fpa h PRO 38 CO 0.67 0.31 -0.80 0.08 -0.23 0.00 0.00 178.00 178.02 3fpa s VAL 39 N -6.02 0.88 -0.06 1.56 1.01 -1.26 -1.20 120.40 115.30 3fpa s VAL 39 Ca -0.12 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.53 3fpa s VAL 39 Cb 0.20 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.77 3fpa s VAL 39 CO 0.76 0.30 -0.11 -1.58 0.00 0.00 0.00 175.10 174.47 3fpa s GLN 40 N 0.68 1.55 0.39 2.72 2.00 -0.80 -4.58 119.66 121.61 3fpa s GLN 40 Ca -0.12 -0.35 0.08 0.00 -2.00 0.00 0.00 55.36 52.96 3fpa s GLN 40 Cb -0.14 -1.32 -0.05 0.00 0.80 0.00 0.00 33.01 32.29 3fpa s GLN 40 CO 0.02 -0.01 0.14 0.95 -0.50 0.00 0.00 175.29 175.89 3fpa s THR 41 N 0.77 2.47 -0.04 -0.34 -4.23 -1.26 0.72 115.64 113.73 3fpa s THR 41 Ca -0.13 -1.76 -0.00 0.00 -1.18 0.00 0.00 61.69 58.62 3fpa s THR 41 Cb -0.15 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.73 3fpa s THR 41 CO 0.02 -0.07 0.03 0.61 -0.54 0.00 0.00 174.62 174.68 3fpa n GLY 42 N -1.16 0.74 0.92 3.99 0.00 0.15 -4.74 105.19 105.10 3fpa n GLY 42 Ca -0.02 -0.58 0.07 0.00 0.00 0.00 0.00 46.02 45.49 3fpa n GLY 42 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fpa n THR 43 N -2.04 0.73 -0.05 2.61 -2.24 -0.87 0.25 114.28 112.68 3fpa n THR 43 Ca -0.00 -0.66 -0.05 0.00 -2.27 0.00 0.00 64.05 61.06 3fpa n THR 43 Cb 0.50 0.26 -0.09 0.00 -2.10 0.00 0.00 70.33 68.91 3fpa n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fpa n ALA 44 N 0.86 1.73 0.30 6.98 0.00 -1.17 -3.99 120.51 125.22 3fpa n ALA 44 Ca 0.16 -0.72 0.16 0.00 0.00 0.00 0.00 53.44 53.04 3fpa n ALA 44 Cb 0.44 0.02 0.91 0.00 0.00 0.00 0.00 19.45 20.83 3fpa n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fpa h ARG 45 N 0.00 0.00 0.00 0.00 3.08 -1.76 -3.46 114.38 112.24 3fpa h ARG 45 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3fpa h ARG 45 Cb 1.67 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.72 3fpa h ARG 45 CO 0.02 0.03 0.00 0.41 -1.07 0.00 0.00 179.97 179.35 3fpa n GLY 46 N -1.14 0.96 3.73 0.04 0.00 -1.12 -5.07 105.19 102.59 3fpa n GLY 46 Ca -0.03 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 3fpa n GLY 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fpa s ASP 47 N -2.02 6.68 -0.36 1.61 -0.00 0.14 -4.95 116.67 117.76 3fpa s ASP 47 Ca 0.00 2.60 0.04 0.00 -0.00 0.00 0.00 52.55 55.18 3fpa s ASP 47 Cb 0.00 -2.61 0.19 0.00 -0.00 0.00 0.00 42.92 40.50 3fpa s ASP 47 CO 0.00 -0.71 0.71 -0.62 -0.00 0.00 0.00 175.17 174.55 3fpa s ASP 48 N 0.62 -1.31 0.23 0.27 3.68 -1.26 -4.38 116.67 114.51 3fpa s ASP 48 Ca 0.62 -0.39 -0.01 0.00 2.13 0.00 0.00 52.55 54.90 3fpa s ASP 48 Cb -0.41 1.72 0.24 0.00 -1.45 0.00 0.00 42.92 43.01 3fpa s ASP 48 CO 0.39 -0.18 1.60 0.44 0.13 0.00 0.00 175.17 177.55 3fpa h ASP 49 N 7.04 0.56 -0.30 -0.34 3.45 -1.96 -2.52 116.42 122.35 3fpa h ASP 49 Ca 0.01 -0.25 -0.07 0.00 0.43 0.00 0.00 57.03 57.15 3fpa h ASP 49 Cb 1.19 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.78 3fpa h ASP 49 CO 0.07 0.90 -0.04 -0.07 -1.57 0.00 0.00 179.24 178.54 3fpa h LEU 50 N 0.43 0.65 -0.28 1.55 3.38 -1.96 -0.37 115.31 118.71 3fpa h LEU 50 Ca 0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3fpa h LEU 50 Cb 0.90 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3fpa h LEU 50 CO 0.08 0.75 0.12 0.00 0.09 0.00 0.00 178.44 179.47 3fpa h ALA 51 N 1.33 0.36 -0.39 1.53 0.00 -1.93 -1.29 119.26 118.87 3fpa h ALA 51 Ca 0.12 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3fpa h ALA 51 Cb 0.45 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 3fpa h ALA 51 CO 0.02 -0.06 -0.24 0.93 0.00 0.00 0.00 179.25 179.90 3fpa h GLU 52 N 0.31 -0.17 -0.97 0.00 5.08 -0.97 -1.69 114.58 116.16 3fpa h GLU 52 Ca 0.09 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.51 3fpa h GLU 52 Cb 0.16 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 3fpa h GLU 52 CO -0.01 -0.11 0.63 0.28 -1.00 0.00 0.00 179.01 178.80 3fpa h VAL 53 N -0.18 1.13 0.05 3.13 2.07 -0.93 -1.50 116.25 120.03 3fpa h VAL 53 Ca 0.19 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3fpa h VAL 53 Cb 0.47 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 3fpa h VAL 53 CO -0.49 0.22 -0.03 1.23 0.02 0.00 0.00 177.57 178.52 3fpa h GLY 54 N 1.18 -0.07 1.02 2.17 0.00 -0.79 0.06 103.07 106.64 3fpa h GLY 54 Ca 0.40 0.03 -0.07 0.00 0.00 0.00 0.00 47.33 47.68 3fpa h GLY 54 CO -0.13 -0.03 0.07 -0.09 0.00 0.00 0.00 176.54 176.36 3fpa h ARG 55 N -0.20 0.92 0.19 4.80 2.43 -1.20 0.45 114.38 121.78 3fpa h ARG 55 Ca -0.01 -0.26 -0.27 0.00 -0.81 0.00 0.00 59.98 58.64 3fpa h ARG 55 Cb 0.18 -0.10 0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3fpa h ARG 55 CO 0.01 0.90 -1.19 -0.07 -1.51 0.00 0.00 179.97 178.11 3fpa h LEU 56 N 0.80 0.64 -0.25 3.80 3.38 -1.26 -3.40 115.31 119.03 3fpa h LEU 56 Ca 0.16 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.20 3fpa h LEU 56 Cb 0.44 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3fpa h LEU 56 CO 0.01 1.57 -0.33 0.00 0.09 0.00 0.00 178.44 179.78 3fpa n ALA 57 N -2.72 3.01 -1.04 1.53 0.00 0.00 -4.60 120.51 116.69 3fpa n ALA 57 Ca -0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 53.44 52.96 3fpa n ALA 57 Cb 0.96 -0.32 -0.01 0.00 0.00 0.00 0.00 19.45 20.09 3fpa n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 58 N 1.09 0.46 3.77 0.00 0.00 0.16 -4.68 105.19 105.99 3fpa n GLY 58 Ca 0.02 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 3fpa n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpa s VAL 59 N -1.82 2.61 -0.02 1.61 1.01 -1.25 -4.93 120.40 117.62 3fpa s VAL 59 Ca 0.00 0.59 0.05 0.00 0.00 0.00 0.00 61.98 62.63 3fpa s VAL 59 Cb 0.00 -3.38 -0.08 0.00 0.00 0.00 0.00 36.38 32.92 3fpa s VAL 59 CO 0.00 0.13 0.10 0.35 0.00 0.00 0.00 175.10 175.68 3fpa n THR 60 N 1.03 0.08 -2.70 3.92 -2.24 -1.26 -4.38 114.28 108.73 3fpa n THR 60 Ca 0.01 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 3fpa n THR 60 Cb 0.41 0.10 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 3fpa n THR 60 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3fpa s GLN 61 N -2.33 3.74 -0.24 -0.78 -1.52 -1.26 -4.92 119.66 112.34 3fpa s GLN 61 Ca -0.02 -1.64 0.01 0.00 -1.95 0.00 0.00 55.36 51.75 3fpa s GLN 61 Cb 0.03 -5.25 0.06 0.00 -0.22 0.00 0.00 33.01 27.63 3fpa s GLN 61 CO 0.23 -2.05 -0.05 -0.51 -0.25 0.00 0.00 175.29 172.66 3fpa s LEU 62 N 3.82 2.59 -0.06 2.90 1.43 -1.26 -0.28 118.68 127.82 3fpa s LEU 62 Ca 0.44 -1.20 0.05 0.00 -1.03 0.00 0.00 54.13 52.39 3fpa s LEU 62 Cb -0.01 