#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fyh n THR 6 N 0.00 1.08 0.29 -5.08 -2.24 -1.26 -1.73 114.28 105.34 3fyh n THR 6 Ca 0.00 0.29 0.18 0.00 -2.27 0.00 0.00 64.05 62.25 3fyh n THR 6 Cb 0.00 -1.11 0.84 0.00 -2.10 0.00 0.00 70.33 67.95 3fyh n THR 6 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3fyh h ASP 7 N 0.00 0.00 -3.67 3.42 3.32 -1.99 -3.44 116.42 114.06 3fyh h ASP 7 Ca 0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 3fyh h ASP 7 Cb 0.24 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.79 3fyh h ASP 7 CO 0.00 0.04 0.46 -0.76 -1.72 0.00 0.00 179.24 177.26 3fyh s LEU 8 N -6.43 4.53 -0.10 1.55 1.43 -0.70 -4.97 118.68 113.99 3fyh s LEU 8 Ca -0.01 2.14 -0.37 0.00 -1.03 0.00 0.00 54.13 54.86 3fyh s LEU 8 Cb 0.11 -3.61 -0.14 0.00 0.03 0.00 0.00 46.19 42.57 3fyh s LEU 8 CO 0.52 -0.16 1.71 -2.65 0.23 0.00 0.00 176.35 176.00 3fyh n PRO 9 N 1.86 1.63 0.00 1.29 -0.02 -1.26 -1.29 135.00 137.21 3fyh n PRO 9 Ca 0.01 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 3fyh n PRO 9 Cb 0.46 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3fyh n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fyh n GLY 10 N 3.91 3.15 3.62 -1.23 0.00 -1.26 -3.75 105.19 109.63 3fyh n GLY 10 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3fyh n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fyh s VAL 11 N -1.77 4.69 0.24 1.61 1.01 -0.41 -5.02 120.40 120.74 3fyh s VAL 11 Ca 0.00 1.40 0.02 0.00 0.00 0.00 0.00 61.98 63.40 3fyh s VAL 11 Cb 0.00 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.16 3fyh s VAL 11 CO 0.00 -0.33 0.18 0.61 0.00 0.00 0.00 175.10 175.57 3fyh n GLY 12 N 4.06 2.87 0.18 4.51 0.00 -1.26 -4.50 105.19 111.05 3fyh n GLY 12 Ca 0.07 -2.22 -0.04 0.00 0.00 0.00 0.00 46.02 43.83 3fyh n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fyh h PRO 13 N 0.00 0.04 -0.20 1.61 0.11 -1.96 0.12 132.00 131.72 3fyh h PRO 13 Ca -0.15 -0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.83 3fyh h PRO 13 Cb 0.54 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.64 3fyh h PRO 13 CO 0.23 0.03 -0.40 0.66 -0.21 0.00 0.00 178.00 178.31 3fyh h SER 14 N 0.04 0.70 -0.63 -2.05 4.64 -2.00 -2.43 113.55 111.83 3fyh h SER 14 Ca 0.22 -0.55 -0.03 0.00 -0.47 0.00 0.00 61.79 60.96 3fyh h SER 14 Cb 0.33 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 3fyh h SER 14 CO -0.42 1.12 0.29 0.74 -0.87 0.00 0.00 176.83 177.69 3fyh h THR 15 N 0.32 1.22 -0.33 2.95 2.02 -1.90 -1.94 112.91 115.25 3fyh h THR 15 Ca 0.01 -0.65 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 3fyh h THR 15 Cb 1.00 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 3fyh h THR 15 CO 0.09 0.27 0.03 0.00 0.37 0.00 0.00 175.52 176.28 3fyh h ALA 16 N 1.38 1.45 -0.31 6.16 0.00 -0.87 -1.16 119.26 125.91 3fyh h ALA 16 Ca 0.22 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3fyh h ALA 16 Cb 0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3fyh h ALA 16 CO -0.02 0.40 -0.10 0.93 0.00 0.00 0.00 179.25 180.45 3fyh h GLU 17 N 0.48 0.62 -0.35 0.00 5.08 -0.87 -2.29 114.58 117.25 3fyh h GLU 17 Ca 0.11 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 3fyh h GLU 17 Cb 0.26 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3fyh h GLU 17 CO 0.00 0.82 0.20 0.87 -1.00 0.00 0.00 179.01 179.90 3fyh h LYS 18 N 0.39 0.49 -0.69 2.33 1.57 -1.02 -1.77 116.57 117.87 3fyh h LYS 18 Ca 0.08 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 3fyh h LYS 18 Cb 0.60 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.76 3fyh h LYS 18 CO 0.04 0.39 0.41 -0.07 -0.57 0.00 0.00 179.45 179.65 3fyh h LEU 19 N 0.45 0.64 -0.96 2.94 3.38 -1.17 -1.81 115.31 118.77 3fyh h LEU 19 Ca 0.12 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 3fyh h LEU 19 Cb 0.04 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3fyh h LEU 19 CO -0.02 0.42 -0.42 1.62 0.09 0.00 0.00 178.44 180.14 3fyh h VAL 20 N 0.77 1.02 0.00 1.22 3.04 -1.21 0.18 116.25 121.27 3fyh h VAL 20 Ca 0.29 -1.59 0.00 0.00 -1.01 0.00 0.00 66.70 64.40 3fyh h VAL 20 Cb 0.11 1.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 3fyh h VAL 20 CO -0.15 0.41 0.00 -0.33 -1.01 0.00 0.00 177.57 176.49 3fyh h GLU 21 N 0.00 0.00 -0.32 4.17 5.08 -0.50 -2.44 114.58 120.56 3fyh h GLU 21 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3fyh h GLU 21 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 3fyh h GLU 21 CO 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.06 3fyh n ALA 22 N -1.85 2.43 -0.77 3.43 0.00 -0.87 -4.97 120.51 117.91 3fyh n ALA 22 Ca 0.04 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.54 3fyh n ALA 22 Cb 0.40 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.99 3fyh n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fyh n GLY 23 N 1.48 0.61 3.34 0.00 0.00 -0.92 -5.01 105.19 104.69 3fyh n GLY 23 Ca 0.18 -0.09 -0.47 0.00 0.00 0.00 0.00 46.02 45.65 3fyh n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fyh s TYR 24 N -2.00 3.63 -0.44 1.61 1.51 0.60 -4.83 117.35 117.42 3fyh s TYR 24 Ca 0.00 -1.83 0.09 0.00 -1.01 0.00 0.00 57.07 54.32 3fyh s TYR 24 Cb 0.00 -3.86 -0.09 0.00 -0.11 0.00 0.00 41.96 37.90 3fyh s TYR 24 CO 0.00 -1.05 0.39 0.44 -1.11 0.00 0.00 175.55 174.22 3fyh n ILE 25 N 4.29 0.00 -4.48 2.71 -5.35 -1.26 -3.80 119.36 111.47 3fyh n ILE 25 Ca 0.11 -0.30 -0.24 0.00 -0.27 0.00 0.00 62.75 62.05 3fyh n ILE 25 Cb 0.46 1.01 -0.10 0.00 -1.74 0.00 0.00 39.64 39.27 3fyh n ILE 25 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 3fyh s ASP 26 N -1.77 3.35 0.14 7.28 -4.77 -1.26 -4.83 116.67 114.81 3fyh s ASP 26 Ca 0.04 -1.13 -0.12 0.00 -3.30 0.00 0.00 52.55 48.03 3fyh s ASP 26 Cb 0.07 -0.27 -0.02 0.00 -1.09 0.00 0.00 42.92 41.60 3fyh s ASP 26 CO 0.35 -0.17 1.53 -0.26 0.70 0.00 0.00 175.17 177.31 3fyh h PHE 27 N 2.20 1.00 -0.85 2.11 0.05 -1.96 -3.10 116.94 116.38 3fyh h PHE 27 Ca -0.41 -0.24 0.03 0.00 3.82 0.00 0.00 57.97 61.18 3fyh h PHE 27 Cb 1.25 -0.23 -0.05 0.00 2.00 0.00 0.00 35.95 38.91 3fyh h PHE 27 CO 0.75 1.01 0.56 1.98 -0.18 0.00 0.00 178.31 182.43 3fyh h MET 28 N 0.70 1.04 -0.25 1.51 4.05 -1.97 0.48 114.93 120.49 3fyh h MET 28 Ca 0.10 -0.06 -0.11 0.00 -0.28 0.00 0.00 59.70 59.35 3fyh h MET 28 Cb 0.73 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 3fyh h MET 28 CO 0.06 0.69 -0.30 -0.22 0.23 0.00 0.00 176.91 177.36 3fyh h LYS 29 N 1.07 0.51 -0.04 0.39 3.64 -1.96 -1.51 116.57 118.67 3fyh h LYS 29 Ca 0.33 -0.22 -0.21 0.00 -1.27 0.00 0.00 60.65 59.29 3fyh h LYS 29 Cb 0.00 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3fyh h LYS 29 CO -0.09 0.76 -0.77 0.82 -2.27 0.00 0.00 179.45 177.89 3fyh h ILE 30 N 0.44 1.34 -0.37 2.00 2.04 -1.06 -2.89 117.51 119.01 3fyh h ILE 30 Ca 0.06 -2.08 0.03 0.00 1.00 0.00 0.00 64.86 63.88 3fyh h ILE 30 Cb 0.75 2.35 -0.02 0.00 -0.74 0.00 0.00 36.82 39.15 3fyh h ILE 30 CO 0.06 0.63 0.25 0.00 0.00 0.00 0.00 178.15 179.09 3fyh h ALA 31 N 0.41 1.89 -0.62 1.87 0.00 0.04 -2.30 119.26 120.56 3fyh h ALA 31 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3fyh h ALA 31 Cb 1.44 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3fyh h ALA 31 CO 0.15 0.06 0.00 0.25 0.00 0.00 0.00 179.25 179.71 3fyh n THR 32 N -4.48 2.00 -2.80 0.00 -2.24 -0.58 -4.71 114.28 101.46 3fyh n THR 32 Ca 0.04 -1.26 -0.25 0.00 -2.27 0.00 0.00 64.05 60.31 3fyh n THR 32 Cb 0.17 0.06 0.01 0.00 -2.10 0.00 0.00 70.33 68.46 3fyh n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fyh s ALA 33 N -2.02 3.53 0.22 6.98 0.00 -0.87 -5.04 121.76 124.55 3fyh s ALA 33 Ca 0.51 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.73 3fyh s ALA 33 Cb 0.34 -2.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 3fyh s ALA 33 CO 0.23 -0.41 0.37 0.95 0.00 0.00 0.00 175.76 176.90 3fyh s THR 34 N -2.68 5.25 0.32 0.00 -4.23 -1.26 -4.98 115.64 108.05 3fyh s THR 34 Ca 0.48 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 60.32 3fyh s THR 34 Cb -0.10 -3.79 0.27 0.00 1.34 0.00 0.00 72.50 70.21 3fyh s THR 34 CO 0.42 -0.24 1.97 0.58 -0.54 0.00 0.00 174.62 176.80 3fyh h VAL 35 N 1.36 1.16 -0.16 2.29 2.07 -1.98 -2.66 116.25 118.33 3fyh h VAL 35 Ca -0.50 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 66.72 3fyh h VAL 35 Cb 1.21 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 3fyh h VAL 35 CO 0.65 0.18 -0.11 1.23 0.02 0.00 0.00 177.57 179.55 3fyh h GLY 36 N 1.01 0.02 2.00 2.17 0.00 -1.99 0.20 103.07 106.48 3fyh h GLY 36 Ca 0.30 0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 3fyh h GLY 36 CO -0.08 -0.12 -0.09 1.05 0.00 0.00 0.00 176.54 177.30 3fyh h GLU 37 N -0.11 0.00 0.14 4.80 4.11 -1.88 -1.93 114.58 119.72 3fyh h GLU 37 Ca 0.10 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.23 3fyh h GLU 37 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3fyh h GLU 37 CO -0.23 0.09 -1.51 -0.07 0.07 0.00 0.00 179.01 177.36 3fyh h LEU 38 N 0.00 0.47 -1.64 3.06 3.38 -1.24 -3.34 115.31 116.00 3fyh h LEU 38 Ca -0.00 -0.89 -0.02 0.00 0.09 0.00 0.00 57.88 57.06 3fyh h LEU 38 Cb 0.27 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3fyh h LEU 38 CO 0.01 1.67 0.06 0.71 0.09 0.00 0.00 178.44 180.98 3fyh h THR 39 N -0.16 1.10 0.00 0.22 1.35 -0.50 -0.75 112.91 114.17 3fyh h THR 39 Ca -0.31 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 3fyh h THR 39 Cb 1.88 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 