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 45.03 3fpa s LEU 62 CO -0.05 -0.24 -0.23 0.00 0.23 0.00 0.00 176.35 176.06 3fpa s ALA 63 N 1.40 2.27 0.24 4.21 0.00 -0.28 -5.01 121.76 124.59 3fpa s ALA 63 Ca -0.05 -1.03 -0.08 0.00 0.00 0.00 0.00 51.96 50.80 3fpa s ALA 63 Cb -0.19 -0.75 -0.02 0.00 0.00 0.00 0.00 23.12 22.16 3fpa s ALA 63 CO -0.07 0.43 0.36 0.20 0.00 0.00 0.00 175.76 176.68 3fpa s GLY 64 N -0.21 0.95 0.00 0.00 0.00 -1.26 -1.02 107.32 105.78 3fpa s GLY 64 Ca -0.02 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.47 3fpa s GLY 64 CO 0.03 -0.93 0.00 1.04 0.00 0.00 0.00 173.10 173.24 3fpa n LEU 65 N -0.36 0.05 -3.71 0.66 4.77 -0.34 -4.95 117.00 113.11 3fpa n LEU 65 Ca -0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 3fpa n LEU 65 Cb 0.63 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.65 3fpa n LEU 65 CO 0.27 0.01 0.11 0.00 -1.33 0.00 0.00 177.39 176.44 3fpa s ALA 66 N -1.70 -0.95 -0.05 -1.18 0.00 -0.72 -5.01 121.76 112.16 3fpa s ALA 66 Ca 0.00 0.43 -0.02 0.00 0.00 0.00 0.00 51.96 52.37 3fpa s ALA 66 Cb 0.00 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.30 3fpa s ALA 66 CO 0.00 -0.33 0.10 1.03 0.00 0.00 0.00 175.76 176.56 3fpa s ARG 67 N -1.66 0.02 -0.09 0.00 0.52 -1.25 -1.91 118.95 114.57 3fpa s ARG 67 Ca -0.11 0.33 0.03 0.00 -0.52 0.00 0.00 55.73 55.47 3fpa s ARG 67 Cb -0.03 -0.26 -0.01 0.00 0.52 0.00 0.00 34.95 35.17 3fpa s ARG 67 CO 0.03 -0.21 -0.20 0.71 0.02 0.00 0.00 175.30 175.65 3fpa s TYR 68 N 1.41 2.61 0.11 -0.53 1.51 0.22 -4.98 117.35 117.70 3fpa s TYR 68 Ca -0.06 -0.74 -0.19 0.00 -1.01 0.00 0.00 57.07 55.07 3fpa s TYR 68 Cb -0.12 -1.71 -0.07 0.00 -0.11 0.00 0.00 41.96 39.95 3fpa s TYR 68 CO -0.05 -0.23 1.69 -1.00 -1.11 0.00 0.00 175.55 174.86 3fpa h PRO 69 N 6.37 0.31 -6.67 -1.71 0.13 -1.90 0.45 132.00 128.99 3fpa h PRO 69 Ca -0.28 -0.04 -0.53 0.00 -0.87 0.00 0.00 66.00 64.29 3fpa h PRO 69 Cb 1.20 -0.06 0.04 0.00 0.13 0.00 0.00 31.00 32.31 3fpa h PRO 69 CO 0.50 0.31 0.70 -0.65 -0.23 0.00 0.00 178.00 178.63 3fpa s GLN 70 N -5.80 4.34 -1.42 0.86 -1.52 -1.26 -2.11 119.66 112.75 3fpa s GLN 70 Ca -0.13 2.13 -0.12 0.00 -1.95 0.00 0.00 55.36 55.29 3fpa s GLN 70 Cb 0.08 -3.18 -0.04 0.00 -0.22 0.00 0.00 33.01 29.65 3fpa s GLN 70 CO 0.71 -0.34 2.52 -0.35 -0.25 0.00 0.00 175.29 177.57 3fpa n PRO 71 N 2.84 3.04 -4.44 2.91 -0.04 -1.26 -2.76 135.00 135.29 3fpa n PRO 71 Ca 0.07 -2.24 -0.21 0.00 -0.04 0.00 0.00 63.50 61.08 3fpa n PRO 71 Cb 0.42 -2.96 -0.10 0.00 -0.04 0.00 0.00 33.50 30.82 3fpa n PRO 71 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3fpa s MET 72 N 2.92 1.66 0.41 0.54 -1.94 -1.26 -4.94 119.30 116.68 3fpa s MET 72 Ca 0.57 -1.94 -0.26 0.00 -1.71 0.00 0.00 55.69 52.35 3fpa s MET 72 Cb 0.15 -0.69 -0.10 0.00 2.01 0.00 0.00 34.83 36.20 3fpa s MET 72 CO -0.05 -0.27 1.32 0.00 -0.01 0.00 0.00 175.02 176.00 3fpa n ALA 73 N -0.69 1.49 -0.34 3.03 0.00 -1.26 -4.62 120.51 118.13 3fpa n ALA 73 Ca -0.03 0.29 0.12 0.00 0.00 0.00 0.00 53.44 53.82 3fpa n ALA 73 Cb 0.66 -2.30 0.25 0.00 0.00 0.00 0.00 19.45 18.06 3fpa n ALA 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3fpa h PRO 74 N 2.28 0.02 -0.18 0.00 0.11 -1.95 0.44 132.00 132.71 3fpa h PRO 74 Ca -0.48 -0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 3fpa h PRO 74 Cb 1.28 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 3fpa h PRO 74 CO 0.61 0.01 -0.30 0.00 -0.21 0.00 0.00 178.00 178.11 3fpa h ALA 75 N 1.96 1.14 -0.10 -0.75 0.00 -1.90 0.31 119.26 119.92 3fpa h ALA 75 Ca 0.56 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 3fpa h ALA 75 Cb 1.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3fpa h ALA 75 CO -0.92 0.55 -0.33 0.00 0.00 0.00 0.00 179.25 178.55 3fpa h ALA 76 N 1.37 0.17 -0.46 0.00 0.00 -1.50 -2.07 119.26 116.77 3fpa h ALA 76 Ca 0.04 -0.43 0.07 0.00 0.00 0.00 0.00 54.91 54.59 3fpa h ALA 76 Cb 0.70 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 3fpa h ALA 76 CO 0.05 0.23 0.13 0.00 0.00 0.00 0.00 179.25 179.66 3fpa h ALA 77 N 0.48 0.54 0.18 0.00 0.00 -0.79 -1.80 119.26 117.87 3fpa h ALA 77 Ca -0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3fpa h ALA 77 Cb 0.95 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3fpa h ALA 77 CO 0.07 -0.27 -0.09 0.00 0.00 0.00 0.00 179.25 178.97 3fpa h ALA 78 N 1.33 -0.24 -0.44 0.00 0.00 -0.95 -2.85 119.26 116.11 3fpa h ALA 78 Ca 0.22 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.10 3fpa h ALA 78 Cb 0.26 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3fpa h ALA 78 CO -0.26 -0.63 0.29 1.49 0.00 0.00 0.00 179.25 180.14 3fpa h GLU 79 N -0.25 0.51 -0.11 0.00 4.81 -1.24 -1.56 114.58 116.74 3fpa h GLU 79 Ca -0.02 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.08 3fpa h GLU 79 Cb 0.19 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3fpa h GLU 79 CO 0.04 0.34 -0.38 1.25 -0.73 0.00 0.00 179.01 179.53 3fpa h HIS 80 N 0.52 0.26 0.00 0.92 2.76 -1.17 -3.22 115.15 115.23 3fpa h HIS 80 Ca 0.17 -0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 3fpa h HIS 80 Cb 0.05 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 28.95 3fpa h HIS 80 CO -0.00 0.58 -0.96 0.00 -1.30 0.00 0.00 177.93 176.25 3fpa n ALA 81 N -2.47 2.65 -2.81 5.26 0.00 -0.79 -4.97 120.51 117.37 3fpa n ALA 81 Ca -0.01 -0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.09 3fpa n ALA 81 Cb 0.45 -1.10 0.03 0.00 0.00 0.00 0.00 19.45 18.83 3fpa n ALA 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 82 N 1.22 0.35 2.83 0.00 0.00 -0.65 -5.06 105.19 103.88 3fpa n GLY 82 Ca 0.01 -0.32 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 3fpa n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3fpa s MET 83 N -5.26 0.28 0.98 1.61 -1.94 -0.84 -5.04 119.30 109.08 3fpa s MET 83 Ca 0.17 0.32 -0.12 0.00 -1.71 0.00 0.00 55.69 54.35 3fpa s MET 83 Cb -0.07 -0.81 0.10 0.00 2.01 0.00 0.00 34.83 36.06 3fpa s MET 83 CO 0.27 -0.69 0.68 0.00 -0.01 0.00 0.00 175.02 175.27 3fpa n ALA 84 N 5.34 -2.16 -1.46 3.03 0.00 -1.26 -4.56 120.51 119.44 3fpa n ALA 84 Ca -0.04 -0.71 -0.30 0.00 0.00 0.00 0.00 53.44 52.39 3fpa n ALA 84 Cb 0.50 -1.93 0.08 0.00 0.00 0.00 0.00 19.45 18.10 3fpa n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fpa s LEU 85 N -3.58 2.79 0.00 0.00 1.43 -1.26 -5.02 118.68 113.05 3fpa s LEU 85 Ca 0.61 1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 55.12 3fpa s LEU 85 Cb -0.21 -4.20 0.17 0.00 0.03 0.00 0.00 46.19 41.97 3fpa s LEU 85 CO 0.64 -1.90 0.37 -2.65 0.23 0.00 0.00 176.35 173.04 3fpa n PRO 86 N -3.41 -2.44 -4.19 1.29 -0.02 -1.26 -4.61 135.00 120.36 3fpa n PRO 86 Ca 0.07 -0.63 -0.27 0.00 -2.02 0.00 0.00 63.50 60.66 3fpa n PRO 86 Cb 0.55 -0.93 -0.08 0.00 -0.02 0.00 0.00 33.50 33.02 3fpa n PRO 86 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fpa s ALA 87 N -2.05 3.24 0.20 3.55 0.00 -1.26 -2.74 121.76 122.70 3fpa s ALA 87 Ca 0.29 -1.34 -0.13 0.00 0.00 0.00 0.00 51.96 50.77 3fpa s ALA 87 Cb -0.05 -1.03 0.23 0.00 0.00 0.00 0.00 23.12 22.26 3fpa s ALA 87 CO 0.24 0.49 1.64 -0.09 0.00 0.00 0.00 175.76 178.05 3fpa h ARG 88 N 2.71 0.03 -0.03 0.00 2.43 -1.87 -2.31 114.38 115.33 3fpa h ARG 88 Ca -0.47 -0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.53 3fpa h ARG 88 Cb 1.20 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3fpa h ARG 88 CO 0.59 0.02 -0.74 -0.44 -1.51 0.00 0.00 179.97 177.88 3fpa h ASP 89 N 0.03 0.26 -0.78 -3.80 3.32 -1.95 -1.99 116.42 111.51 3fpa h ASP 89 Ca 0.29 -0.18 0.17 0.00 0.02 0.00 0.00 57.03 57.33 3fpa h ASP 89 Cb 0.45 -0.08 -0.11 0.00 0.22 0.00 0.00 39.33 39.81 3fpa h ASP 89 CO -0.57 0.91 0.22 1.56 -1.72 0.00 0.00 179.24 179.64 3fpa h GLN 90 N 0.14 0.29 -0.03 3.56 4.20 -1.85 -0.64 115.11 120.77 3fpa h GLN 90 Ca -0.03 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 3fpa h GLN 90 Cb 1.31 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.03 3fpa h GLN 90 CO 0.11 0.19 -0.12 0.82 -0.67 0.00 0.00 178.83 179.16 3fpa h ILE 91 N 0.29 1.49 -0.72 2.54 2.04 -0.96 -2.69 117.51 119.51 3fpa h ILE 91 Ca 0.45 -1.63 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 3fpa h ILE 91 Cb 0.79 2.50 -0.03 0.00 -0.74 0.00 0.00 36.82 39.34 3fpa h ILE 91 CO -0.52 0.44 0.42 0.58 0.00 0.00 0.00 178.15 179.07 3fpa h VAL 92 N -0.47 1.21 -0.05 1.67 2.07 -1.25 -2.12 116.25 117.30 3fpa h VAL 92 Ca -0.01 -0.47 -0.17 0.00 0.82 0.00 0.00 66.70 66.87 3fpa h VAL 92 Cb 0.79 0.21 0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3fpa h VAL 92 CO 0.03 0.22 -0.62 0.03 0.02 0.00 0.00 177.57 177.24 3fpa h ARG 93 N 0.99 0.50 -0.52 1.57 3.08 -1.21 -0.90 114.38 117.89 3fpa h ARG 93 Ca 0.26 -0.48 0.09 0.00 0.07 0.00 0.00 59.98 59.92 3fpa h ARG 93 Cb -0.02 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 30.05 3fpa h ARG 93 CO -0.05 1.12 -0.36 1.25 -1.07 0.00 0.00 179.97 180.86 3fpa h LEU 94 N 0.07 -1.22 -0.55 3.04 6.46 -1.34 0.32 115.31 122.09 3fpa h LEU 94 Ca -0.06 0.22 -0.03 0.00 -0.12 0.00 0.00 57.88 57.88 3fpa h LEU 94 Cb 1.30 0.58 -0.02 0.00 -0.73 0.00 0.00 40.66 41.78 3fpa h LEU 94 CO 0.12 -0.32 0.21 0.40 -0.62 0.00 0.00 178.44 178.24 3fpa h ILE 95 N -0.21 1.22 0.00 4.05 2.04 -1.42 -1.89 117.51 121.30 3fpa h ILE 95 Ca 0.20 -0.70 -0.09 0.00 1.00 0.00 0.00 64.86 65.27 3fpa h ILE 95 Cb 0.55 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3fpa h ILE 95 CO -0.64 0.27 -0.42 0.00 0.00 0.00 0.00 178.15 177.36 3fpa h ALA 96 N 1.06 1.15 -0.21 1.87 0.00 -0.55 -2.80 119.26 119.78 3fpa h ALA 96 Ca 0.18 -0.38 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 3fpa h ALA 96 Cb 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3fpa h ALA 96 CO -0.01 0.52 -0.46 -0.44 0.00 0.00 0.00 179.25 178.87 3fpa h ASP 97 N 0.00 0.56 -0.59 0.00 3.32 -0.11 -3.21 116.42 116.38 3fpa h ASP 97 Ca -0.00 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.74 3fpa h ASP 97 Cb 0.82 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 3fpa h ASP 97 CO 0.05 0.94 0.21 -0.07 -1.72 0.00 0.00 179.24 178.65 3fpa h LEU 98 N 0.42 0.85 -9.86 1.55 3.38 -1.10 -3.44 115.31 107.11 3fpa h LEU 98 Ca 0.03 -0.19 -0.53 0.00 0.09 0.00 0.00 57.88 57.27 3fpa h LEU 98 Cb 0.96 -0.22 0.09 0.00 0.09 0.00 0.00 40.66 41.59 3fpa h LEU 98 CO 0.09 0.81 0.86 -0.62 0.09 0.00 0.00 178.44 179.67 3fpa s ASP 99 N -6.16 6.33 0.26 -0.43 2.15 -1.09 -4.98 116.67 112.75 3fpa s ASP 99 Ca -0.13 3.02 -0.16 0.00 0.43 0.00 0.00 52.55 55.71 3fpa s ASP 99 Cb 0.13 -2.65 0.01 0.00 -0.30 0.00 0.00 42.92 40.11 3fpa s ASP 99 CO 0.80 -0.92 0.58 0.00 -0.17 0.00 0.00 175.17 175.46 3fpa s ARG 100 N -1.11 1.65 0.31 4.34 1.70 -1.26 -5.01 118.95 119.58 3fpa s ARG 100 Ca 0.60 -1.15 -0.29 0.00 -0.47 0.00 0.00 55.73 54.41 3fpa s ARG 100 Cb -0.48 0.53 -0.11 0.00 -0.57 0.00 0.00 34.95 34.32 3fpa s ARG 100 CO 0.54 -0.72 1.46 -2.14 -1.08 0.00 0.00 175.30 173.36 3fpa s PRO 101 N -3.96 4.21 0.00 3.89 0.02 -1.26 -2.12 135.00 135.78 3fpa s PRO 101 Ca 0.18 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.63 3fpa s PRO 101 Cb -0.03 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.45 3fpa s PRO 101 CO 0.08 -0.46 0.00 0.41 -0.33 0.00 0.00 177.00 176.71 3fpa n GLY 102 N 1.40 2.15 3.81 0.52 0.00 -1.26 -5.00 105.19 106.81 3fpa n GLY 102 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 3fpa n GLY 102 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fpa s ARG 103 N -0.03 3.98 -0.34 1.61 3.52 -0.90 -3.69 118.95 123.09 3fpa s ARG 103 Ca 0.00 0.36 -0.15 0.00 -0.13 0.00 0.00 55.73 55.82 3fpa s ARG 103 Cb 0.00 -3.26 -0.01 0.00 -1.56 0.00 0.00 34.95 30.11 3fpa s ARG 103 CO 0.00 0.59 0.35 -1.17 -0.81 0.00 0.00 175.30 174.26 3fpa s LEU 104 N -0.72 4.45 -0.24 -0.88 0.20 0.11 -4.70 118.68 116.90 3fpa s LEU 104 Ca 0.23 -0.26 -0.09 0.00 0.69 0.00 0.00 54.13 54.70 3fpa s LEU 104 Cb -0.16 -2.32 -0.04 0.00 -0.43 0.00 0.00 46.19 43.24 3fpa s LEU 104 CO 0.12 -0.33 0.13 -0.89 -0.29 0.00 0.00 176.35 175.08 3fpa s THR 105 N 1.99 5.00 -0.13 3.68 2.01 -0.96 -1.47 115.64 125.75 3fpa s THR 105 Ca 0.11 0.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.14 3fpa s THR 105 Cb -0.17 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 3fpa s THR 105 CO 0.12 0.34 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.58 3fpa s LEU 106 N 1.21 3.21 -0.19 4.42 1.43 -0.17 -0.22 118.68 128.36 3fpa s LEU 106 Ca 0.06 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.05 3fpa s LEU 106 Cb -0.14 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.33 3fpa s LEU 106 CO 0.05 0.23 -0.12 -0.69 0.23 0.00 0.00 176.35 176.05 3fpa s VAL 107 N -0.00 2.77 -0.16 -1.59 1.01 -0.31 -0.49 120.40 121.63 3fpa s VAL 107 Ca 0.00 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 3fpa s VAL 107 Cb -0.13 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 3fpa s VAL 107 CO 0.03 0.49 0.04 -0.70 0.00 0.00 0.00 175.10 174.96 3fpa s GLU 108 N 1.21 3.75 0.00 2.72 2.12 -0.21 0.79 118.70 129.09 3fpa s GLU 108 Ca 0.02 -0.36 0.00 0.00 0.36 0.00 0.00 54.97 54.99 3fpa s GLU 108 Cb -0.14 -3.11 