3fyh h THR 39 CO 0.11 0.12 0.00 0.47 -0.25 0.00 0.00 175.52 175.97 3fyh n ASP 40 N -4.43 0.00 0.03 5.36 10.43 -0.74 -1.32 116.55 125.89 3fyh n ASP 40 Ca 0.00 -0.44 0.05 0.00 2.57 0.00 0.00 54.79 56.97 3fyh n ASP 40 Cb 0.14 0.00 -0.08 0.00 1.84 0.00 0.00 41.12 43.02 3fyh n ASP 40 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 3fyh n ILE 41 N -0.63 0.78 -1.85 0.53 5.41 -0.29 -5.08 119.36 118.23 3fyh n ILE 41 Ca 0.02 -0.62 0.00 0.00 1.00 0.00 0.00 62.75 63.14 3fyh n ILE 41 Cb 0.01 -0.43 0.00 0.00 -0.71 0.00 0.00 39.64 38.50 3fyh n ILE 41 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3fyh n GLU 42 N -2.68 -5.13 0.00 0.38 4.07 -0.43 -4.63 120.64 112.22 3fyh n GLU 42 Ca -0.08 3.69 0.00 0.00 -0.06 0.00 0.00 57.16 60.71 3fyh n GLU 42 Cb 0.72 -4.03 0.00 0.00 -0.06 0.00 0.00 31.44 28.07 3fyh n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3fyh n GLY 43 N 0.82 1.42 3.12 8.31 0.00 -1.26 -4.98 105.19 112.62 3fyh n GLY 43 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3fyh n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fyh s ILE 44 N -2.36 2.87 1.06 -0.61 1.01 -1.26 -5.00 121.20 116.91 3fyh s ILE 44 Ca 0.00 -1.74 -0.12 0.00 0.00 0.00 0.00 60.65 58.78 3fyh s ILE 44 Cb 0.00 -2.82 0.22 0.00 0.01 0.00 0.00 42.46 39.88 3fyh s ILE 44 CO 0.00 -0.34 1.07 -0.55 0.00 0.00 0.00 174.94 175.12 3fyh s SER 45 N 1.34 2.04 0.16 3.58 0.15 -1.26 -4.45 113.70 115.27 3fyh s SER 45 Ca 0.01 1.33 0.06 0.00 0.70 0.00 0.00 55.95 58.04 3fyh s SER 45 Cb -0.20 -2.04 -0.03 0.00 -1.71 0.00 0.00 66.02 62.04 3fyh s SER 45 CO -0.03 -3.51 1.37 1.05 1.20 0.00 0.00 173.24 173.32 3fyh h GLU 46 N -2.15 0.08 -0.01 5.44 4.11 -1.95 -1.84 114.58 118.26 3fyh h GLU 46 Ca -0.57 -0.10 -0.21 0.00 0.07 0.00 0.00 59.36 58.55 3fyh h GLU 46 Cb 1.33 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 3fyh h GLU 46 CO 0.55 0.92 -0.89 -0.22 0.07 0.00 0.00 179.01 179.43 3fyh h LYS 47 N 0.04 0.34 -0.12 1.06 1.63 -1.99 -1.79 116.57 115.74 3fyh h LYS 47 Ca -0.03 -0.35 -0.18 0.00 -0.85 0.00 0.00 60.65 59.25 3fyh h LYS 47 Cb 1.55 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 33.28 3fyh h LYS 47 CO 0.13 1.03 -0.66 0.00 -3.45 0.00 0.00 179.45 176.50 3fyh h ALA 48 N 0.85 0.62 -0.20 5.00 0.00 -1.93 -2.12 119.26 121.48 3fyh h ALA 48 Ca -0.06 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 3fyh h ALA 48 Cb 1.51 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 3fyh h ALA 48 CO 0.15 0.73 0.03 0.00 0.00 0.00 0.00 179.25 180.15 3fyh h ALA 49 N 0.93 0.26 -0.03 0.00 0.00 -1.25 -1.17 119.26 118.00 3fyh h ALA 49 Ca -0.02 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3fyh h ALA 49 Cb 1.23 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 3fyh h ALA 49 CO 0.12 -0.06 -0.17 0.00 0.00 0.00 0.00 179.25 179.14 3fyh h ALA 50 N 0.82 1.65 -0.04 0.00 0.00 -1.29 -1.93 119.26 118.47 3fyh h ALA 50 Ca 0.06 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3fyh h ALA 50 Cb 0.33 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.09 3fyh h ALA 50 CO 0.01 0.26 -0.50 -0.22 0.00 0.00 0.00 179.25 178.80 3fyh h LYS 51 N 0.05 0.41 -0.06 0.00 3.64 -0.98 -2.40 116.57 117.24 3fyh h LYS 51 Ca 0.01 -0.39 -0.12 0.00 -1.27 0.00 0.00 60.65 58.88 3fyh h LYS 51 Cb 0.34 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 3fyh h LYS 51 CO 0.02 1.04 -0.52 0.00 -2.27 0.00 0.00 179.45 177.73 3fyh h MET 52 N -0.08 0.16 0.00 1.90 -0.00 -1.13 -0.86 114.93 114.92 3fyh h MET 52 Ca -0.05 -0.09 -0.00 0.00 -0.00 0.00 0.00 59.70 59.56 3fyh h MET 52 Cb 1.18 0.01 0.00 0.00 -0.00 0.00 0.00 31.60 32.79 3fyh h MET 52 CO 0.10 0.64 -0.00 0.82 -0.00 0.00 0.00 176.91 178.47 3fyh h ILE 53 N 0.12 1.18 -0.59 -0.10 2.04 -1.38 0.20 117.51 118.98 3fyh h ILE 53 Ca 0.00 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 3fyh h ILE 53 Cb 0.96 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 3fyh h ILE 53 CO 0.08 0.14 0.30 -0.03 0.00 0.00 0.00 178.15 178.64 3fyh h MET 54 N -0.23 0.83 -0.46 2.37 4.05 -1.31 -0.34 114.93 119.83 3fyh h MET 54 Ca -0.00 -0.10 -0.12 0.00 -0.28 0.00 0.00 59.70 59.20 3fyh h MET 54 Cb 0.23 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 30.85 3fyh h MET 54 CO 0.00 0.63 -0.19 0.78 0.23 0.00 0.00 176.91 178.36 3fyh h GLY 55 N 0.91 1.00 0.90 1.39 0.00 -0.82 -2.41 103.07 104.04 3fyh h GLY 55 Ca 0.21 -0.86 -0.05 0.00 0.00 0.00 0.00 47.33 46.63 3fyh h GLY 55 CO -0.03 0.78 0.01 0.00 0.00 0.00 0.00 176.54 177.30 3fyh h ALA 56 N 0.96 0.44 -0.63 3.60 0.00 0.15 -1.40 119.26 122.38 3fyh h ALA 56 Ca 0.11 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.83 3fyh h ALA 56 Cb 0.75 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 3fyh h ALA 56 CO 0.06 0.19 0.37 0.00 0.00 0.00 0.00 179.25 179.86 3fyh h ARG 57 N 0.37 0.68 -0.55 0.00 3.08 -1.04 -0.81 114.38 116.12 3fyh h ARG 57 Ca 0.09 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3fyh h ARG 57 Cb 0.43 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 3fyh h ARG 57 CO 0.02 0.45 0.28 0.22 -1.07 0.00 0.00 179.97 179.86 3fyh h ASP 58 N 0.70 0.71 0.32 7.04 1.82 -1.20 0.80 116.42 126.61 3fyh h ASP 58 Ca 0.27 -0.12 -0.06 0.00 -0.39 0.00 0.00 57.03 56.73 3fyh h ASP 58 Cb 0.10 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 39.92 3fyh h ASP 58 CO -0.14 0.63 -0.26 -0.07 -1.61 0.00 0.00 179.24 177.78 3fyh h LEU 59 N 0.74 0.00 -1.14 2.28 4.07 -0.76 -1.25 115.31 119.25 3fyh h LEU 59 Ca 0.19 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.15 3fyh h LEU 59 Cb 0.10 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.84 3fyh h LEU 59 CO -0.03 0.26 0.00 0.00 -1.08 0.00 0.00 178.44 177.60 3fyh n ASP 61 N 0.38 -6.12 -2.22 0.00 2.03 0.23 -4.94 116.55 105.91 3fyh n ASP 61 Ca 0.18 -0.61 -0.31 0.00 0.52 0.00 0.00 54.79 54.58 3fyh n ASP 61 Cb 0.39 -3.36 0.08 0.00 -0.72 0.00 0.00 41.12 37.51 3fyh n ASP 61 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3fyh n LEU 62 N -2.46 6.95 0.00 -2.67 4.32 -0.90 -5.02 117.00 117.22 3fyh n LEU 62 Ca -0.16 -4.32 0.00 0.00 -0.02 0.00 0.00 56.01 51.51 3fyh n LEU 62 Cb 0.60 -0.83 0.00 0.00 -1.62 0.00 0.00 43.42 41.58 3fyh n LEU 62 CO 0.60 1.56 0.00 0.61 -1.22 0.00 0.00 177.39 178.94 3fyh n GLY 63 N -0.90 2.10 3.76 -0.72 0.00 -1.26 -5.05 105.19 103.12 3fyh n GLY 63 Ca 0.58 -1.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 3fyh n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fyh s PHE 64 N 2.87 3.28 0.12 1.61 0.40 -1.26 -5.03 117.98 119.97 3fyh s PHE 64 Ca 0.00 1.51 0.07 0.00 -0.60 0.00 0.00 56.93 57.91 3fyh s PHE 64 Cb 0.00 -3.51 -0.04 0.00 0.51 0.00 0.00 43.02 39.98 3fyh s PHE 64 CO 0.00 -1.33 -0.18 0.15 0.70 0.00 0.00 175.22 174.56 3fyh s LYS 65 N -1.45 1.09 0.28 0.44 -0.14 -1.26 -5.16 119.74 113.54 3fyh s LYS 65 Ca 0.48 -1.20 -0.13 0.00 -1.36 0.00 0.00 55.97 53.75 3fyh s LYS 65 Cb -0.36 -1.20 0.01 0.00 -1.68 0.00 0.00 37.83 34.60 3fyh s LYS 65 CO 0.46 0.26 0.55 -1.54 -0.76 0.00 0.00 175.35 174.32 3fyh s SER 66 N -2.17 0.01 1.32 2.83 1.04 -1.26 -4.89 113.70 110.59 3fyh s SER 66 Ca 0.08 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.54 3fyh s SER 66 Cb -0.08 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3fyh s SER 66 CO 0.04 -1.25 0.00 0.61 0.98 0.00 0.00 173.24 173.62 3fyh n GLY 67 N -0.43 3.14 0.27 7.32 0.00 -1.26 -2.38 105.19 111.85 3fyh n GLY 67 Ca -0.02 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.90 3fyh n GLY 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3fyh h ILE 68 N 0.00 0.87 0.00 -0.61 2.10 -2.01 -1.74 117.51 116.11 3fyh h ILE 68 Ca 0.00 -0.06 -0.01 0.00 1.08 0.00 0.00 64.86 65.88 3fyh h ILE 68 Cb 0.00 1.03 -0.00 0.00 -1.09 0.00 0.00 36.82 36.76 3fyh h ILE 68 CO 0.00 0.02 -0.03 0.44 -1.08 0.00 0.00 178.15 177.50 3fyh h ASP 69 N 0.00 0.00 -0.32 2.19 3.32 -1.88 -0.61 116.42 119.12 3fyh h ASP 69 Ca -0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 3fyh h ASP 69 Cb 0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3fyh h ASP 69 CO 0.00 0.03 -0.45 -0.07 -1.72 0.00 0.00 179.24 177.02 3fyh h LEU 70 N 0.00 0.97 -0.37 1.55 3.38 -1.44 -1.73 115.31 117.68 3fyh h LEU 70 Ca -0.00 -0.47 -0.11 0.00 0.09 0.00 0.00 57.88 57.39 3fyh h LEU 70 Cb 0.12 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3fyh h LEU 70 CO 0.00 1.27 -0.18 -0.07 0.09 0.00 0.00 178.44 179.55 3fyh h LEU 71 N 0.71 0.80 -0.78 1.67 3.38 -1.28 -2.75 115.31 117.06 3fyh h LEU 71 Ca 0.04 -0.41 0.04 0.00 0.09 0.00 0.00 57.88 57.64 3fyh h LEU 71 Cb 1.05 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 3fyh h LEU 71 CO 0.11 1.03 0.49 0.11 0.09 0.00 0.00 178.44 180.26 3fyh h LYS 72 N 0.56 0.91 -0.48 1.13 1.79 -1.06 -0.82 116.57 118.60 3fyh h LYS 72 Ca 0.08 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 3fyh h LYS 72 Cb 0.73 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.15 3fyh h LYS 72 CO 0.06 0.60 0.24 0.37 -1.08 0.00 0.00 179.45 179.64 3fyh h GLN 73 N 0.94 0.69 -0.02 3.15 5.75 -1.25 -2.62 115.11 121.74 3fyh h GLN 73 Ca 0.32 -0.09 -0.05 0.00 -0.15 0.00 0.00 58.65 58.68 3fyh h GLN 73 Cb 0.05 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 3fyh h GLN 73 CO -0.13 0.56 -0.22 -0.09 -2.65 0.00 0.00 178.83 176.31 3fyh h ARG 74 N 0.63 0.03 0.00 1.69 9.65 -1.10 -2.12 114.38 123.17 3fyh h ARG 74 Ca 0.17 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 3fyh h ARG 74 Cb 0.09 