0.00 0.00 0.26 0.00 0.00 34.13 31.14 3fpa s GLU 108 CO -0.05 0.37 0.00 0.41 -0.54 0.00 0.00 175.26 175.44 3fpa n GLY 109 N 3.22 0.61 3.30 -1.50 0.00 -1.25 -4.31 105.19 105.26 3fpa n GLY 109 Ca -0.17 -1.74 -0.33 0.00 0.00 0.00 0.00 46.02 43.78 3fpa n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpa s ALA 110 N -3.35 2.48 0.00 4.61 0.00 -1.26 -4.94 121.76 119.30 3fpa s ALA 110 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.99 3fpa s ALA 110 Cb 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.99 3fpa s ALA 110 CO 0.00 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.32 3fpa n GLY 111 N 3.73 2.40 3.93 0.00 0.00 -1.26 -4.67 105.19 109.31 3fpa n GLY 111 Ca -0.19 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 3fpa n GLY 111 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fpa s GLY 112 N -0.88 1.72 0.37 -0.02 0.00 -1.25 -4.37 107.32 102.89 3fpa s GLY 112 Ca 0.00 -1.07 0.12 0.00 0.00 0.00 0.00 44.72 43.77 3fpa s GLY 112 CO 0.00 -0.43 1.82 -2.00 0.00 0.00 0.00 173.10 172.49 3fpa h LEU 113 N -1.27 0.58 -2.30 0.66 5.85 -1.88 -2.74 115.31 114.21 3fpa h LEU 113 Ca -0.44 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.34 3fpa h LEU 113 Cb 1.27 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3fpa h LEU 113 CO 0.48 0.22 0.00 0.18 -0.34 0.00 0.00 178.44 178.98 3fpa n LEU 114 N -4.61 3.38 -4.73 2.25 4.32 -1.26 -3.77 117.00 112.58 3fpa n LEU 114 Ca 0.21 -1.58 -0.42 0.00 -0.02 0.00 0.00 56.01 54.20 3fpa n LEU 114 Cb 0.64 -0.34 -0.03 0.00 -1.62 0.00 0.00 43.42 42.07 3fpa n LEU 114 CO 0.27 0.79 1.10 -0.69 -1.22 0.00 0.00 177.39 177.64 3fpa s VAL 115 N -1.32 2.86 0.03 4.08 1.01 -1.04 -4.92 120.40 121.10 3fpa s VAL 115 Ca 0.41 0.67 -0.30 0.00 0.00 0.00 0.00 61.98 62.76 3fpa s VAL 115 Cb 0.23 -3.43 -0.06 0.00 0.00 0.00 0.00 36.38 33.12 3fpa s VAL 115 CO 0.31 0.09 1.32 -0.70 0.00 0.00 0.00 175.10 176.11 3fpa s GLU 116 N 0.25 4.34 -0.01 2.72 2.12 -1.26 -4.14 118.70 122.72 3fpa s GLU 116 Ca 0.62 1.90 0.03 0.00 0.36 0.00 0.00 54.97 57.87 3fpa s GLU 116 Cb -0.40 -3.44 -0.04 0.00 0.26 0.00 0.00 34.13 30.51 3fpa s GLU 116 CO 0.38 -0.45 0.05 1.28 -0.54 0.00 0.00 175.26 175.98 3fpa n LEU 117 N 4.66 0.00 -3.81 2.70 4.77 0.12 -4.13 117.00 121.32 3fpa n LEU 117 Ca 0.11 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 3fpa n LEU 117 Cb 0.44 0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.47 3fpa n LEU 117 CO 0.57 0.01 -0.04 0.00 -1.33 0.00 0.00 177.39 176.60 3fpa s ALA 118 N -2.16 -0.41 0.06 -1.18 0.00 -1.14 -4.43 121.76 112.50 3fpa s ALA 118 Ca -0.01 -0.42 -0.04 0.00 0.00 0.00 0.00 51.96 51.49 3fpa s ALA 118 Cb 0.02 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.57 3fpa s ALA 118 CO 0.11 -0.50 0.28 -1.21 0.00 0.00 0.00 175.76 174.44 3fpa s GLU 119 N -3.57 3.56 -0.32 0.00 2.02 -1.11 -0.03 118.70 119.26 3fpa s GLU 119 Ca 0.02 -0.17 -0.14 0.00 0.02 0.00 0.00 54.97 54.71 3fpa s GLU 119 Cb 0.03 -3.00 -0.02 0.00 0.10 0.00 0.00 34.13 31.23 3fpa s GLU 119 CO -0.10 0.59 0.29 -1.25 0.02 0.00 0.00 175.26 174.81 3fpa s PRO 120 N -2.19 3.65 -1.51 0.39 0.04 -1.26 -2.93 135.00 131.20 3fpa s PRO 120 Ca 0.33 -0.43 -0.05 0.00 0.04 0.00 0.00 61.00 60.89 3fpa s PRO 120 Cb -0.13 -3.77 0.01 0.00 0.04 0.00 0.00 34.50 30.65 3fpa s PRO 120 CO 0.21 -0.41 0.66 0.41 0.04 0.00 0.00 177.00 177.91 3fpa n GLY 121 N 5.00 -0.49 3.85 0.56 0.00 -1.16 -4.99 105.19 107.95 3fpa n GLY 121 Ca -0.11 0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 3fpa n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpa s VAL 122 N -3.19 4.90 0.34 1.61 1.01 0.96 -4.97 120.40 121.06 3fpa s VAL 122 Ca 0.33 0.71 0.06 0.00 0.00 0.00 0.00 61.98 63.08 3fpa s VAL 122 Cb -0.14 -3.70 -0.07 0.00 0.00 0.00 0.00 36.38 32.47 3fpa s VAL 122 CO 0.40 0.18 0.00 0.42 0.00 0.00 0.00 175.10 176.10 3fpa s THR 123 N -1.54 1.60 0.57 3.92 -4.23 -1.26 -0.70 115.64 114.00 3fpa s THR 123 Ca 0.39 -2.05 0.27 0.00 -1.18 0.00 0.00 61.69 59.13 3fpa s THR 123 Cb -0.14 -2.74 0.37 0.00 1.34 0.00 0.00 72.50 71.33 3fpa s THR 123 CO 0.19 -0.10 2.02 0.25 -0.54 0.00 0.00 174.62 176.45 3fpa h LEU 124 N 2.06 0.00 -0.25 4.79 6.46 -1.72 -1.98 115.31 124.68 3fpa h LEU 124 Ca -0.41 0.00 -0.12 0.00 -0.12 0.00 0.00 57.88 57.22 3fpa h LEU 124 Cb 1.24 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.17 3fpa h LEU 124 CO 0.72 0.00 -0.32 -0.09 -0.62 0.00 0.00 178.44 178.13 3fpa h ARG 125 N 0.00 0.66 0.16 1.25 2.43 -1.93 -1.53 114.38 115.41 3fpa h ARG 125 Ca 0.17 -0.37 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 3fpa h ARG 125 Cb 0.80 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 3fpa h ARG 125 CO -0.00 0.98 -0.08 -0.44 -1.51 0.00 0.00 179.97 178.92 3fpa h ASP 126 N 0.37 -0.18 -0.67 -3.80 3.32 -1.79 -1.91 116.42 111.76 3fpa h ASP 126 Ca 0.03 -0.05 0.14 0.00 0.02 0.00 0.00 57.03 57.17 3fpa h ASP 126 Cb 0.89 0.05 -0.10 0.00 0.22 0.00 0.00 39.33 40.39 3fpa h ASP 126 CO 0.08 -0.07 0.11 0.58 -1.72 0.00 0.00 179.24 178.21 3fpa h VAL 127 N -0.29 0.53 -0.70 -1.35 2.07 -1.43 -1.07 116.25 114.02 3fpa h VAL 127 Ca -0.02 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 3fpa h VAL 127 Cb 0.22 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 3fpa h VAL 127 CO 0.04 0.04 0.28 0.00 0.02 0.00 0.00 177.57 177.95 3fpa h ALA 128 N 1.57 1.17 -0.01 1.67 0.00 -1.13 -2.35 119.26 120.18 3fpa h ALA 128 Ca 0.36 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3fpa h ALA 128 Cb 0.59 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3fpa h ALA 128 CO -0.49 0.60 -0.03 0.28 0.00 0.00 0.00 179.25 179.60 3fpa h VAL 129 N 1.02 0.91 -0.04 0.00 2.07 -0.52 0.15 116.25 119.84 3fpa h VAL 129 Ca 0.24 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.77 3fpa h VAL 129 Cb 0.19 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3fpa h VAL 129 CO -0.02 0.00 0.03 0.44 0.02 0.00 0.00 177.57 178.04 3fpa h ASP 130 N -0.05 0.00 -0.01 0.57 3.45 -0.77 -2.65 116.42 116.96 3fpa h ASP 130 Ca 0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.48 3fpa h ASP 130 Cb 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 3fpa h ASP 130 CO -0.04 0.00 -0.27 0.52 -1.57 0.00 0.00 179.24 177.87 3fpa n VAL 131 N -4.17 0.00 -3.53 -1.35 0.31 -0.93 -5.00 118.33 103.67 3fpa n VAL 131 Ca -0.02 -0.36 -0.20 0.00 -0.01 0.00 0.00 64.34 63.75 3fpa n VAL 131 Cb 0.13 1.09 0.08 0.00 -0.91 0.00 0.00 33.84 34.22 3fpa n VAL 131 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fpa n ALA 132 N -0.51 -1.79 -2.73 3.52 0.00 0.40 -4.95 120.51 114.46 3fpa n ALA 132 Ca 0.04 0.07 -0.36 0.00 0.00 0.00 0.00 53.44 53.19 3fpa n ALA 132 Cb 0.20 -3.36 -0.06 0.00 0.00 0.00 0.00 19.45 16.23 3fpa n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fpa s ALA 133 N -3.38 3.82 0.80 0.00 0.00 -0.53 -4.92 121.76 117.56 3fpa s ALA 133 Ca 0.20 -0.52 -0.11 0.00 0.00 0.00 0.00 51.96 51.53 3fpa s ALA 133 Cb -0.09 -2.11 0.07 0.00 0.00 0.00 0.00 23.12 20.99 3fpa s ALA 133 CO 0.74 0.61 1.09 0.00 0.00 0.00 0.00 175.76 178.20 3fpa s ALA 134 N -1.21 2.22 -0.07 0.00 0.00 -1.25 -4.47 121.76 116.99 3fpa s ALA 134 Ca 0.24 -0.16 0.05 0.00 0.00 0.00 0.00 51.96 52.09 3fpa s ALA 134 Cb -0.14 -3.12 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 3fpa s ALA 134 CO 0.13 -1.74 -0.23 0.00 0.00 0.00 0.00 175.76 173.91 3fpa s ALA 135 N -3.13 2.23 -0.16 0.00 0.00 0.01 -1.47 121.76 119.24 3fpa s ALA 135 Ca 0.61 -1.02 -0.10 0.00 0.00 0.00 0.00 51.96 51.44 3fpa s ALA 135 Cb -0.15 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 3fpa s ALA 135 CO 0.54 0.39 0.18 -1.17 0.00 0.00 0.00 175.76 175.71 3fpa s LEU 136 N -0.08 4.28 -0.21 0.00 2.96 0.15 0.66 118.68 126.44 3fpa s LEU 136 Ca -0.06 0.40 -0.04 0.00 -0.22 0.00 0.00 54.13 54.21 3fpa s LEU 136 Cb -0.14 -2.17 -0.01 0.00 0.50 0.00 0.00 46.19 44.36 3fpa s LEU 136 CO 0.05 0.23 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.58 3fpa s VAL 137 N -0.07 3.51 -0.15 1.68 1.01 -0.29 0.60 120.40 126.68 3fpa s VAL 137 Ca 0.13 -0.45 -0.16 0.00 0.00 0.00 0.00 61.98 61.50 3fpa s VAL 137 Cb -0.12 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3fpa s VAL 137 CO 0.02 0.42 0.37 -0.69 0.00 0.00 0.00 175.10 175.22 3fpa s VAL 138 N 1.33 5.25 0.13 2.92 1.01 0.32 -0.76 120.40 130.60 3fpa s VAL 138 Ca 0.04 0.70 0.06 0.00 0.00 0.00 0.00 61.98 62.79 3fpa s VAL 138 Cb -0.14 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3fpa s VAL 138 CO -0.01 0.35 -0.15 0.68 0.00 0.00 0.00 175.10 175.96 3fpa s VAL 139 N 0.66 1.44 0.93 2.92 -7.23 -0.10 -1.76 120.40 117.27 3fpa s VAL 139 Ca 0.20 -1.73 -0.15 0.00 -1.81 0.00 0.00 61.98 58.49 3fpa s VAL 139 Cb -0.14 -1.58 0.18 0.00 0.56 0.00 0.00 36.38 35.41 3fpa s VAL 139 CO 0.06 -0.37 1.29 0.42 -0.31 0.00 0.00 175.10 176.20 3fpa s THR 140 N -2.03 2.01 -1.01 5.32 -4.23 -1.26 -1.81 115.64 112.63 3fpa s THR 140 Ca 0.10 -0.04 0.10 0.00 -1.18 0.00 0.00 61.69 60.67 3fpa s THR 140 Cb -0.06 -2.97 0.17 0.00 1.34 0.00 0.00 72.50 70.98 3fpa s THR 140 CO 0.04 0.00 1.02 0.00 -0.54 0.00 0.00 174.62 175.14 3fpa n ALA 141 N -3.67 2.32 -2.32 3.99 0.00 -1.26 -4.84 120.51 114.72 3fpa n ALA 141 Ca 0.15 -0.86 -0.26 0.00 0.00 0.00 0.00 53.44 52.47 3fpa n ALA 141 Cb 0.60 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.70 3fpa n ALA 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fpa s ASP 142 N -0.91 6.08 -0.16 0.00 -0.00 -1.26 -3.69 116.67 116.73 3fpa s ASP 142 Ca 0.16 0.70 -0.41 0.00 -0.00 0.00 0.00 52.55 53.00 3fpa s ASP 142 Cb 0.09 -2.00 -0.18 0.00 -0.00 0.00 0.00 42.92 40.83 3fpa s ASP 142 CO 0.13 -0.63 1.43 -0.11 -0.00 0.00 0.00 175.17 175.98 3fpa n LEU 143 N -2.20 1.28 0.00 1.23 7.94 -1.26 -1.44 117.00 122.54 3fpa n LEU 143 Ca 0.00 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.04 3fpa n LEU 143 Cb 0.56 -1.03 0.00 0.00 0.53 0.00 0.00 43.42 43.48 3fpa n LEU 143 CO 0.51 -1.08 0.00 0.61 -1.11 0.00 0.00 177.39 176.32 3fpa n GLY 144 N 3.00 0.77 0.19 -3.96 0.00 -1.26 -4.97 105.19 98.96 3fpa n GLY 144 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 3fpa n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpa h THR 145 N 0.00 1.35 -0.09 2.61 1.03 -1.57 -2.67 112.91 113.57 3fpa h THR 145 Ca 0.00 -2.00 0.02 0.00 -0.01 0.00 0.00 66.41 64.41 3fpa h THR 145 Cb 0.00 1.98 -0.02 0.00 -1.07 0.00 0.00 68.15 69.05 3fpa h THR 145 CO 0.00 0.61 -0.01 -0.07 -0.01 0.00 0.00 175.52 176.04 3fpa h LEU 146 N 0.35 -0.06 0.07 0.00 3.38 -1.92 0.31 115.31 117.43 3fpa h LEU 146 Ca -0.02 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fpa h LEU 146 Cb 1.24 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3fpa h LEU 146 CO 0.12 -0.02 -0.03 -1.13 0.09 0.00 0.00 178.44 177.47 3fpa h ASN 147 N 0.01 -0.08 -0.32 -0.43 -1.24 -1.96 -0.20 115.58 111.35 3fpa h ASN 147 Ca 0.04 -0.09 -0.04 0.00 0.71 0.00 0.00 56.30 56.91 3fpa h ASN 147 Cb 0.06 0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 3fpa h ASN 147 CO -0.08 0.05 0.07 0.45 -1.29 0.00 0.00 177.43 176.62 3fpa h HIS 148 N -0.20 0.63 -0.03 0.67 3.86 -1.36 -1.32 115.15 117.41 3fpa h HIS 148 Ca -0.01 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.14 3fpa h HIS 148 Cb 0.17 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.45 3fpa h HIS 148 CO -0.04 0.57 -0.00 1.15 0.86 0.00 0.00 177.93 180.47 3fpa h THR 149 N 0.60 1.26 -0.41 2.45 2.02 -0.30 -2.32 112.91 116.21 3fpa h THR 149 Ca 0.13 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.50 3fpa h THR 149 Cb 0.28 1.73 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 3fpa h THR 149 CO 0.00 0.21 0.10 0.11 0.37 0.00 0.00 175.52 176.31 3fpa h LYS 150 N -0.27 0.60 -0.30 6.66 1.57 -0.78 -0.96 116.57 123.10 3fpa h LYS 150 Ca 0.01 -0.10 -0.13 0.00 -1.87 0.00 0.00 60.65 58.56 3fpa h LYS 150 Cb 0.33 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3fpa h LYS 150 CO 0.00 0.55 -0.35 1.25 -0.57 0.00 0.00 179.45 180.33 3fpa h LEU 151 N 0.59 0.70 0.03 2.94 5.85 -1.25 -1.97 115.31 122.21 3fpa h LEU 151 Ca 0.14 -0.29 -0.26 0.00 0.84 0.00 0.00 57.88 58.30 3fpa h LEU 151 Cb 0.21 -0.20 0.02 0.00 0.37 0.00 0.00 40.66 41.07 3fpa h LEU 151 CO -0.00 0.99 -1.03 0.74 -0.34 0.00 0.00 178.44 178.80 3fpa h THR 152 N 0.56 1.30 -0.51 1.05 2.02 -1.01 -2.92 112.91 113.40 3fpa h THR 152 Ca 0.06 -2.28 0.00 0.00 0.77 0.00 0.00 66.41 64.96 3fpa h THR 152 Cb 0.86 2.51 -0.03 0.00 -1.74 0.00 0.00 68.15 69.76 3fpa h THR 152 CO 0.07 0.70 0.33 -0.07 0.37 0.00 0.00 175.52 176.92 3fpa h LEU 153 N 0.28 0.59 -0.55 2.58 3.38 -1.14 -1.64 115.31 118.81 3fpa h LEU 153 Ca -0.14 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 3fpa h LEU 153 Cb 1.70 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 3fpa h LEU 153 CO 0.20 0.44 -0.47 -0.33 0.09 0.00 0.00 178.44 178.37 3fpa h GLU 154 N 0.70 0.63 -0.30 1.13 5.08 -1.39 -2.40 114.58 118.03 3fpa h GLU 154 Ca 0.19 -0.36 -0.13 0.00 -1.00 0.00 0.00 59.36 58.06 3fpa h GLU 154 Cb -0.07 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3fpa h GLU 154 CO -0.04 0.96 -0.33 0.00 -1.00 0.00 0.00 179.01 178.60 3fpa h ALA 155 N 0.98 0.85 0.12 3.43 0.00 -1.25 -1.01 119.26 122.37 3fpa h ALA 155 Ca 0.03 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3fpa h ALA 155 Cb 1.