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 3fyh h ARG 74 CO -0.02 0.25 0.00 0.43 2.80 0.00 0.00 179.97 183.43 3fyh n SER 75 N -4.26 0.00 -0.01 -3.80 7.64 -0.37 -2.27 113.62 110.55 3fyh n SER 75 Ca -0.02 0.32 0.14 0.00 1.01 0.00 0.00 58.87 60.32 3fyh n SER 75 Cb 0.29 -0.41 0.65 0.00 -1.01 0.00 0.00 64.21 63.73 3fyh n SER 75 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3fyh n THR 76 N -1.41 0.00 -2.58 0.44 -2.24 -0.80 -4.53 114.28 103.16 3fyh n THR 76 Ca 0.06 -0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.41 3fyh n THR 76 Cb 0.17 -0.45 -0.03 0.00 -2.10 0.00 0.00 70.33 67.92 3fyh n THR 76 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3fyh s VAL 77 N -2.83 4.54 0.32 2.28 1.01 -0.96 -4.89 120.40 119.87 3fyh s VAL 77 Ca 0.20 1.83 0.08 0.00 0.00 0.00 0.00 61.98 64.09 3fyh s VAL 77 Cb 0.19 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 3fyh s VAL 77 CO 0.51 -0.00 0.18 -1.66 0.00 0.00 0.00 175.10 174.13 3fyh s TRP 78 N 2.12 2.81 0.03 5.22 1.48 -1.26 -4.76 118.94 124.58 3fyh s TRP 78 Ca 0.52 -0.31 0.04 0.00 -1.06 0.00 0.00 56.10 55.29 3fyh s TRP 78 Cb -0.21 -1.62 -0.02 0.00 -1.16 0.00 0.00 33.47 30.46 3fyh s TRP 78 CO 0.20 0.33 -0.13 0.15 -4.06 0.00 0.00 176.95 173.44 3fyh s LYS 79 N -3.88 0.93 -0.22 3.25 1.02 0.42 -1.65 119.74 119.61 3fyh s LYS 79 Ca 0.38 -0.67 -0.08 0.00 0.02 0.00 0.00 55.97 55.61 3fyh s LYS 79 Cb -0.04 -0.92 -0.04 0.00 -0.52 0.00 0.00 37.83 36.31 3fyh s LYS 79 CO 0.24 0.23 0.09 -1.17 -0.92 0.00 0.00 175.35 173.82 3fyh s LEU 80 N -0.93 3.79 0.62 3.17 2.96 -0.30 0.10 118.68 128.10 3fyh s LEU 80 Ca 0.02 0.00 -0.17 0.00 -0.22 0.00 0.00 54.13 53.76 3fyh s LEU 80 Cb -0.07 -1.99 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 3fyh s LEU 80 CO 0.01 0.08 1.18 -0.55 -1.32 0.00 0.00 176.35 175.75 3fyh s SER 81 N 0.93 5.05 0.00 3.68 0.15 -0.26 -0.85 113.70 122.39 3fyh s SER 81 Ca 0.05 2.29 0.21 0.00 0.70 0.00 0.00 55.95 59.20 3fyh s SER 81 Cb -0.14 -2.59 0.17 0.00 -1.71 0.00 0.00 66.02 61.76 3fyh s SER 81 CO 0.03 -1.69 1.17 0.35 1.20 0.00 0.00 173.24 174.30 3fyh n THR 82 N -1.91 0.00 -0.99 6.45 -2.24 -1.26 -4.87 114.28 109.46 3fyh n THR 82 Ca 0.13 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 3fyh n THR 82 Cb 0.50 1.44 0.00 0.00 -2.10 0.00 0.00 70.33 70.17 3fyh n THR 82 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3fyh n SER 83 N 1.19 -0.29 -4.14 3.42 7.64 -1.26 -4.80 113.62 115.38 3fyh n SER 83 Ca 0.12 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.68 3fyh n SER 83 Cb 0.53 -0.12 -0.16 0.00 -1.01 0.00 0.00 64.21 63.45 3fyh n SER 83 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3fyh s SER 84 N -2.88 3.13 0.16 6.43 0.15 -1.26 -4.01 113.70 115.42 3fyh s SER 84 Ca 0.00 -0.63 -0.15 0.00 0.70 0.00 0.00 55.95 55.86 3fyh s SER 84 Cb 0.00 -1.47 0.06 0.00 -1.71 0.00 0.00 66.02 62.90 3fyh s SER 84 CO 0.00 0.03 1.79 0.28 1.20 0.00 0.00 173.24 176.53 3fyh h SER 85 N 7.73 0.33 -0.04 5.45 0.02 -1.92 -0.32 113.55 124.80 3fyh h SER 85 Ca -0.41 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3fyh h SER 85 Cb 1.16 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 3fyh h SER 85 CO 0.61 0.24 0.02 -0.33 -1.14 0.00 0.00 176.83 176.24 3fyh h GLU 86 N 0.44 0.06 -0.46 3.45 4.39 -1.85 -1.39 114.58 119.23 3fyh h GLU 86 Ca 0.17 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.84 3fyh h GLU 86 Cb 0.05 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 3fyh h GLU 86 CO -0.10 0.12 0.20 1.25 -1.16 0.00 0.00 179.01 179.31 3fyh h LEU 87 N -0.01 0.61 -1.10 1.33 5.85 -1.82 -1.76 115.31 118.42 3fyh h LEU 87 Ca 0.02 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.61 3fyh h LEU 87 Cb 0.07 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 3fyh h LEU 87 CO -0.00 0.59 0.61 0.44 -0.34 0.00 0.00 178.44 179.74 3fyh h ASP 88 N 0.59 1.03 -0.06 1.25 3.45 -0.95 -1.35 116.42 120.39 3fyh h ASP 88 Ca 0.15 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.59 3fyh h ASP 88 Cb 0.16 -0.25 -0.00 0.00 -0.56 0.00 0.00 39.33 38.68 3fyh h ASP 88 CO -0.02 0.73 0.00 -1.28 -1.57 0.00 0.00 179.24 177.10 3fyh h SER 89 N 1.21 0.10 -0.23 6.45 0.87 -0.96 0.48 113.55 121.47 3fyh h SER 89 Ca 0.35 -0.30 0.04 0.00 -1.23 0.00 0.00 61.79 60.66 3fyh h SER 89 Cb -0.06 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 3fyh h SER 89 CO -0.09 0.37 0.16 0.58 -0.53 0.00 0.00 176.83 177.32 3fyh h VAL 90 N -0.17 0.96 -0.00 2.23 2.07 -1.08 -0.05 116.25 120.21 3fyh h VAL 90 Ca 0.02 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3fyh h VAL 90 Cb 0.32 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3fyh h VAL 90 CO 0.00 0.03 -0.01 0.18 0.02 0.00 0.00 177.57 177.79 3fyh n LEU 91 N -4.49 0.03 -0.35 2.57 4.77 -0.53 -4.90 117.00 114.10 3fyh n LEU 91 Ca 0.02 0.19 -0.04 0.00 -0.03 0.00 0.00 56.01 56.14 3fyh n LEU 91 Cb 0.20 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 3fyh n LEU 91 CO 0.35 0.01 -0.04 0.61 -1.33 0.00 0.00 177.39 176.98 3fyh n GLY 92 N 1.21 0.65 0.00 -0.72 0.00 -0.03 -4.08 105.19 102.21 3fyh n GLY 92 Ca 0.17 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3fyh n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fyh n GLY 93 N -2.30 3.55 0.00 -0.02 0.00 0.17 -5.01 105.19 101.58 3fyh n GLY 93 Ca -0.04 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.43 3fyh n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fyh n GLY 94 N 0.00 -2.42 3.68 -0.02 0.00 -1.20 -4.72 105.19 100.52 3fyh n GLY 94 Ca 0.00 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 3fyh n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fyh s LEU 95 N 0.00 4.35 0.15 0.99 1.43 -0.03 -4.67 118.68 120.90 3fyh s LEU 95 Ca 0.00 2.39 -0.29 0.00 -1.03 0.00 0.00 54.13 55.20 3fyh s LEU 95 Cb 0.00 -3.56 -0.07 0.00 0.03 0.00 0.00 46.19 42.59 3fyh s LEU 95 CO 0.00 -0.86 0.91 -1.61 0.23 0.00 0.00 176.35 175.01 3fyh s GLU 96 N 2.81 4.70 0.75 1.70 2.02 -1.26 -1.15 118.70 128.27 3fyh s GLU 96 Ca 0.72 1.38 -0.11 0.00 0.02 0.00 0.00 54.97 56.98 3fyh s GLU 96 Cb -0.37 -3.33 0.04 0.00 0.10 0.00 0.00 34.13 30.56 3fyh s GLU 96 CO 0.31 0.36 1.08 -1.54 0.02 0.00 0.00 175.26 175.49 3fyh s SER 97 N -0.50 4.97 -1.39 -0.19 1.04 -0.66 -3.74 113.70 113.23 3fyh s SER 97 Ca 0.43 1.42 0.00 0.00 0.48 0.00 0.00 55.95 58.27 3fyh s SER 97 Cb -0.24 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.66 3fyh s SER 97 CO 0.29 -1.68 0.00 0.00 0.98 0.00 0.00 173.24 172.83 3fyh n GLN 98 N -3.26 -0.95 -3.72 4.02 6.02 -0.07 -4.74 117.38 114.70 3fyh n GLN 98 Ca 0.07 0.94 -0.10 0.00 -0.01 0.00 0.00 57.00 57.90 3fyh n GLN 98 Cb 0.55 -5.02 -0.06 0.00 1.02 0.00 0.00 30.24 26.73 3fyh n GLN 98 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3fyh s SER 99 N -2.81 -0.11 -0.20 1.08 0.01 -1.25 -4.53 113.70 105.89 3fyh s SER 99 Ca 0.00 -0.39 -0.06 0.00 1.31 0.00 0.00 55.95 56.81 3fyh s SER 99 Cb 0.00 0.41 -0.03 0.00 0.21 0.00 0.00 66.02 66.61 3fyh s SER 99 CO 0.00 -0.77 0.03 -0.69 0.41 0.00 0.00 173.24 172.22 3fyh s VAL 100 N -3.59 4.31 -0.14 3.43 1.01 -1.26 -2.79 120.40 121.37 3fyh s VAL 100 Ca 0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 61.81 3fyh s VAL 100 Cb 0.02 -2.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.44 3fyh s VAL 100 CO -0.10 0.43 -0.14 -0.89 0.00 0.00 0.00 175.10 174.40 3fyh s THR 101 N 0.82 2.94 -0.09 3.92 2.01 -0.05 -0.69 115.64 124.50 3fyh s THR 101 Ca 0.02 -0.69 0.01 0.00 0.31 0.00 0.00 61.69 61.33 3fyh s THR 101 Cb -0.14 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 3fyh s THR 101 CO 0.02 0.52 -0.10 -0.70 -0.69 0.00 0.00 174.62 173.67 3fyh s GLU 102 N 0.50 2.94 -0.27 4.92 2.12 0.04 -1.02 118.70 127.93 3fyh s GLU 102 Ca -0.09 -0.62 -0.00 0.00 0.36 0.00 0.00 54.97 54.62 3fyh s GLU 102 Cb -0.16 -2.58 0.05 0.00 0.26 0.00 0.00 34.13 31.70 3fyh s GLU 102 CO 0.04 0.50 -0.05 -0.06 -0.54 0.00 0.00 175.26 175.15 3fyh s PHE 103 N -0.38 3.22 0.17 5.30 0.40 -0.44 -0.86 117.98 125.39 3fyh s PHE 103 Ca 0.05 -1.97 0.07 0.00 -0.60 0.00 0.00 56.93 54.47 3fyh s PHE 103 Cb -0.12 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.34 3fyh s PHE 103 CO 0.02 -0.82 0.04 0.00 0.70 0.00 0.00 175.22 175.17 3fyh s ALA 104 N 1.21 3.32 0.00 5.36 0.00 -0.14 -1.49 121.76 130.03 3fyh s ALA 104 Ca -0.05 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 50.58 3fyh s ALA 104 Cb -0.19 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 21.82 3fyh s ALA 104 CO -0.03 0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.62 3fyh n GLY 105 N -0.20 1.39 3.71 0.00 0.00 -1.01 -0.26 105.19 108.81 3fyh n GLY 105 Ca -0.09 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 3fyh n GLY 105 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fyh s VAL 106 N -2.00 2.25 0.42 1.61 -7.23 -1.26 -2.85 120.40 111.34 3fyh s VAL 106 Ca 0.00 0.08 -0.26 0.00 -1.81 0.00 0.00 61.98 59.99 3fyh s VAL 106 Cb 0.00 -2.62 -0.10 0.00 0.56 0.00 0.00 36.38 34.22 3fyh s VAL 106 CO 0.00 -0.11 1.45 0.33 -0.31 0.00 0.00 175.10 176.46 3fyh n PHE 107 N -4.02 2.80 -0.97 2.82 7.35 -1.26 -2.44 117.46 121.75 3fyh n PHE 107 Ca 0.06 0.45 0.00 0.00 -0.76 0.00 0.00 57.45 57.19 3fyh n PHE 107 Cb 0.57 -2.49 0.00 0.00 0.35 0.00 0.00 39.48 37.91 3fyh n PHE 107 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3fyh n GLY 108 N 0.53 0.59 0.16 7.13 0.00 -1.26 -4.91 105.19 107.45 3fyh n GLY 108 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 