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3fpa h ALA 155 CO 0.09 0.64 -0.10 -0.07 0.00 0.00 0.00 179.25 179.82 3fpa h LEU 156 N 0.56 -0.25 -1.73 0.00 3.38 -1.27 -3.09 115.31 112.92 3fpa h LEU 156 Ca 0.06 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3fpa h LEU 156 Cb 0.84 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 3fpa h LEU 156 CO 0.07 -0.15 -0.17 0.00 0.09 0.00 0.00 178.44 178.28 3fpa h ALA 157 N 0.65 1.57 0.00 1.53 0.00 -1.24 -1.59 119.26 120.18 3fpa h ALA 157 Ca -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3fpa h ALA 157 Cb 0.20 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3fpa h ALA 157 CO -0.01 0.21 -0.07 0.00 0.00 0.00 0.00 179.25 179.37 3fpa h ALA 158 N 1.83 1.26 0.00 0.00 0.00 -1.10 -2.19 119.26 119.07 3fpa h ALA 158 Ca -0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3fpa h ALA 158 Cb 0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3fpa h ALA 158 CO 0.02 0.09 -0.03 1.04 0.00 0.00 0.00 179.25 180.37 3fpa n GLN 159 N -3.56 1.26 -2.82 0.00 1.13 -0.89 -4.99 117.38 107.52 3fpa n GLN 159 Ca -0.02 -2.56 -0.18 0.00 -1.94 0.00 0.00 57.00 52.30 3fpa n GLN 159 Cb 0.19 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.07 3fpa n GLN 159 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3fpa n GLN 160 N -1.39 -2.97 -3.05 -1.09 3.00 -0.83 -4.95 117.38 106.11 3fpa n GLN 160 Ca 0.16 0.63 -0.40 0.00 -0.01 0.00 0.00 57.00 57.38 3fpa n GLN 160 Cb 0.64 -5.31 -0.05 0.00 0.00 0.00 0.00 30.24 25.52 3fpa n GLN 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3fpa s VAL 161 N -2.83 5.02 0.00 5.09 0.11 -0.65 -5.00 120.40 122.14 3fpa s VAL 161 Ca 0.17 1.37 0.00 0.00 -2.93 0.00 0.00 61.98 60.59 3fpa s VAL 161 Cb -0.09 -4.02 0.00 0.00 -1.53 0.00 0.00 36.38 30.75 3fpa s VAL 161 CO 0.21 0.17 0.00 -1.54 -3.33 0.00 0.00 175.10 170.61 3fpa n SER 162 N 4.45 0.00 0.00 3.54 3.41 -1.26 -4.11 113.62 119.65 3fpa n SER 162 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 3fpa n SER 162 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 3fpa n SER 162 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fpa n ALA 164 N -3.00 0.00 0.00 7.33 0.00 0.21 -0.81 120.51 124.24 3fpa n ALA 164 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3fpa n ALA 164 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3fpa n ALA 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 165 N 0.00 0.95 3.76 0.00 0.00 -1.25 -4.94 105.19 103.71 3fpa n GLY 165 Ca 0.00 -1.97 -0.26 0.00 0.00 0.00 0.00 46.02 43.79 3fpa n GLY 165 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fpa s LEU 166 N 0.00 3.67 -0.06 0.99 1.43 0.05 -1.14 118.68 123.62 3fpa s LEU 166 Ca 0.00 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 3fpa s LEU 166 Cb 0.00 -2.28 0.02 0.00 0.03 0.00 0.00 46.19 43.96 3fpa s LEU 166 CO 0.00 0.06 -0.05 -0.69 0.23 0.00 0.00 176.35 175.90 3fpa s VAL 167 N -1.79 0.63 -0.42 -1.59 1.01 0.06 -0.20 120.40 118.10 3fpa s VAL 167 Ca 0.30 -0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 3fpa s VAL 167 Cb -0.10 -0.66 0.02 0.00 0.00 0.00 0.00 36.38 35.65 3fpa s VAL 167 CO 0.22 0.26 1.17 -0.63 0.00 0.00 0.00 175.10 176.12 3fpa s ILE 168 N 1.10 4.23 0.29 2.22 1.01 -0.40 -0.92 121.20 128.74 3fpa s ILE 168 Ca -0.08 1.30 0.25 0.00 0.00 0.00 0.00 60.65 62.13 3fpa s ILE 168 Cb -0.14 -4.48 0.26 0.00 0.01 0.00 0.00 42.46 38.10 3fpa s ILE 168 CO -0.01 -0.83 1.95 1.23 0.00 0.00 0.00 174.94 177.29 3fpa h GLY 169 N 11.08 0.00 -6.31 6.18 0.00 -1.49 0.16 103.07 112.68 3fpa h GLY 169 Ca -0.23 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 46.95 3fpa h GLY 169 CO 1.10 0.00 -0.46 -0.45 0.00 0.00 0.00 176.54 176.73 3fpa s SER 170 N -6.20 0.14 -0.25 0.19 0.15 -1.24 -4.59 113.70 101.90 3fpa s SER 170 Ca -0.01 0.47 -0.07 0.00 0.70 0.00 0.00 55.95 57.04 3fpa s SER 170 Cb 0.12 1.13 -0.03 0.00 -1.71 0.00 0.00 66.02 65.53 3fpa s SER 170 CO 0.61 -0.28 0.06 0.86 1.20 0.00 0.00 173.24 175.70 3fpa s TRP 171 N 2.55 3.08 0.64 3.44 -0.11 0.11 -4.43 118.94 124.22 3fpa s TRP 171 Ca 0.07 -0.46 -0.17 0.00 1.22 0.00 0.00 56.10 56.76 3fpa s TRP 171 Cb -0.14 -2.23 -0.01 0.00 -1.50 0.00 0.00 33.47 29.58 3fpa s TRP 171 CO -0.14 -0.37 1.21 -2.14 -4.62 0.00 0.00 176.95 170.88 3fpa s PRO 172 N 1.61 2.72 -0.06 5.86 0.02 -1.26 -0.96 135.00 142.93 3fpa s PRO 172 Ca 0.06 1.79 -0.00 0.00 0.02 0.00 0.00 61.00 62.87 3fpa s PRO 172 Cb -0.15 -1.90 0.03 0.00 0.02 0.00 0.00 34.50 32.49 3fpa s PRO 172 CO 0.03 -1.40 -0.01 0.34 -0.33 0.00 0.00 177.00 175.63 3fpa s ASP 173 N -1.77 1.18 0.76 2.53 -1.08 -1.26 -3.11 116.67 113.92 3fpa s ASP 173 Ca 0.76 -0.09 -0.11 0.00 -0.52 0.00 0.00 52.55 52.59 3fpa s ASP 173 Cb -0.30 -0.41 0.05 0.00 -1.46 0.00 0.00 42.92 40.80 3fpa s ASP 173 CO 0.37 -0.13 1.08 -2.16 0.52 0.00 0.00 175.17 174.86 3fpa s PRO 174 N 1.45 2.40 0.01 4.34 0.04 -1.26 -5.08 135.00 136.90 3fpa s PRO 174 Ca -0.03 1.09 -0.03 0.00 0.04 0.00 0.00 61.00 62.07 3fpa s PRO 174 Cb -0.13 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 3fpa s PRO 174 CO -0.03 -1.52 1.04 -1.35 0.04 0.00 0.00 177.00 175.18 3fpa h PRO 175 N -1.04 -0.06 0.00 0.56 0.11 -1.94 -3.50 132.00 126.13 3fpa h PRO 175 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3fpa h PRO 175 Cb 1.23 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3fpa h PRO 175 CO 0.53 -0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.69 3fpa n GLY 176 N -1.04 2.16 0.23 -0.55 0.00 -1.26 -4.63 105.19 100.10 3fpa n GLY 176 Ca -0.01 -2.04 -0.14 0.00 0.00 0.00 0.00 46.02 43.83 3fpa n GLY 176 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3fpa h LEU 177 N 0.00 0.87 0.49 0.99 6.46 -2.00 -3.01 115.31 119.11 3fpa h LEU 177 Ca 0.00 -0.49 -0.02 0.00 -0.12 0.00 0.00 57.88 57.25 3fpa h LEU 177 Cb 0.00 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 39.68 3fpa h LEU 177 CO 0.00 1.27 -0.23 0.58 -0.62 0.00 0.00 178.44 179.44 3fpa h VAL 178 N 0.58 0.47 -0.45 1.05 2.07 -1.93 -2.18 116.25 115.86 3fpa h VAL 178 Ca 0.00 -0.31 0.09 0.00 0.82 0.00 0.00 66.70 67.30 3fpa h VAL 178 Cb 1.19 0.59 -0.08 0.00 -1.52 0.00 0.00 31.29 31.48 3fpa h VAL 178 CO 0.12 0.05 -0.06 0.00 0.02 0.00 0.00 177.57 177.71 3fpa h ALA 179 N -0.45 0.36 -0.46 1.67 0.00 -1.64 0.48 119.26 119.22 3fpa h ALA 179 Ca -0.07 