3fyh n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3fyh h SER 109 N 0.00 0.00 0.00 1.61 4.64 -1.82 -3.47 113.55 114.51 3fyh h SER 109 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fyh h SER 109 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3fyh h SER 109 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3fyh n GLY 110 N 0.91 1.48 0.11 -0.77 0.00 -1.26 -4.79 105.19 100.88 3fyh n GLY 110 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 3fyh n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fyh h LYS 111 N 0.10 -0.17 -0.17 1.61 1.57 -1.90 -1.20 116.57 116.41 3fyh h LYS 111 Ca 0.00 0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 3fyh h LYS 111 Cb 0.00 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3fyh h LYS 111 CO 0.00 -0.11 -0.24 1.15 -0.57 0.00 0.00 179.45 179.68 3fyh h THR 112 N -0.18 1.24 -0.49 -0.16 2.02 -1.98 -2.28 112.91 111.09 3fyh h THR 112 Ca -0.01 -1.14 -0.02 0.00 0.77 0.00 0.00 66.41 66.01 3fyh h THR 112 Cb 0.14 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 3fyh h THR 112 CO 0.02 0.35 0.24 1.56 0.37 0.00 0.00 175.52 178.06 3fyh h GLN 113 N 0.28 0.70 -0.57 6.66 1.08 -1.88 -1.35 115.11 120.03 3fyh h GLN 113 Ca 0.05 -0.10 -0.04 0.00 -1.45 0.00 0.00 58.65 57.10 3fyh h GLN 113 Cb 0.58 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.86 3fyh h GLN 113 CO 0.04 0.58 0.17 0.82 -0.95 0.00 0.00 178.83 179.49 3fyh h ILE 114 N 0.64 1.22 -0.24 2.54 2.04 -0.88 0.19 117.51 123.02 3fyh h ILE 114 Ca 0.17 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 3fyh h ILE 114 Cb 0.10 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 3fyh h ILE 114 CO -0.02 0.29 0.05 0.24 0.00 0.00 0.00 178.15 178.71 3fyh h MET 115 N 0.84 0.39 -0.33 2.37 2.86 -0.90 -1.04 114.93 119.13 3fyh h MET 115 Ca 0.19 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3fyh h MET 115 Cb 0.25 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 3fyh h MET 115 CO -0.01 0.51 0.12 0.45 1.06 0.00 0.00 176.91 179.04 3fyh h HIS 116 N 0.22 0.51 -0.76 -0.22 3.86 -0.90 -2.60 115.15 115.25 3fyh h HIS 116 Ca 0.08 -0.04 0.07 0.00 -1.16 0.00 0.00 60.37 59.31 3fyh h HIS 116 Cb 0.29 -0.15 -0.05 0.00 1.06 0.00 0.00 27.41 28.56 3fyh h HIS 116 CO 0.01 0.50 0.50 0.37 0.86 0.00 0.00 177.93 180.17 3fyh h GLN 117 N 0.38 0.77 -0.55 2.45 5.75 -0.43 -2.22 115.11 121.25 3fyh h GLN 117 Ca 0.11 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.47 3fyh h GLN 117 Cb 0.22 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 3fyh h GLN 117 CO -0.01 0.51 -0.02 0.77 -2.65 0.00 0.00 178.83 177.43 3fyh h SER 118 N 0.79 0.97 -0.78 -0.69 0.02 -0.89 -0.31 113.55 112.66 3fyh h SER 118 Ca 0.33 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3fyh h SER 118 Cb 0.27 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 3fyh h SER 118 CO -0.11 1.05 0.50 0.00 -1.14 0.00 0.00 176.83 177.12 3fyh h VAL 120 N 1.07 1.38 -0.28 0.00 2.07 -1.20 -3.30 116.25 115.99 3fyh h VAL 120 Ca 0.29 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 3fyh h VAL 120 Cb -0.09 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 3fyh h VAL 120 CO -0.06 0.33 0.14 0.78 0.02 0.00 0.00 177.57 178.78 3fyh h ASN 121 N -0.35 0.34 -0.22 0.57 2.35 -0.81 -0.33 115.58 117.12 3fyh h ASN 121 Ca 0.01 -0.02 0.06 0.00 -0.55 0.00 0.00 56.30 55.80 3fyh h ASN 121 Cb 0.55 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 3fyh h ASN 121 CO 0.01 0.28 0.20 0.25 -1.65 0.00 0.00 177.43 176.52 3fyh h LEU 122 N 0.39 0.00 -1.06 1.61 6.46 -1.36 -0.33 115.31 121.01 3fyh h LEU 122 Ca 0.10 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 3fyh h LEU 122 Cb 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 3fyh h LEU 122 CO -0.02 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 177.80 3fyh n GLN 123 N -4.06 1.69 -3.68 1.25 1.13 -0.14 -4.57 117.38 109.00 3fyh n GLN 123 Ca 0.02 -1.05 -0.38 0.00 -1.94 0.00 0.00 57.00 53.65 3fyh n GLN 123 Cb 0.34 -1.36 -0.10 0.00 0.11 0.00 0.00 30.24 29.22 3fyh n GLN 123 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 3fyh s ASN 124 N -1.45 5.44 0.42 1.08 3.84 -0.13 -4.98 114.94 119.15 3fyh s ASN 124 Ca 0.30 -1.92 0.25 0.00 0.21 0.00 0.00 52.86 51.71 3fyh s ASN 124 Cb 0.16 -1.91 1.30 0.00 -0.55 0.00 0.00 41.25 40.25 3fyh s ASN 124 CO 0.24 -0.59 1.69 -0.65 -2.79 0.00 0.00 177.10 174.99 3fyh h PRO 125 N 8.23 0.20 0.00 0.43 0.11 -1.82 0.39 132.00 139.54 3fyh h PRO 125 Ca -0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 3fyh h PRO 125 Cb 1.06 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3fyh h PRO 125 CO 0.76 0.13 0.00 0.39 -0.21 0.00 0.00 178.00 179.07 3fyh n GLU 126 N -4.66 0.65 -0.16 1.05 1.02 -1.26 -2.76 120.64 114.52 3fyh n GLU 126 Ca 0.32 0.02 0.12 0.00 -0.02 0.00 0.00 57.16 57.60 3fyh n GLU 126 Cb 1.20 -1.50 0.23 0.00 -0.02 0.00 0.00 31.44 31.35 3fyh n GLU 126 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3fyh n PHE 127 N -1.10 0.42 -3.77 -0.32 0.99 0.14 -4.77 117.46 109.04 3fyh n PHE 127 Ca 0.17 -0.21 -0.37 0.00 -0.00 0.00 0.00 57.45 57.04 3fyh n PHE 127 Cb 0.13 0.00 -0.13 0.00 -1.00 0.00 0.00 39.48 38.48 3fyh n PHE 127 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3fyh s LEU 128 N -1.54 3.76 -0.25 4.37 1.02 -1.11 -1.11 118.68 123.82 3fyh s LEU 128 Ca 0.37 -0.67 -0.11 0.00 0.02 0.00 0.00 54.13 53.74 3fyh s LEU 128 Cb 0.22 -1.87 -0.05 0.00 0.02 0.00 0.00 46.19 44.51 3fyh s LEU 128 CO 0.31 -0.17 0.18 -0.36 0.02 0.00 0.00 176.35 176.32 3fyh s PHE 129 N 1.50 3.28 0.17 0.29 0.08 0.11 -4.91 117.98 118.50 3fyh s PHE 129 Ca 0.03 0.20 -0.15 0.00 0.12 0.00 0.00 56.93 57.13 3fyh s PHE 129 Cb -0.17 -2.32 0.02 0.00 -0.57 0.00 0.00 43.02 39.98 3fyh s PHE 129 CO 0.02 -0.02 0.42 1.52 -0.10 0.00 0.00 175.22 177.06 3fyh s TYR 130 N 1.34 0.02 -0.33 0.36 -0.85 -1.26 -0.44 117.35 116.19 3fyh s TYR 130 Ca 0.08 -0.37 -0.21 0.00 -0.52 0.00 0.00 57.07 56.06 3fyh s TYR 130 Cb -0.14 0.23 -0.00 0.00 0.38 0.00 0.00 41.96 42.42 3fyh s TYR 130 CO 0.07 -0.81 0.64 0.34 -1.52 0.00 0.00 175.55 174.27 3fyh s ASP 131 N -2.89 6.47 0.63 -0.18 3.68 -1.26 -4.96 116.67 118.16 3fyh s ASP 131 Ca 0.10 0.30 0.36 0.00 2.13 0.00 0.00 52.55 55.44 3fyh s ASP 131 Cb 0.01 -2.33 2.06 0.00 -1.45 0.00 0.00 42.92 41.21 3fyh s ASP 131 CO -0.04 -0.55 2.28 -0.33 0.13 0.00 0.00 175.17 176.67 3fyh h GLU 132 N 8.33 0.00 0.00 4.34 3.07 -1.95 -0.11 114.58 128.26 3fyh h GLU 132 Ca -0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 3fyh h GLU 132 Cb 1.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 3fyh h GLU 132 CO 0.82 0.00 -0.14 -1.91 -1.40 0.00 0.00 179.01 176.38 3fyh n GLU 133 N -3.50 0.28 -0.02 2.33 4.07 -1.26 -3.97 120.64 118.56 3fyh n GLU 133 Ca -0.03 0.19 0.00 0.00 -0.06 0.00 0.00 57.16 57.27 3fyh n GLU 133 Cb 0.11 -1.79 -0.07 0.00 -0.06 0.00 0.00 31.44 29.63 3fyh n GLU 133 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3fyh n ALA 134 N -1.80 2.07 -3.88 4.31 0.00 -0.45 -4.93 120.51 115.82 3fyh n ALA 134 Ca 0.05 -0.39 -0.28 0.00 0.00 0.00 0.00 53.44 52.82 3fyh n ALA 134 Cb 0.44 -0.13 -0.16 0.00 0.00 0.00 0.00 19.45 19.59 3fyh n ALA 134 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3fyh s VAL 135 N -2.43 1.09 0.51 0.00 1.01 -0.18 -4.70 120.40 115.69 3fyh s VAL 135 Ca -0.04 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.14 3fyh s VAL 135 Cb 0.04 -1.27 -0.08 0.00 0.00 0.00 0.00 36.38 35.07 3fyh s VAL 135 CO 0.37 0.12 1.00 -0.94 0.00 0.00 0.00 175.10 175.65 3fyh s SER 136 N 1.64 6.48 0.41 3.32 1.04 -1.26 -4.19 113.70 121.14 3fyh s SER 136 Ca 0.01 1.69 0.14 0.00 0.48 0.00 0.00 55.95 58.26 3fyh s SER 136 Cb -0.15 -2.53 0.99 0.00 0.10 0.00 0.00 66.02 64.43 3fyh s SER 136 CO -0.08 -0.69 1.93 0.11 0.98 0.00 0.00 173.24 175.50 3fyh h LYS 137 N 1.10 0.46 0.00 4.02 1.57 -1.98 0.01 116.57 121.75 3fyh h LYS 137 Ca -0.48 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.22 3fyh h LYS 137 Cb 1.20 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 3fyh h LYS 137 CO 0.60 0.31 -0.26 0.78 -0.57 0.00 0.00 179.45 180.30 3fyh h GLY 138 N 0.48 0.00 1.79 3.86 0.00 -1.97 -2.84 103.07 104.39 3fyh h GLY 138 Ca 0.35 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.60 3fyh h GLY 138 CO -0.12 0.00 -0.30 -2.09 0.00 0.00 0.00 176.54 174.03 3fyh h GLU 139 N 0.00 0.24 -0.48 4.80 4.81 -1.35 -2.88 114.58 119.72 3fyh h GLU 139 Ca -0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3fyh h GLU 139 Cb 0.55 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3fyh h GLU 139 CO 0.03 0.53 0.00 1.33 -0.73 0.00 0.00 179.01 180.17 3fyh n VAL 140 N -4.12 1.93 -2.73 0.32 0.24 -1.15 -4.99 118.33 107.83 3fyh n VAL 140 Ca -0.01 -1.38 -0.40 0.00 -2.04 0.00 0.00 64.34 60.51 3fyh n VAL 140 Cb 0.40 0.04 -0.06 0.00 -1.47 0.00 0.00 33.84 32.75 3fyh n VAL 140 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fyh s ALA 141 N -2.08 3.34 -1.34 2.33 0.00 -1.08 -3.83 121.76 119.09 3fyh s ALA 141 Ca 0.44 0.64 -0.02 0.00 0.00 0.00 0.00 51.96 53.02 3fyh s ALA 141 Cb 0.31 -3.22 0.01 0.00 0.00 0.00 0.00 23.12 20.22 3fyh s ALA 141 CO 0.18 0.18 0.75 0.94 0.00 0.00 0.00 175.76 177.81 3fyh n GLN 142 N 1.44 -5.06 -2.17 0.00 7.27 -1.26 -4.88 117.38 112.72 3fyh n GLN 142 Ca -0.02 0.62 -0.36 0.00 0.07 0.00 0.00 57.00 57.31 3fyh n GLN 142 Cb 0.47 -5.24 0.01 0.00 2.41 0.00 0.00 30.24 27.89 3fyh n GLN 142 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 3fyh s PRO 143 N -6.06 3.36 0.13 3.69 0.04 -1.25 -4.40 135.00 130.51 3fyh s PRO 143 Ca 0.10 1.74 0.05 0.00 0.04 0.00 0.00 61.00 62.93 3fyh s PRO 143 Cb -0.05 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 3fyh s PRO 143 CO 0.81 -0.88 -0.12 0.15 0.04 0.00 0.00 177.00 177.00 3fyh s LYS 144 N -3.12 1.03 0.17 4.56 1.02 -0.64 -4.93 119.74 117.83 3fyh s LYS 144 Ca 0.71 -1.30 0.10 0.00 0.02 0.00 0.00 55.97 55.50 3fyh s LYS 144 Cb -0.28 -0.80 -0.04 0.00 -0.52 0.00 0.00 37.83 36.20 3fyh s LYS 144 CO 0.32 0.14 -0.19 0.00 -0.92 0.00 0.00 175.35 174.69 3fyh s ALA 145 N -2.53 2.65 -0.08 5.17 0.00 -0.01 -1.28 121.76 125.68 3fyh s ALA 145 Ca 0.11 -1.52 0.04 0.00 0.00 0.00 0.00 51.96 50.59 3fyh s ALA 145 Cb -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.59 3fyh s ALA 145 CO 0.02 0.49 -0.20 0.08 0.00 0.00 0.00 175.76 176.14 3fyh s VAL 146 N -1.50 1.76 -0.27 0.00 1.01 -0.08 0.06 120.40 121.36 3fyh s VAL 146 Ca 0.20 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.35 3fyh s VAL 146 Cb -0.09 -1.53 0.07 0.00 0.00 0.00 0.00 36.38 34.83 3fyh s VAL 146 CO 0.11 0.49 -0.05 -0.47 0.00 0.00 0.00 175.10 175.18 3fyh s TYR 147 N 0.33 3.05 -0.45 5.22 6.04 0.14 -0.51 117.35 131.16 3fyh s TYR 147 Ca -0.15 -2.28 -0.20 0.00 0.04 0.00 0.00 57.07 54.49 3fyh s TYR 147 Cb -0.16 -2.03 0.03 0.00 -1.04 0.00 0.00 41.96 38.75 3fyh s TYR 147 CO 0.06 -0.86 0.60 0.42 -1.54 0.00 0.00 175.55 174.23 3fyh s ILE 148 N 1.17 4.89 -0.39 3.14 1.01 -0.06 -0.57 121.20 130.38 3fyh s ILE 148 Ca -0.03 -0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.37 3fyh s ILE 148 Cb -0.19 -4.19 0.02 0.00 0.01 0.00 0.00 42.46 38.10 3fyh s ILE 148 CO -0.07 -0.61 0.27 -0.62 0.00 0.00 0.00 174.94 173.91 3fyh s ASP 149 N 2.11 6.01 0.03 3.58 2.15 0.30 -1.50 116.67 129.35 3fyh s ASP 149 Ca 0.19 -0.87 0.23 0.00 0.43 0.00 0.00 52.55 52.53 3fyh s ASP 149 Cb -0.16 -2.13 -0.00 0.00 -0.30 0.00 0.00 42.92 40.33 3fyh s ASP 149 CO 0.16 -0.41 0.99 0.41 -0.17 0.00 0.00 175.17 176.15 3fyh n THR 150 N 5.12 0.10 0.23 1.71 -1.04 0.17 -0.93 114.28 119.64 3fyh n THR 150 Ca -0.11 -0.19 0.06 0.00 -2.04 0.00 0.00 64.05 61.77 3fyh n THR 150 Cb 0.47 0.37 -0.09 0.00 -1.82 0.00 0.00 70.33 69.27 3fyh n THR 150 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3fyh n GLU 151 N -1.84 1.42 -1.12 -2.82 -0.58 -1.24 -4.80 120.64 109.65 3fyh n GLU 151 Ca 0.02 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 3fyh n GLU 151 Cb 0.41 -1.21 0.00 0.00 -0.57 0.00 0.00 31.44 30.07 3fyh n GLU 151 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3fyh n GLY 152 N 1.58 0.46 1.16 0.62 0.00 -1.26 -4.97 105.19 102.78 3fyh n GLY 152 Ca -0.00 -0.95 0.08 0.00 0.00 0.00 0.00 46.02 45.15 3fyh n GLY 152 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fyh n THR 153 N -3.10 1.64 -2.20 2.61 -2.24 -1.26 -4.96 114.28 104.77 3fyh n THR 153 Ca 0.00 -1.27 -0.41 0.00 -2.27 0.00 0.00 64.05 60.10 3fyh n THR 153 Cb 0.11 0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 3fyh n THR 153 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3fyh s PHE 154 N -1.75 3.23 -0.22 4.78 5.36 -1.26 -4.99 117.98 123.13 3fyh s PHE 154 Ca 0.41 1.22 -0.02 0.00 -0.96 0.00 0.00 56.93 57.59 3fyh s PHE 154 Cb 0.27 -3.62 0.07 0.00 -0.34 0.00 0.00 43.02 39.39 3fyh s PHE 154 CO 0.19 -1.93 0.02 1.03 -1.46 0.00 0.00 175.22 173.08 3fyh s ARG 155 N -0.25 0.91 0.52 10.12 1.81 -1.26 -4.99 118.95 125.80 3fyh s ARG 155 Ca 0.56 -0.67 0.19 0.00 -1.72 0.00 0.00 55.73 54.09 3fyh s ARG 155 Cb -0.37 -2.22 1.33 0.00 -0.45 0.00 0.00 34.95 33.23 3fyh s ARG 155 CO 0.39 -0.68 2.13 -1.00 -0.68 0.00 0.00 175.30 175.46 3fyh h PRO 156 N 8.14 0.00 -0.90 3.54 0.13 -2.00 -1.55 132.00 139.36 3fyh h PRO 156 Ca -0.16 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 3fyh h PRO 156 Cb 1.09 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.18 3fyh h PRO 156 CO 0.38 0.05 0.52 0.93 -0.23 0.00 0.00 178.00 179.64 3fyh h GLU 157 N 0.00 1.25 -0.23 0.86 3.07 -1.99 -0.62 114.58 116.91 3fyh h GLU 157 Ca -0.00 -0.13 -0.17 0.00 -0.50 0.00 0.00 59.36 58.56 3fyh h GLU 157 Cb 0.09 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 27.75 3fyh h GLU 157 CO 0.01 0.89 -0.53 -0.09 -1.40 0.00 0.00 179.01 177.89 3fyh h ARG 158 N 1.26 0.67 0.04 2.33 9.65 -1.72 -1.51 114.38 125.10 3fyh h ARG 158 Ca 0.32 -0.42 0.01 0.00 -1.10 0.00 0.00 59.98 58.79 3fyh h ARG 158 Cb -0.01 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 3fyh h ARG 158 CO -0.06 1.03 -0.06 0.82 2.80 0.00 0.00 179.97 184.51 3fyh h ILE 159 N 0.52 0.85 -0.55 1.20 1.08 -1.00 -1.07 117.51 118.54 3fyh h ILE 159 Ca 0.02 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.53 3fyh h ILE 159 Cb 1.09 0.85 -0.05 0.00 -3.07 0.00 0.00 36.82 35.64 3fyh h ILE 159 CO 0.11 0.00 0.29 0.24 -0.69 0.00 0.00 178.15 178.10 3fyh h MET 160 N -0.13 0.54 -0.17 2.37 2.86 -0.98 0.16 114.93 119.59 3fyh h MET 160 Ca 0.01 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 3fyh h MET 160 Cb 0.14 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 3fyh h MET 160 CO -0.04 0.36 0.04 0.37 1.06 0.00 0.00 176.91 178.70 3fyh h GLN 161 N 0.56 0.27 -0.76 1.72 4.15 -1.11 0.34 115.11 120.28 3fyh h GLN 161 Ca 0.24 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.57 3fyh h GLN 161 Cb 0.14 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.76 3fyh h GLN 161 CO -0.16 0.41 0.35 0.52 -1.93 0.00 0.00 178.83 178.02 3fyh h MET 162 N 0.08 1.10 -0.31 1.69 2.86 -0.99 -1.72 114.93 117.64 3fyh h MET 162 Ca 0.05 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.49 3fyh h MET 162 Cb 0.26 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 3fyh h MET 162 CO 0.00 0.86 0.03 0.00 1.06 0.00 0.00 176.91 178.85 3fyh h ALA 163 N 1.30 0.42 -0.13 6.32 0.00 -0.81 -2.35 119.26 123.99 3fyh h ALA 163 Ca 0.26 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3fyh h ALA 163 Cb 0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3fyh h ALA 163 CO -0.03 0.14 -0.08 1.49 0.00 0.00 0.00 179.25 180.76 3fyh h GLU 164 N 0.34 -0.08 0.00 0.00 4.57 -0.60 -0.35 114.58 118.46 3fyh h GLU 164 Ca 0.09 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 3fyh h GLU 164 Cb 0.39 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3fyh h GLU 164 CO 0.01 -0.05 0.00 0.45 -1.18 0.00 0.00 179.01 178.24 3fyh h HIS 165 N -0.08 0.00 -0.01 0.92 3.86 -1.23 -0.52 115.15 118.08 3fyh h HIS 165 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3fyh h HIS 165 Cb 0.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.67 3fyh h HIS 165 CO -0.21 0.00 -0.20 0.00 0.86 0.00 0.00 177.93 178.38 3fyh n ALA 166 N -2.02 2.96 -1.70 2.45 0.00 -0.67 -4.95 120.51 116.58 3fyh n ALA 166 Ca -0.01 -0.48 -0.05 0.00 0.00 0.00 0.00 53.44 52.90 3fyh n ALA 166 Cb 0.19 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 3fyh n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fyh n GLY 167 N 1.31 0.42 3.57 0.00 0.00 -0.20 -5.04 105.19 105.24 3fyh n GLY 167 Ca 0.14 -0.73 -0.26 0.00 0.00 0.00 0.00 46.02 45.17 3fyh n GLY 167 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fyh s ILE 168 N -2.24 2.28 -0.21 -0.61 -4.36 -0.25 -5.02 121.20 110.79 3fyh s ILE 168 Ca 0.00 -2.14 -0.29 0.00 -0.26 0.00 0.00 60.65 57.96 3fyh s ILE 168 Cb 0.00 -2.71 0.01 0.00 1.25 0.00 0.00 42.46 41.00 3fyh s ILE 168 CO 0.00 -0.18 1.05 -0.62 0.24 0.00 0.00 174.94 175.43 3fyh s ASP 169 N -3.64 7.11 0.15 4.36 2.15 -1.26 -3.90 116.67 121.64 3fyh s ASP 169 Ca 0.33 1.42 -0.17 0.00 0.43 0.00 0.00 52.55 54.57 3fyh s ASP 169 Cb 0.03 -2.54 0.03 0.00 -0.30 0.00 0.00 42.92 40.14 3fyh s ASP 169 CO 0.17 -0.64 1.78 1.23 -0.17 0.00 0.00 175.17 177.54 3fyh h GLY 170 N 9.25 0.48 1.35 2.66 0.00 -1.87 -2.32 103.07 112.60 3fyh h GLY 170 Ca -0.21 -0.13 0.06 0.00 0.00 0.00 0.00 47.33 47.05 3fyh h GLY 170 CO 0.96 0.10 0.31 -1.61 0.00 0.00 0.00 176.54 176.29 3fyh h GLN 171 N 0.37 0.37 -0.48 4.80 5.75 -1.95 0.37 115.11 124.33 3fyh h GLN 171 Ca 0.15 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.55 3fyh h GLN 171 Cb 0.05 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 3fyh h GLN 171 CO -0.10 0.24 -0.01 1.15 -2.65 0.00 0.00 178.83 177.47 3fyh h THR 172 N 0.38 1.25 0.01 2.39 2.02 -1.83 0.26 112.91 117.37 3fyh h THR 172 Ca 0.20 -1.02 -0.00 0.00 0.77 0.00 0.00 66.41 66.35 3fyh h THR 172 Cb 0.30 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3fyh h THR 172 CO -0.05 0.36 -0.00 0.58 0.37 0.00 0.00 175.52 176.78 3fyh h VAL 173 N 0.75 1.24 -0.87 3.16 2.07 -0.73 -2.50 116.25 119.37 3fyh h VAL 173 Ca 0.14 -0.73 0.08 0.00 0.82 0.00 0.00 66.70 67.02 3fyh h VAL 173 Cb 0.47 1.73 -0.07 0.00 -1.52 0.00 0.00 31.29 31.90 3fyh h VAL 173 CO 0.02 0.19 0.53 -0.07 0.02 0.00 0.00 177.57 178.26 3fyh h LEU 174 N -0.32 0.80 -2.00 2.57 4.07 -1.09 -1.26 115.31 118.08 3fyh h LEU 174 Ca -0.00 0.03 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 3fyh h LEU 174 Cb 0.32 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 41.93 3fyh h LEU 174 CO 0.00 0.48 -0.10 0.44 -1.08 0.00 0.00 178.44 178.18 3fyh h ASP 175 N 0.91 0.00 -0.24 -0.43 3.32 -0.87 -2.94 116.42 116.17 3fyh h ASP 175 Ca 0.40 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.45 3fyh h ASP 175 Cb 0.