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3fpa h ALA 179 Cb 0.58 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 3fpa h ALA 179 CO 0.11 -0.42 0.01 0.00 0.00 0.00 0.00 179.25 178.95 3fpa h ALA 180 N 1.42 1.17 -0.26 0.00 0.00 -1.57 0.29 119.26 120.32 3fpa h ALA 180 Ca 0.22 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 3fpa h ALA 180 Cb 0.33 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3fpa h ALA 180 CO -0.42 0.54 -0.40 1.03 0.00 0.00 0.00 179.25 180.00 3fpa h SER 181 N 0.70 0.80 -0.64 0.00 0.87 -0.78 -2.82 113.55 111.68 3fpa h SER 181 Ca 0.14 -0.52 -0.09 0.00 -1.23 0.00 0.00 61.79 60.09 3fpa h SER 181 Cb 0.41 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 3fpa h SER 181 CO 0.01 1.16 0.05 0.78 -0.53 0.00 0.00 176.83 178.31 3fpa h ASN 182 N 0.47 1.06 -0.83 6.23 2.35 0.32 -0.77 115.58 124.41 3fpa h ASN 182 Ca 0.02 -0.28 0.05 0.00 -0.55 0.00 0.00 56.30 55.54 3fpa h ASN 182 Cb 1.00 -0.28 -0.05 0.00 0.05 0.00 0.00 38.32 39.03 3fpa h ASN 182 CO 0.09 1.08 0.52 -0.09 -1.65 0.00 0.00 177.43 177.38 3fpa h ARG 183 N 1.01 0.95 -0.24 0.81 2.43 -0.46 0.53 114.38 119.41 3fpa h ARG 183 Ca 0.19 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 3fpa h ARG 183 Cb 0.51 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3fpa h ARG 183 CO 0.02 0.63 -0.13 0.77 -1.51 0.00 0.00 179.97 179.75 3fpa h SER 184 N 0.98 0.54 -0.66 -3.80 0.02 -1.28 -2.65 113.55 106.69 3fpa h SER 184 Ca 0.35 -0.42 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 3fpa h SER 184 Cb 0.09 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 3fpa h SER 184 CO -0.14 0.84 0.16 0.00 -1.14 0.00 0.00 176.83 176.54 3fpa h ALA 185 N 0.72 0.87 -0.43 3.77 0.00 -0.81 -2.57 119.26 120.81 3fpa h ALA 185 Ca 0.05 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.74 3fpa h ALA 185 Cb 0.64 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3fpa h ALA 185 CO 0.04 0.60 0.25 -0.07 0.00 0.00 0.00 179.25 180.07 3fpa h LEU 186 N 0.99 0.40 -2.89 0.00 4.07 0.01 -2.55 115.31 115.34 3fpa h LEU 186 Ca 0.21 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 3fpa h LEU 186 Cb 0.37 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 3fpa h LEU 186 CO 0.00 0.29 -0.00 0.00 -1.08 0.00 0.00 178.44 177.65 3fpa h ALA 187 N 1.19 1.08 0.00 1.53 0.00 -1.25 -0.88 119.26 120.94 3fpa h ALA 187 Ca 0.17 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.91 3fpa h ALA 187 Cb 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3fpa h ALA 187 CO -0.08 0.00 -0.82 0.00 0.00 0.00 0.00 179.25 178.35 3fpa h ARG 188 N 0.00 0.00 0.00 0.00 3.08 -1.05 -3.36 114.38 113.04 3fpa h ARG 188 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 3fpa h ARG 188 Cb 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3fpa h ARG 188 CO 0.00 0.77 -2.00 0.44 -1.07 0.00 0.00 179.97 178.10 3fpa n ILE 189 N -3.28 0.76 -3.71 2.04 -5.35 -0.73 -5.03 119.36 104.06 3fpa n ILE 189 Ca 0.00 -0.67 -0.10 0.00 -0.27 0.00 0.00 62.75 61.71 3fpa n ILE 189 Cb 0.86 -0.32 -0.04 0.00 -1.74 0.00 0.00 39.64 38.39 3fpa n ILE 189 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3fpa s ALA 190 N -3.02 -0.87 -0.11 -1.28 0.00 -0.41 -5.13 121.76 110.94 3fpa s ALA 190 Ca -0.08 -0.21 -0.30 0.00 0.00 0.00 0.00 51.96 51.38 3fpa s ALA 190 Cb 0.10 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 24.00 3fpa s ALA 190 CO 0.86 -0.73 1.13 1.41 0.00 0.00 0.00 175.76 178.42 3fpa s MET 191 N -3.86 4.34 -0.56 0.00 1.75 -1.26 -4.09 119.30 115.63 3fpa s MET 191 Ca 0.08 1.54 -0.22 0.00 -1.25 0.00 0.00 55.69 55.83 3fpa s MET 191 Cb 0.00 -3.59 0.05 0.00 2.84 0.00 0.00 34.83 34.13 3fpa s MET 191 CO -0.06 -0.47 0.84 0.08 -0.65 0.00 0.00 175.02 174.76 3fpa s VAL 192 N 2.47 4.54 0.09 10.11 1.01 -1.26 -0.77 120.40 136.59 3fpa s VAL 192 Ca 0.52 -0.11 0.19 0.00 0.00 0.00 0.00 61.98 62.58 3fpa s VAL 192 Cb -0.21 -4.49 0.14 0.00 0.00 0.00 0.00 36.38 31.82 3fpa s VAL 192 CO 0.17 -1.08 1.69 0.03 0.00 0.00 0.00 175.10 175.91 3fpa h ARG 193 N 9.25 0.00 -1.41 2.72 2.47 -0.95 -3.46 114.38 123.00 3fpa h ARG 193 Ca -0.27 0.00 0.20 0.00 -1.26 0.00 0.00 59.98 58.65 3fpa h ARG 193 Cb 1.08 0.00 -0.22 0.00 -1.65 0.00 0.00 29.97 29.18 3fpa h ARG 193 CO 1.07 0.38 0.77 0.00 0.56 0.00 0.00 179.97 182.75 3fpa s ALA 194 N -3.47 -2.04 -0.25 0.04 0.00 -1.25 -4.43 121.76 110.36 3fpa s ALA 194 Ca 0.01 1.66 -0.01 0.00 0.00 0.00 0.00 51.96 53.62 3fpa s ALA 194 Cb 0.10 -0.68 0.07 0.00 0.00 0.00 0.00 23.12 22.62 3fpa s ALA 194 CO 0.69 -0.42 0.03 0.00 0.00 0.00 0.00 175.76 176.06 3fpa s ALA 195 N -1.68 1.53 0.05 0.00 0.00 -1.26 -1.27 121.76 119.13 3fpa s ALA 195 Ca 0.06 -1.27 -0.30 0.00 0.00 0.00 0.00 51.96 50.45 3fpa s ALA 195 Cb -0.01 -1.43 -0.05 0.00 0.00 0.00 0.00 23.12 21.64 3fpa s ALA 195 CO -0.04 -1.36 1.03 -0.51 0.00 0.00 0.00 175.76 174.88 3fpa s LEU 196 N 1.61 4.41 0.37 0.00 1.02 0.56 -4.84 118.68 121.80 3fpa s LEU 196 Ca 0.01 1.80 -0.28 0.00 0.02 0.00 0.00 54.13 55.68 3fpa s LEU 196 Cb -0.18 -3.58 -0.10 0.00 0.02 0.00 0.00 46.19 42.35 3fpa s LEU 196 CO -0.13 -0.26 1.37 -2.84 0.02 0.00 0.00 176.35 174.52 3fpa s PRO 197 N 0.68 4.17 0.26 1.29 0.02 -1.26 0.08 135.00 140.22 3fpa s PRO 197 Ca 0.52 2.33 -0.31 0.00 0.02 0.00 0.00 61.00 63.56 3fpa s PRO 197 Cb -0.24 -2.96 -0.12 0.00 0.02 0.00 0.00 34.50 31.20 3fpa s PRO 197 CO 0.29 -0.39 1.55 0.00 -0.33 0.00 0.00 177.00 178.12 3fpa n ALA 198 N 0.51 2.04 -0.46 -1.55 0.00 -0.13 -2.16 120.51 118.76 3fpa n ALA 198 Ca 0.01 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3fpa n ALA 198 Cb 0.41 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.46 3fpa n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 199 N 2.49 0.73 0.41 0.00 0.00 -1.26 -4.95 105.19 102.60 3fpa n GLY 199 Ca 0.11 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.35 3fpa n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpa h ALA 200 N 0.00 2.58 0.00 4.61 0.00 -1.80 -2.37 119.26 122.28 3fpa h ALA 200 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3fpa h ALA 200 Cb 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3fpa h ALA 200 CO 0.00 -0.77 -0.03 0.00 0.00 0.00 0.00 179.25 178.45 3fpa h ALA 201 N 1.68 1.07 -0.01 0.00 0.00 -1.92 -2.60 119.26 117.47 3fpa h ALA 201 Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3fpa h ALA 201 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3fpa h ALA 201 CO -0.01 0.04 -0.28 0.43 0.00 0.00 0.00 179.25 179.43 3fpa n SER 202 N -3.23 1.73 -4.75 0.00 7.64 -0.89 -4.97 113.62 109.16 3fpa n SER 202 