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 3fyh h ASP 175 CO -0.21 0.10 -0.00 0.59 -1.72 0.00 0.00 179.24 177.99 3fyh n ASN 176 N -3.89 3.74 -3.99 6.45 4.13 -0.54 -4.92 115.26 116.24 3fyh n ASN 176 Ca -0.02 -3.03 -0.28 0.00 1.68 0.00 0.00 54.58 52.92 3fyh n ASN 176 Cb 0.19 -0.54 -0.17 0.00 -1.54 0.00 0.00 39.78 37.73 3fyh n ASN 176 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3fyh s THR 177 N -2.84 1.33 -0.15 3.41 2.01 -0.82 -0.83 115.64 117.75 3fyh s THR 177 Ca 0.41 -0.50 -0.15 0.00 0.31 0.00 0.00 61.69 61.76 3fyh s THR 177 Cb 0.34 -1.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 3fyh s THR 177 CO 0.08 0.42 0.36 -0.36 -0.69 0.00 0.00 174.62 174.43 3fyh s PHE 178 N 1.39 3.47 -0.10 4.92 0.40 0.11 -4.91 117.98 123.26 3fyh s PHE 178 Ca 0.01 0.70 0.02 0.00 -0.60 0.00 0.00 56.93 57.05 3fyh s PHE 178 Cb -0.13 -2.42 -0.01 0.00 0.51 0.00 0.00 43.02 40.96 3fyh s PHE 178 CO -0.07 0.20 -0.17 0.08 0.70 0.00 0.00 175.22 175.97 3fyh s VAL 179 N 0.57 2.76 -0.18 -0.44 1.01 -1.26 0.23 120.40 123.10 3fyh s VAL 179 Ca 0.20 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.40 3fyh s VAL 179 Cb -0.14 -2.11 0.03 0.00 0.00 0.00 0.00 36.38 34.16 3fyh s VAL 179 CO 0.06 0.55 -0.16 0.00 0.00 0.00 0.00 175.10 175.55 3fyh s ALA 180 N 0.10 2.13 -0.34 5.51 0.00 0.27 -4.96 121.76 124.47 3fyh s ALA 180 Ca -0.08 -1.15 -0.25 0.00 0.00 0.00 0.00 51.96 50.49 3fyh s ALA 180 Cb -0.15 -1.18 0.01 0.00 0.00 0.00 0.00 23.12 21.80 3fyh s ALA 180 CO 0.05 -0.49 0.85 0.50 0.00 0.00 0.00 175.76 176.67 3fyh s ARG 181 N 1.36 3.88 -0.17 0.00 6.06 -1.26 -0.54 118.95 128.28 3fyh s ARG 181 Ca 0.03 0.56 -0.05 0.00 -2.50 0.00 0.00 55.73 53.77 3fyh s ARG 181 Cb -0.14 -3.77 -0.03 0.00 0.06 0.00 0.00 34.95 31.07 3fyh s ARG 181 CO -0.11 -0.82 -0.01 0.00 -2.50 0.00 0.00 175.30 171.86 3fyh s ALA 182 N 3.20 3.07 -1.92 6.12 0.00 -0.11 -4.96 121.76 127.16 3fyh s ALA 182 Ca 0.35 -0.84 0.23 0.00 0.00 0.00 0.00 51.96 51.69 3fyh s ALA 182 Cb -0.13 -1.66 0.09 0.00 0.00 0.00 0.00 23.12 21.42 3fyh s ALA 182 CO 0.16 0.13 1.15 0.66 0.00 0.00 0.00 175.76 177.85 3fyh n TYR 183 N 3.68 0.00 -3.86 0.00 4.01 -1.26 -4.28 117.16 115.45 3fyh n TYR 183 Ca -0.17 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.49 3fyh n TYR 183 Cb 0.52 -0.02 -0.01 0.00 -0.31 0.00 0.00 39.34 39.53 3fyh n TYR 183 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3fyh s ASN 184 N -2.52 -0.09 0.41 7.72 6.03 -1.26 -5.03 114.94 120.19 3fyh s ASN 184 Ca 0.19 -0.88 0.16 0.00 -1.03 0.00 0.00 52.86 51.29 3fyh s ASN 184 Cb 0.18 0.76 0.89 0.00 -3.03 0.00 0.00 41.25 40.05 3fyh s ASN 184 CO 0.59 -1.45 1.89 0.77 -2.03 0.00 0.00 177.10 176.87 3fyh h SER 185 N 2.03 0.00 -0.20 3.54 4.64 -1.95 -1.84 113.55 119.78 3fyh h SER 185 Ca -0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 3fyh h SER 185 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 3fyh h SER 185 CO 0.31 0.29 0.08 0.44 -0.87 0.00 0.00 176.83 177.09 3fyh h ASP 186 N 0.00 0.27 -0.60 4.97 3.32 -1.98 -0.38 116.42 122.02 3fyh h ASP 186 Ca -0.00 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.82 3fyh h ASP 186 Cb 0.55 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 3fyh h ASP 186 CO 0.04 0.36 0.11 0.24 -1.72 0.00 0.00 179.24 178.26 3fyh h MET 187 N 0.18 0.98 -0.62 3.56 2.86 -1.91 0.34 114.93 120.33 3fyh h MET 187 Ca 0.07 -0.26 0.02 0.00 -2.06 0.00 0.00 59.70 57.47 3fyh h MET 187 Cb 0.16 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 3fyh h MET 187 CO -0.01 0.92 0.40 0.37 1.06 0.00 0.00 176.91 179.66 3fyh h GLN 188 N 0.89 0.78 -0.24 1.72 4.15 -1.20 0.15 115.11 121.36 3fyh h GLN 188 Ca 0.18 -0.05 -0.19 0.00 0.77 0.00 0.00 58.65 59.37 3fyh h GLN 188 Cb 0.40 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.92 3fyh h GLN 188 CO 0.01 0.52 -0.60 0.52 -1.93 0.00 0.00 178.83 177.34 3fyh h MET 189 N 0.80 0.79 -0.36 1.69 2.86 -0.85 -2.34 114.93 117.52 3fyh h MET 189 Ca 0.24 -0.53 -0.06 0.00 -2.06 0.00 0.00 59.70 57.28 3fyh h MET 189 Cb -0.05 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 3fyh h MET 189 CO -0.07 1.16 -0.02 1.25 1.06 0.00 0.00 176.91 180.29 3fyh h LEU 190 N 0.59 0.64 -0.83 1.22 5.85 -0.62 -1.58 115.31 120.58 3fyh h LEU 190 Ca -0.00 -0.32 0.05 0.00 0.84 0.00 0.00 57.88 58.44 3fyh h LEU 190 Cb 1.20 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 42.01 3fyh h LEU 190 CO 0.13 0.81 0.52 -0.26 -0.34 0.00 0.00 178.44 179.29 3fyh h PHE 191 N 0.46 0.96 -0.71 1.25 0.05 -0.74 -0.46 116.94 117.76 3fyh h PHE 191 Ca 0.10 0.03 -0.06 0.00 3.82 0.00 0.00 57.97 61.86 3fyh h PHE 191 Cb 0.49 -0.31 -0.03 0.00 2.00 0.00 0.00 35.95 38.10 3fyh h PHE 191 CO 0.04 0.52 0.21 0.00 -0.18 0.00 0.00 178.31 178.90 3fyh h ALA 192 N 1.37 1.03 -0.03 2.45 0.00 -1.00 -1.86 119.26 121.22 3fyh h ALA 192 Ca 0.35 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3fyh h ALA 192 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3fyh h ALA 192 CO -0.15 0.65 -0.15 0.93 0.00 0.00 0.00 179.25 180.53 3fyh h GLU 193 N 1.06 0.04 0.00 0.00 5.08 -0.60 -2.87 114.58 117.29 3fyh h GLU 193 Ca 0.23 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3fyh h GLU 193 Cb 0.31 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3fyh h GLU 193 CO -0.01 0.20 0.00 1.63 -1.00 0.00 0.00 179.01 179.84 3fyh n LYS 194 N -4.33 0.44 0.16 2.33 5.02 -0.25 -3.68 118.16 117.86 3fyh n LYS 194 Ca -0.02 0.01 0.03 0.00 -2.02 0.00 0.00 58.31 56.31 3fyh n LYS 194 Cb 0.23 -1.50 0.42 0.00 -0.02 0.00 0.00 35.03 34.17 3fyh n LYS 194 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3fyh h ILE 195 N 0.00 1.17 -0.58 -0.18 2.04 -1.40 -0.31 117.51 118.25 3fyh h ILE 195 Ca 0.00 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 3fyh h ILE 195 Cb 0.26 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3fyh h ILE 195 CO 0.00 0.23 0.31 -0.08 0.00 0.00 0.00 178.15 178.61 3fyh h GLU 196 N 0.13 0.80 -0.53 2.37 4.81 -1.79 -1.81 114.58 118.56 3fyh h GLU 196 Ca 0.03 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 3fyh h GLU 196 Cb 0.38 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3fyh h GLU 196 CO 0.02 0.60 0.14 -0.44 -0.73 0.00 0.00 179.01 178.61 3fyh h ASP 197 N 0.81 0.74 -0.48 1.04 3.32 -1.29 -1.81 116.42 118.75 3fyh h ASP 197 Ca 0.21 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 3fyh h ASP 197 Cb 0.04 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3fyh h ASP 197 CO -0.03 0.72 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.94 3fyh h LEU 198 N 0.77 1.01 -0.75 1.55 3.38 -1.13 -2.82 115.31 117.32 3fyh h LEU 198 Ca 0.17 -0.37 -0.08 0.00 0.09 0.00 0.00 57.88 57.69 3fyh h LEU 198 Cb 0.26 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3fyh h LEU 198 CO -0.00 1.17 0.04 0.40 0.09 0.00 0.00 178.44 180.13 3fyh h ILE 199 N 0.86 1.26 0.00 1.22 2.04 -1.07 -2.27 117.51 119.55 3fyh h ILE 199 Ca 0.12 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.92 3fyh h ILE 199 Cb 0.77 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 3fyh h ILE 199 CO 0.06 0.39 0.00 0.06 0.00 0.00 0.00 178.15 178.66 3fyh h GLN 200 N 0.92 0.00 -0.34 2.37 -0.00 -1.28 -2.14 115.11 114.64 3fyh h GLN 200 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.83 3fyh h GLN 200 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.96 3fyh h GLN 200 CO 0.02 0.00 0.00 0.39 -0.00 0.00 0.00 178.83 179.24 3fyh n GLU 201 N -2.96 1.65 -0.11 0.06 1.02 -0.90 -4.87 120.64 114.54 3fyh n GLU 201 Ca 0.02 -0.86 0.00 0.00 -0.02 0.00 0.00 57.16 56.29 3fyh n GLU 201 Cb 0.34 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 3fyh n GLU 201 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3fyh n GLY 202 N 0.76 0.67 3.64 0.62 0.00 -0.80 -5.06 105.19 105.01 3fyh n GLY 202 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3fyh n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3fyh s ASN 203 N -2.70 6.53 -1.31 1.61 0.01 -0.94 -4.98 114.94 113.17 3fyh s ASN 203 Ca 0.00 0.64 -0.17 0.00 -0.71 0.00 0.00 52.86 52.62 3fyh s ASN 203 Cb 0.00 -2.30 0.03 0.00 0.41 0.00 0.00 41.25 39.38 3fyh s ASN 203 CO 0.00 -0.27 1.94 -3.20 -1.51 0.00 0.00 177.10 174.06 3fyh n ASN 204 N 5.29 4.23 -4.66 -1.22 5.15 -1.26 -4.00 115.26 118.79 3fyh n ASN 204 Ca -0.03 -2.85 -0.42 0.00 -0.60 0.00 0.00 54.58 50.67 3fyh n ASN 204 Cb 0.50 -1.67 -0.03 0.00 -0.53 0.00 0.00 39.78 38.05 3fyh n ASN 204 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3fyh s ILE 205 N 4.59 3.53 0.00 -1.44 -1.09 -1.26 -1.62 121.20 123.92 3fyh s ILE 205 Ca 0.53 0.64 0.00 0.00 -2.23 0.00 0.00 60.65 59.59 3fyh s ILE 205 Cb 0.08 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.53 3fyh s ILE 205 CO 0.03 -0.07 0.05 0.29 -1.23 0.00 0.00 174.94 174.01 3fyh n LYS 206 N 7.22 5.47 -3.76 2.79 4.76 -0.40 -4.77 118.16 129.47 3fyh n LYS 206 Ca 0.18 -0.05 -0.15 0.00 -2.87 0.00 0.00 58.31 55.41 3fyh n LYS 206 Cb 0.43 -0.50 -0.16 0.00 -1.84 0.00 0.00 35.03 32.96 3fyh n LYS 206 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3fyh s LEU 207 N -1.59 0.93 -0.09 -0.35 2.96 -1.18 -1.03 118.68 118.33 3fyh s LEU 207 Ca 0.00 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.00 3fyh s LEU 207 Cb 0.00 -0.04 0.01 0.00 0.50 0.00 0.00 46.19 46.66 3fyh s LEU 207 CO 0.00 -0.15 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.04 3fyh s VAL 208 N 1.22 1.41 -0.06 1.68 1.01 0.47 -0.91 120.40 125.22 3fyh s VAL 208 Ca -0.07 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.33 3fyh s VAL 208 Cb -0.13 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 3fyh s VAL 208 CO -0.03 0.42 -0.22 -0.69 0.00 0.00 0.00 175.10 174.58 3fyh s VAL 209 N 0.73 2.36 -0.26 2.92 1.01 0.33 -0.37 120.40 127.12 3fyh s VAL 209 Ca -0.12 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 60.91 3fyh s VAL 209 Cb -0.16 -1.89 0.07 0.00 0.00 0.00 0.00 36.38 34.40 3fyh s VAL 209 CO 0.03 0.57 -0.03 -0.63 0.00 0.00 0.00 175.10 175.03 3fyh s ILE 210 N -0.22 1.64 -0.30 2.22 -1.09 -0.21 -0.89 121.20 122.35 3fyh s ILE 210 Ca -0.01 -1.42 0.01 0.00 -2.23 0.00 0.00 60.65 57.00 3fyh s ILE 210 Cb -0.13 -1.95 0.09 0.00 -1.58 0.00 0.00 42.46 38.89 3fyh s ILE 210 CO 0.03 -0.20 0.05 -0.62 -1.23 0.00 0.00 174.94 172.97 3fyh s ASP 211 N 1.32 4.19 0.19 3.58 3.68 -0.56 -1.62 116.67 127.44 3fyh s ASP 211 Ca -0.03 -1.69 0.04 0.00 2.13 0.00 0.00 52.55 53.01 3fyh s ASP 211 Cb -0.19 -1.15 -0.03 0.00 -1.45 0.00 0.00 42.92 40.09 3fyh s ASP 211 CO -0.08 -0.37 0.25 -0.55 0.13 0.00 0.00 175.17 174.55 3fyh s SER 212 N 1.36 6.01 0.04 -0.34 0.15 -1.26 -0.65 113.70 119.00 3fyh s SER 212 Ca 0.07 0.01 -0.17 0.00 0.70 0.00 0.00 55.95 56.56 3fyh s SER 212 Cb -0.18 -1.71 -0.26 0.00 -1.71 0.00 0.00 66.02 62.17 3fyh s SER 212 CO -0.16 0.02 1.11 0.25 1.20 0.00 0.00 173.24 175.66 3fyh h LEU 213 N 1.93 0.75 -0.41 3.45 5.85 -1.07 -3.40 115.31 122.41 3fyh h LEU 213 Ca -0.49 -0.79 0.00 0.00 0.84 0.00 0.00 57.88 57.44 3fyh h LEU 213 Cb 1.21 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.01 3fyh h LEU 213 CO 0.65 1.45 -0.48 0.35 -0.34 0.00 0.00 178.44 180.07 3fyh n THR 214 N -3.97 0.00 0.03 1.05 -2.24 -1.26 -4.67 114.28 103.22 3fyh n THR 214 Ca -0.12 -0.26 -0.11 0.00 -2.27 0.00 0.00 64.05 61.29 3fyh n THR 214 Cb 0.84 1.08 -0.05 0.00 -2.10 0.00 0.00 70.33 70.11 3fyh n THR 214 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3fyh h SER 215 N 0.78 -0.27 -0.53 3.42 0.02 -1.91 -1.06 113.55 114.00 3fyh h SER 215 Ca 0.00 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3fyh h SER 215 Cb 0.41 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 3fyh h SER 215 CO 0.00 -0.13 0.31 0.71 -1.14 0.00 0.00 176.83 176.58 3fyh h THR 216 N -0.14 1.16 -0.95 -2.27 1.35 -1.86 -1.36 112.91 108.85 3fyh h THR 216 Ca 0.05 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 3fyh h THR 216 Cb 0.20 0.47 -0.05 0.00 -1.73 0.00 0.00 68.15 67.04 3fyh h THR 216 CO -0.12 0.17 0.60 -0.26 -0.25 0.00 0.00 175.52 175.66 3fyh h PHE 217 N 0.70 1.23 -0.01 4.73 -1.00 -1.77 -0.39 116.94 120.44 3fyh h PHE 217 Ca 0.19 0.01 -0.13 0.00 2.81 0.00 0.00 57.97 60.85 3fyh h PHE 217 Cb 0.00 -0.41 -0.02 0.00 3.61 0.00 0.00 35.95 39.14 3fyh h PHE 217 CO -0.02 0.80 -0.60 0.00 -1.61 0.00 0.00 178.31 176.88 3fyh h ARG 218 N 1.30 0.04 0.00 1.51 3.08 -0.99 0.72 114.38 120.06 3fyh h ARG 218 Ca 0.34 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.32 3fyh h ARG 218 Cb -0.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3fyh h ARG 218 CO -0.07 0.63 -0.21 -0.97 -1.07 0.00 0.00 179.97 178.28 3fyh h ASN 219 N 0.03 0.00 0.03 7.04 -0.73 -0.60 -3.15 115.58 118.20 3fyh h ASN 219 Ca -0.01 0.00 -0.38 0.00 1.87 0.00 0.00 56.30 57.78 3fyh h ASN 219 Cb 1.06 0.00 -0.06 0.00 0.27 0.00 0.00 38.32 39.59 3fyh h ASN 219 CO 0.08 0.21 -2.38 -0.62 -0.37 0.00 0.00 177.43 174.35 3fyh n GLU 220 N -3.20 0.67 -3.51 6.67 1.02 -0.21 -4.63 120.64 117.45 3fyh n GLU 220 Ca 0.02 0.15 -0.28 0.00 -0.02 0.00 0.00 57.16 57.04 3fyh n GLU 220 Cb 0.55 -1.56 -0.09 0.00 -0.02 0.00 0.00 31.44 30.33 3fyh n GLU 220 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3fyh n TYR 221 N -3.24 3.58 1.32 -0.32 4.01 0.22 -5.10 117.16 117.63 3fyh n TYR 221 Ca -0.42 -4.17 0.00 0.00 -0.16 0.00 0.00 57.90 53.16 3fyh n TYR 221 Cb 1.02 -0.59 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 3fyh n TYR 221 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 3fyh n THR 222 N 1.07 0.00 -3.10 -0.72 5.66 -1.19 -4.61 114.28 111.40 3fyh n THR 222 Ca 0.28 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 61.13 3fyh n THR 222 Cb 0.40 -0.18 0.04 0.00 -1.55 0.00 0.00 70.33 69.05 3fyh n THR 222 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 3fyh n LYS 226 N -0.40 -4.63 -0.24 1.09 0.00 -1.26 -5.12 118.16 107.59 3fyh n LYS 226 Ca 0.00 0.53 0.13 0.00 -0.00 0.00 0.00 58.31 58.97 3fyh n LYS 226 Cb 0.03 -4.65 0.41 0.00 -0.00 0.00 0.00 35.03 30.81 3fyh n LYS 226 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 3fyh h LEU 227 N -1.54 0.59 0.00 -5.58 7.12 -1.98 0.01 115.31 113.93 3fyh h LEU 227 Ca -0.35 0.03 0.00 0.00 0.13 0.00 0.00 57.88 57.69 3fyh h LEU 227 Cb 1.23 -0.08 -0.00 0.00 -0.53 0.00 0.00 40.66 41.28 3fyh h LEU 227 CO 0.35 0.30 -0.00 0.00 -0.13 0.00 0.00 178.44 178.96 3fyh h ALA 228 N 1.61 -0.58 0.84 1.25 0.00 -1.98 0.43 119.26 120.83 3fyh h ALA 228 Ca 0.42 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 3fyh h ALA 228 Cb 0.74 0.42 0.01 0.00 0.00 0.00 0.00 17.79 18.96 3fyh h ALA 228 CO -0.18 -0.58 -0.40 1.49 0.00 0.00 0.00 179.25 179.58 3fyh h GLU 229 N -0.00 -1.08 -0.44 0.00 4.81 -1.92 -1.77 114.58 114.17 3fyh h GLU 229 Ca -0.00 0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 3fyh h GLU 229 Cb 0.00 0.25 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 3fyh h GLU 229 CO -0.00 -0.71 -0.26 -2.13 -0.73 0.00 0.00 179.01 175.18 3fyh n ARG 230 N -5.55 -0.19 -0.33 1.92 0.63 -0.04 0.24 116.66 113.34 3fyh n ARG 230 Ca -0.15 0.88 0.27 0.00 -0.92 0.00 0.00 57.85 57.94 3fyh n ARG 230 Cb 0.45 -1.30 0.58 0.00 0.45 0.00 0.00 32.46 32.64 3fyh n ARG 230 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 3fyh h GLN 231 N 0.00 0.26 0.00 -0.14 1.08 0.09 0.76 115.11 117.16 3fyh h GLN 231 Ca 0.07 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 3fyh h GLN 231 Cb 0.18 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 3fyh h GLN 231 CO -0.41 0.17 0.00 0.94 -0.95 0.00 0.00 178.83 178.58 3fyh n GLN 232 N -4.52 0.00 -0.30 1.46 7.27 0.67 -0.51 117.38 121.45 3fyh n GLN 232 Ca 0.26 0.29 0.14 0.00 0.07 0.00 0.00 57.00 57.77 3fyh n GLN 232 Cb 1.02 -1.24 0.31 0.00 2.41 0.00 0.00 30.24 32.73 3fyh n GLN 232 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 3fyh h LYS 233 N 0.00 0.29 -0.03 3.69 3.64 -0.94 0.77 116.57 123.99 3fyh h LYS 233 Ca 0.00 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 3fyh h LYS 233 Cb 0.00 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3fyh h LYS 233 CO 0.00 0.19 -0.33 1.25 -2.27 0.00 0.00 179.45 178.29 3fyh h LEU 234 N 0.30 0.06 -0.43 5.20 5.85 -0.90 -1.31 115.31 124.08 3fyh h LEU 234 Ca 0.57 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 59.10 3fyh h LEU 234 Cb 1.13 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 3fyh h LEU 234 CO -0.59 0.39 -0.51 1.23 -0.34 0.00 0.00 178.44 178.62 3fyh h GLY 235 N 1.03 0.81 0.99 3.75 0.00 0.31 0.10 103.07 110.06 3fyh h GLY 235 Ca 0.01 -0.91 -0.06 0.00 0.00 0.00 0.00 47.33 46.36 3fyh h GLY 235 CO 0.04 0.82 0.07 -0.09 0.00 0.00 0.00 176.54 177.39 3fyh h ARG 236 N 0.58 0.84 -0.17 4.80 2.43 -0.95 -0.62 114.38 121.28 3fyh h ARG 236 Ca 0.02 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 3fyh h ARG 236 Cb 1.08 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 3fyh h ARG 236 CO 0.11 0.84 0.11 1.25 -1.51 0.00 0.00 179.97 180.76 3fyh h HIS 237 N 0.71 0.20 -0.54 2.20 2.76 -1.04 -1.74 115.15 117.70 3fyh h HIS 237 Ca 0.15 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.29 3fyh h HIS 237 Cb 0.41 -0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.28 3fyh h HIS 237 CO 0.03 0.13 0.18 0.52 -1.30 0.00 0.00 177.93 177.49 3fyh h MET 238 N 0.22 0.80 -0.72 5.26 2.86 -0.83 -1.78 114.93 120.75 3fyh h MET 238 Ca 0.06 -0.14 -0.07 0.00 -2.06 0.00 0.00 59.70 57.50 3fyh h MET 238 Cb -0.02 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 3fyh h MET 238 CO -0.02 0.69 0.18 0.00 1.06 0.00 0.00 176.91 178.82 3fyh h ALA 239 N 1.41 0.96 -0.76 6.32 0.00 -0.75 -0.57 119.26 125.88 3fyh h ALA 239 Ca 0.18 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3fyh h ALA 239 Cb 0.21 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3fyh h ALA 239 CO -0.01 0.67 0.27 1.15 0.00 0.00 0.00 179.25 181.33 3fyh h THR 240 N 1.08 1.26 -0.35 0.00 2.02 -0.72 -0.79 112.91 115.41 3fyh h THR 240 Ca 0.23 -0.86 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 3fyh h THR 240 Cb 0.36 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 3fyh h THR 240 CO 0.00 0.34 -0.09 -0.07 0.37 0.00 0.00 175.52 176.07 3fyh h LEU 241 N 1.12 0.69 -1.09 2.58 3.38 -1.00 -1.36 115.31 119.62 3fyh h LEU 241 Ca 0.25 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 3fyh h LEU 241 Cb 0.26 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3fyh h LEU 241 CO -0.01 0.90 0.06 0.78 0.09 0.00 0.00 178.44 180.26 3fyh h ASN 242 N 0.48 0.66 -0.16 -0.43 4.21 -0.88 -0.94 115.58 118.51 3fyh h ASN 242 Ca 0.09 -0.13 -0.04 0.00 1.21 0.00 0.00 56.30 57.43 3fyh h ASN 242 Cb 0.60 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.62 3fyh h ASN 242 CO 0.04 0.69 -0.06 0.50 -1.29 0.00 0.00 177.43 177.31 3fyh h LYS 243 N 0.67 0.33 -0.33 0.81 3.64 -0.91 -2.08 116.57 118.70 3fyh h LYS 243 Ca 0.14 -0.13 0.05 0.00 -1.27 0.00 0.00 60.65 59.45 3fyh h LYS 243 Cb 0.33 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.09 3fyh h LYS 243 CO 0.01 0.62 0.02 1.25 -2.27 0.00 0.00 179.45 179.08 3fyh h LEU 244 