Ca -0.01 -1.36 -0.34 0.00 1.01 0.00 0.00 58.87 58.17 3fpa n SER 202 Cb 0.19 0.24 0.07 0.00 -1.01 0.00 0.00 64.21 63.70 3fpa n SER 202 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3fpa s LEU 203 N -2.36 3.36 0.73 -3.43 1.43 -0.98 -5.03 118.68 112.40 3fpa s LEU 203 Ca 0.24 2.18 -0.12 0.00 -1.03 0.00 0.00 54.13 55.41 3fpa s LEU 203 Cb 0.19 -4.57 0.03 0.00 0.03 0.00 0.00 46.19 41.87 3fpa s LEU 203 CO 0.49 -1.94 1.11 -1.81 0.23 0.00 0.00 176.35 174.43 3fpa s ASP 204 N -2.29 5.20 0.32 2.29 1.01 -1.26 -4.75 116.67 117.19 3fpa s ASP 204 Ca 0.71 1.10 0.06 0.00 0.71 0.00 0.00 52.55 55.12 3fpa s ASP 204 Cb -0.25 -1.85 0.70 0.00 1.01 0.00 0.00 42.92 42.54 3fpa s ASP 204 CO 0.43 -1.49 1.84 0.00 0.21 0.00 0.00 175.17 176.16 3fpa h ALA 205 N -0.76 1.69 -0.15 5.23 0.00 -1.81 0.42 119.26 123.88 3fpa h ALA 205 Ca -0.45 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.32 3fpa h ALA 205 Cb 1.27 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.91 3fpa h ALA 205 CO 0.64 0.05 -0.54 0.78 0.00 0.00 0.00 179.25 180.17 3fpa h GLY 206 N 0.82 0.70 1.18 0.00 0.00 -1.92 -1.00 103.07 102.84 3fpa h GLY 206 Ca 0.48 -0.93 -0.09 0.00 0.00 0.00 0.00 47.33 46.80 3fpa h GLY 206 CO -0.25 0.83 0.01 -0.55 0.00 0.00 0.00 176.54 176.58 3fpa h ASP 207 N 0.30 0.96 -0.63 0.19 3.45 -1.80 -2.93 116.42 115.95 3fpa h ASP 207 Ca -0.02 -0.26 -0.04 0.00 0.43 0.00 0.00 57.03 57.14 3fpa h ASP 207 Cb 1.17 -0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 39.65 3fpa h ASP 207 CO 0.11 1.01 0.23 0.15 -1.57 0.00 0.00 179.24 179.17 3fpa h PHE 208 N 0.91 0.99 -0.67 4.55 3.57 -0.10 -2.43 116.94 123.76 3fpa h PHE 208 Ca 0.17 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3fpa h PHE 208 Cb 0.52 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 3fpa h PHE 208 CO 0.03 0.79 0.38 0.00 -2.23 0.00 0.00 178.31 177.29 3fpa h ALA 209 N 1.09 0.86 -0.32 2.41 0.00 -1.07 0.48 119.26 122.72 3fpa h ALA 209 Ca 0.21 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3fpa h ALA 209 Cb 0.24 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3fpa h ALA 209 CO -0.01 0.36 -0.24 0.00 0.00 0.00 0.00 179.25 179.36 3fpa h ALA 210 N 1.19 0.46 -0.12 0.00 0.00 -1.44 -0.37 119.26 118.99 3fpa h ALA 210 Ca 0.24 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.79 3fpa h ALA 210 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3fpa h ALA 210 CO -0.04 0.44 -0.03 1.98 0.00 0.00 0.00 179.25 181.61 3fpa h MET 211 N 0.49 0.01 -0.42 0.00 -1.53 -1.32 -2.70 114.93 109.46 3fpa h MET 211 Ca 0.06 -0.00 -0.09 0.00 -3.44 0.00 0.00 59.70 56.23 3fpa h MET 211 Cb 0.80 -0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.83 3fpa h MET 211 CO 0.06 0.00 -0.10 0.77 0.14 0.00 0.00 176.91 177.79 3fpa h SER 212 N 0.01 0.73 -0.28 1.39 0.02 -0.69 0.53 113.55 115.25 3fpa h SER 212 Ca 0.06 -0.21 -0.03 0.00 -0.84 0.00 0.00 61.79 60.77 3fpa h SER 212 Cb 0.08 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 3fpa h SER 212 CO -0.12 0.86 0.09 0.00 -1.14 0.00 0.00 176.83 176.52 3fpa h ALA 213 N 1.21 1.51 0.00 3.77 0.00 -1.04 -2.87 119.26 121.84 3fpa h ALA 213 Ca 0.12 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3fpa h ALA 213 Cb 0.56 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3fpa h ALA 213 CO 0.03 0.37 -0.78 0.00 0.00 0.00 0.00 179.25 178.87 3fpa h ALA 214 N 1.61 0.68 -0.00 0.00 0.00 -1.02 -3.37 119.26 117.16 3fpa h ALA 214 Ca 0.12 -0.49 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 3fpa h ALA 214 Cb 0.18 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3fpa h ALA 214 CO -0.01 0.61 -0.79 0.00 0.00 0.00 0.00 179.25 179.06 3fpa h ALA 215 N 1.56 0.70 -2.37 0.00 0.00 -0.69 -3.46 119.26 115.01 3fpa h ALA 215 Ca -0.05 -0.71 -0.55 0.00 0.00 0.00 0.00 54.91 53.59 3fpa h ALA 215 Cb 1.38 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 3fpa h ALA 215 CO 0.05 0.97 -0.62 -0.06 0.00 0.00 0.00 179.25 179.59 3fpa s PHE 216 N -3.23 2.84 -0.31 0.00 0.08 -1.22 -4.42 117.98 111.72 3fpa s PHE 216 Ca -0.01 -0.17 -0.28 0.00 0.12 0.00 0.00 56.93 56.59 3fpa s PHE 216 Cb 0.11 -1.29 0.02 0.00 -0.57 0.00 0.00 43.02 41.29 3fpa s PHE 216 CO 0.79 0.57 1.05 0.34 -0.10 0.00 0.00 175.22 177.87 3fpa s ASP 217 N -3.54 6.91 0.32 1.36 2.15 -1.26 -4.94 116.67 117.67 3fpa s ASP 217 Ca 0.31 1.03 0.06 0.00 0.43 0.00 0.00 52.55 54.38 3fpa s ASP 217 Cb -0.07 -2.53 0.73 0.00 -0.30 0.00 0.00 42.92 40.74 3fpa s ASP 217 CO 0.21 -0.84 1.83 -0.09 -0.17 0.00 0.00 175.17 176.10 3fpa h ARG 218 N 8.06 0.77 -0.56 4.34 9.65 -1.98 -1.14 114.38 133.53 3fpa h ARG 218 Ca -0.21 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.64 3fpa h ARG 218 Cb 1.06 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 29.44 3fpa h ARG 218 CO 1.02 0.51 0.36 -0.91 2.80 0.00 0.00 179.97 183.74 3fpa h ASN 219 N 0.79 0.61 -0.34 -3.80 4.21 -1.98 0.34 115.58 115.41 3fpa h ASN 219 Ca 0.51 -0.01 -0.04 0.00 1.21 0.00 0.00 56.30 57.97 3fpa h ASN 219 Cb 0.74 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.79 3fpa h ASN 219 CO -0.28 0.43 0.06 -0.25 -1.29 0.00 0.00 177.43 176.10 3fpa h TRP 220 N 0.72 0.59 0.74 1.19 7.01 -1.67 0.10 115.95 124.64 3fpa h TRP 220 Ca 0.21 -0.08 -0.03 0.00 2.11 0.00 0.00 58.89 61.10 3fpa h TRP 220 Cb -0.05 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 26.86 3fpa h TRP 220 CO -0.04 0.62 -0.38 0.28 -2.79 0.00 0.00 178.44 176.13 3fpa h VAL 221 N 0.39 0.23 -0.85 2.65 2.07 -1.09 -2.26 116.25 117.38 3fpa h VAL 221 Ca 0.10 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.84 3fpa h VAL 221 Cb 0.35 0.23 -0.13 0.00 -1.52 0.00 0.00 31.29 30.21 3fpa h VAL 221 CO 0.01 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.83 3fpa h ALA 222 N -0.78 1.22 0.00 1.67 0.00 -0.38 -1.50 119.26 119.48 3fpa h ALA 222 Ca -0.10 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3fpa h ALA 222 Cb 0.80 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3fpa h ALA 222 CO 0.15 -0.43 -0.14 0.78 0.00 0.00 0.00 179.25 179.61 3fpa h GLY 223 N 0.23 0.00 1.70 0.00 0.00 -0.67 -2.51 103.07 101.82 3fpa h GLY 223 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.85 3fpa h GLY 223 CO -0.62 0.00 0.09 1.04 0.00 0.00 0.00 176.54 177.05 3fpa n LEU 224 N -4.19 0.19 0.00 3.11 4.77 -0.57 -5.09 117.00 115.23 3fpa n LEU 224 Ca -0.02 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 3fpa n LEU 224 Cb 0.22 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 3fpa n LEU 224 CO 0.34 -0.60 0.04 0.52 -1.33 0.00 0.00 177.39 176.37