N 0.01 -0.09 -0.54 5.20 5.85 -1.09 0.32 115.31 124.98 3fyh h LEU 244 Ca 0.04 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.87 3fyh h LEU 244 Cb 0.51 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.61 3fyh h LEU 244 CO 0.02 -0.01 0.29 0.00 -0.34 0.00 0.00 178.44 178.40 3fyh h ALA 245 N 1.27 0.70 0.09 1.25 0.00 -1.09 -1.49 119.26 119.99 3fyh h ALA 245 Ca 0.16 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3fyh h ALA 245 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3fyh h ALA 245 CO -0.24 -0.05 -0.04 -0.44 0.00 0.00 0.00 179.25 178.48 3fyh h ASP 246 N 0.55 -0.10 0.70 0.00 3.32 -0.65 -1.77 116.42 118.47 3fyh h ASP 246 Ca 0.24 -0.41 -0.09 0.00 0.02 0.00 0.00 57.03 56.79 3fyh h ASP 246 Cb 0.13 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3fyh h ASP 246 CO -0.15 0.39 -0.41 -0.07 -1.72 0.00 0.00 179.24 177.28 3fyh h LEU 247 N -0.62 0.00 -3.04 1.55 4.07 -0.39 -3.18 115.31 113.71 3fyh h LEU 247 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3fyh h LEU 247 Cb 0.51 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.25 3fyh h LEU 247 CO 0.02 0.41 0.00 0.49 -1.08 0.00 0.00 178.44 178.28 3fyh n PHE 248 N -3.68 0.57 -4.02 1.13 3.01 -0.56 -4.98 117.46 108.93 3fyh n PHE 248 Ca -0.01 -0.66 -0.42 0.00 1.01 0.00 0.00 57.45 57.37 3fyh n PHE 248 Cb 0.50 -0.14 0.01 0.00 -0.01 0.00 0.00 39.48 39.84 3fyh n PHE 248 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 3fyh n ASN 249 N -0.05 -3.74 -4.47 4.37 5.15 -0.93 -4.89 115.26 110.69 3fyh n ASN 249 Ca 0.14 -1.23 -0.30 0.00 -0.60 0.00 0.00 54.58 52.59 3fyh n ASN 249 Cb 0.59 -2.05 -0.12 0.00 -0.53 0.00 0.00 39.78 37.67 3fyh n ASN 249 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3fyh s VAL 251 N -1.05 5.12 -0.18 0.00 1.01 -0.20 -0.89 120.40 124.23 3fyh s VAL 251 Ca 0.16 1.08 -0.00 0.00 0.00 0.00 0.00 61.98 63.22 3fyh s VAL 251 Cb -0.11 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.40 3fyh s VAL 251 CO 0.08 0.26 -0.15 -0.69 0.00 0.00 0.00 175.10 174.60 3fyh s VAL 252 N 1.00 2.61 -0.00 2.92 1.01 -1.12 -0.40 120.40 126.41 3fyh s VAL 252 Ca 0.28 -0.77 0.06 0.00 0.00 0.00 0.00 61.98 61.55 3fyh s VAL 252 Cb -0.16 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 3fyh s VAL 252 CO 0.12 0.50 -0.18 -0.76 0.00 0.00 0.00 175.10 174.78 3fyh s LEU 253 N 1.12 2.55 0.04 3.92 1.43 0.50 -0.87 118.68 127.37 3fyh s LEU 253 Ca 0.01 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 3fyh s LEU 253 Cb -0.14 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.55 3fyh s LEU 253 CO -0.05 0.30 -0.05 0.68 0.23 0.00 0.00 176.35 177.46 3fyh s VAL 254 N -0.80 0.29 0.17 -1.59 -7.23 -0.19 -1.04 120.40 110.00 3fyh s VAL 254 Ca 0.13 -1.14 0.09 0.00 -1.81 0.00 0.00 61.98 59.24 3fyh s VAL 254 Cb -0.10 -0.62 -0.04 0.00 0.56 0.00 0.00 36.38 36.18 3fyh s VAL 254 CO 0.02 -0.56 -0.12 0.42 -0.31 0.00 0.00 175.10 174.56 3fyh s THR 255 N -1.90 3.06 -0.09 5.32 -4.23 -0.64 -1.32 115.64 115.84 3fyh s THR 255 Ca -0.09 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 58.74 3fyh s THR 255 Cb -0.07 -2.49 0.04 0.00 1.34 0.00 0.00 72.50 71.32 3fyh s THR 255 CO -0.02 -0.07 0.03 0.21 -0.54 0.00 0.00 174.62 174.24 3fyh s ASN 256 N -2.68 1.72 -0.51 3.99 3.84 -0.55 -0.81 114.94 119.95 3fyh s ASN 256 Ca 0.23 -0.20 -0.22 0.00 0.21 0.00 0.00 52.86 52.88 3fyh s ASN 256 Cb -0.09 -0.35 0.04 0.00 -0.55 0.00 0.00 41.25 40.30 3fyh s ASN 256 CO 0.14 -0.24 0.80 -1.58 -2.79 0.00 0.00 177.10 173.42 3fyh s GLN 257 N 2.03 3.29 0.04 0.43 2.00 -1.26 -2.40 119.66 123.79 3fyh s GLN 257 Ca 0.04 -0.40 0.02 0.00 -2.00 0.00 0.00 55.36 53.02 3fyh s GLN 257 Cb -0.13 -4.03 -0.04 0.00 0.80 0.00 0.00 33.01 29.61 3fyh s GLN 257 CO -0.05 -1.29 0.06 0.14 -0.50 0.00 0.00 175.29 173.65 3fyh s VAL 258 N 3.36 4.52 -0.32 1.34 -7.23 -1.13 -4.96 120.40 115.99 3fyh s VAL 258 Ca 0.26 -0.62 0.07 0.00 -1.81 0.00 0.00 61.98 59.89 3fyh s VAL 258 Cb -0.14 -3.11 -0.08 0.00 0.56 0.00 0.00 36.38 33.60 3fyh s VAL 258 CO 0.18 0.25 0.30 -0.24 -0.31 0.00 0.00 175.10 175.28 3fyh n SER 259 N 0.88 0.64 0.00 4.85 2.88 -1.26 -4.16 113.62 117.45 3fyh n SER 259 Ca -0.11 -0.61 0.00 0.00 -1.33 0.00 0.00 58.87 56.82 3fyh n SER 259 Cb 0.52 1.04 0.00 0.00 -0.75 0.00 0.00 64.21 65.02 3fyh n SER 259 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fyh n GLY 279 N 1.26 3.08 3.99 0.46 0.00 -1.26 -5.01 105.19 107.72 3fyh n GLY 279 Ca 0.01 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.46 3fyh n GLY 279 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3fyh s HIS 280 N 0.00 2.68 0.00 1.61 -0.00 -1.26 -5.03 115.29 113.28 3fyh s HIS 280 Ca 0.00 -0.44 -0.01 0.00 -0.00 0.00 0.00 55.06 54.61 3fyh s HIS 280 Cb 0.00 -2.34 -0.02 0.00 -0.00 0.00 0.00 32.58 30.22 3fyh s HIS 280 CO 0.00 -0.44 0.70 0.00 -0.00 0.00 0.00 174.74 175.00 3fyh n ALA 281 N -1.84 1.62 -2.25 -1.38 0.00 -1.26 -4.95 120.51 110.45 3fyh n ALA 281 Ca 0.08 -0.15 -0.39 0.00 0.00 0.00 0.00 53.44 52.98 3fyh n ALA 281 Cb 0.60 -2.18 -0.06 0.00 0.00 0.00 0.00 19.45 17.81 3fyh n ALA 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fyh s ALA 282 N 2.56 3.56 0.05 0.00 0.00 -1.26 -4.88 121.76 121.79 3fyh s ALA 282 Ca 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 51.96 52.08 3fyh s ALA 282 Cb 0.03 -2.69 -0.27 0.00 0.00 0.00 0.00 23.12 20.19 3fyh s ALA 282 CO 0.00 0.37 1.03 0.00 0.00 0.00 0.00 175.76 177.16 3fyh h THR 283 N 3.55 1.37 -4.29 0.00 1.03 -1.28 -3.45 112.91 109.84 3fyh h THR 283 Ca -0.49 -3.00 -0.68 0.00 -0.01 0.00 0.00 66.41 62.23 3fyh h THR 283 Cb 1.21 2.83 -0.31 0.00 -1.07 0.00 0.00 68.15 70.82 3fyh h THR 283 CO 0.64 0.86 -0.88 -0.36 -0.01 0.00 0.00 175.52 175.77 3fyh s PHE 284 N -2.65 2.29 -0.04 0.00 0.40 -0.91 -4.06 117.98 113.02 3fyh s PHE 284 Ca -0.05 -0.56 0.01 0.00 -0.60 0.00 0.00 56.93 55.73 3fyh s PHE 284 Cb 0.07 -1.49 0.02 0.00 0.51 0.00 0.00 43.02 42.13 3fyh s PHE 284 CO 0.86 -0.12 -0.05 1.03 0.70 0.00 0.00 175.22 177.63 3fyh s ARG 285 N -0.37 0.90 0.19 0.44 0.52 -0.44 -0.78 118.95 119.40 3fyh s ARG 285 Ca 0.03 -0.13 0.11 0.00 -0.52 0.00 0.00 55.73 55.22 3fyh s ARG 285 Cb -0.12 -0.88 -0.04 0.00 0.52 0.00 0.00 34.95 34.43 3fyh s ARG 285 CO 0.01 -0.07 -0.24 -0.06 0.02 0.00 0.00 175.30 174.96 3fyh s PHE 286 N 0.87 2.30 -0.17 -0.53 0.40 -0.04 -1.24 117.98 119.57 3fyh s PHE 286 Ca -0.12 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 55.86 3fyh s PHE 286 Cb -0.14 -1.15 0.02 0.00 0.51 0.00 0.00 43.02 42.26 3fyh s PHE 286 CO 0.01 0.49 -0.16 -0.06 0.70 0.00 0.00 175.22 176.19 3fyh s PHE 287 N -1.62 2.45 -0.13 0.36 0.08 -0.42 -0.97 117.98 117.74 3fyh s PHE 287 Ca 0.20 -1.44 -0.03 0.00 0.12 0.00 0.00 56.93 55.78 3fyh s PHE 287 Cb -0.08 -1.73 -0.03 0.00 -0.57 0.00 0.00 43.02 40.61 3fyh s PHE 287 CO 0.10 -0.74 -0.02 0.08 -0.10 0.00 0.00 175.22 174.54 3fyh s VAL 288 N 1.39 4.06 0.20 -0.44 1.01 0.64 -1.04 120.40 126.22 3fyh s VAL 288 Ca 0.04 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.74 3fyh s VAL 288 Cb -0.13 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 3fyh s VAL 288 CO -0.11 0.53 -0.01 0.00 0.00 0.00 0.00 175.10 175.51 3fyh s ARG 289 N -0.12 1.24 0.22 2.72 1.70 0.04 -4.00 118.95 120.74 3fyh s ARG 289 Ca 0.03 -1.61 -0.25 0.00 -0.47 0.00 0.00 55.73 53.44 3fyh s ARG 289 Cb -0.13 -0.52 -0.08 0.00 -0.57 0.00 0.00 34.95 33.65 3fyh s ARG 289 CO 0.02 -0.08 0.81 0.15 -1.08 0.00 0.00 175.30 175.12 3fyh s LYS 290 N -3.86 4.53 0.00 3.89 1.02 -1.26 -0.96 119.74 123.09 3fyh s LYS 290 Ca 0.26 1.16 0.00 0.00 0.02 0.00 0.00 55.97 57.41 3fyh s LYS 290 Cb 0.05 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 3fyh s LYS 290 CO 0.06 0.47 0.00 0.41 -0.92 0.00 0.00 175.35 175.38 3fyh n GLY 291 N 1.19 3.61 3.67 -3.33 0.00 0.17 -4.80 105.19 105.70 3fyh n GLY 291 Ca -0.03 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 3fyh n GLY 291 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3fyh s LYS 292 N 2.86 4.27 3.16 1.61 2.36 -1.26 -4.64 119.74 128.10 3fyh s LYS 292 Ca 0.00 1.66 0.00 0.00 -2.55 0.00 0.00 55.97 55.08 3fyh s LYS 292 Cb 0.00 -3.70 0.00 0.00 -1.05 0.00 0.00 37.83 33.08 3fyh s LYS 292 CO 0.00 -0.62 0.00 0.41 1.55 0.00 0.00 175.35 176.69 3fyh n GLY 293 N 3.53 0.64 0.18 5.54 0.00 -1.26 -1.48 105.19 112.34 3fyh n GLY 293 Ca 0.13 0.65 0.02 0.00 0.00 0.00 0.00 46.02 46.82 3fyh n GLY 293 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3fyh h ASP 294 N 0.00 0.00 -4.01 1.61 1.82 -1.89 -3.47 116.42 110.48 3fyh h ASP 294 Ca 0.00 -0.00 -0.49 0.00 -0.39 0.00 0.00 57.03 56.15 3fyh h ASP 294 Cb 0.00 -0.00 0.05 0.00 0.68 0.00 0.00 39.33 40.05 3fyh h ASP 294 CO 0.00 0.41 0.44 -0.54 -1.61 0.00 0.00 179.24 177.94 3fyh s LYS 295 N -4.11 3.83 0.01 0.28 -0.14 -0.55 -1.80 119.74 117.26 3fyh s LYS 295 Ca -0.03 1.61 -0.02 0.00 -1.36 0.00 0.00 55.97 56.18 3fyh s LYS 295 Cb 0.14 -2.34 -0.01 0.00 -1.68 0.00 0.00 37.83 33.94 3fyh s LYS 295 CO 0.73 -0.45 0.01 1.03 -0.76 0.00 0.00 175.35 175.91 3fyh s ARG 296 N -2.80 0.31 -0.11 1.68 1.81 0.33 0.44 118.95 120.61 3fyh s ARG 296 Ca 0.64 -0.49 0.02 0.00 -1.72 0.00 0.00 55.73 54.18 3fyh s ARG 296 Cb -0.24 0.12 0.01 0.00 -0.45 0.00 0.00 34.95 34.39 3fyh s ARG 296 CO 0.29 -0.06 -0.19 0.08 -0.68 0.00 0.00 175.30 174.75 3fyh s VAL 297 N -1.26 1.73 -0.22 3.52 1.01 -0.14 -1.36 120.40 123.69 3fyh s VAL 297 Ca -0.14 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 3fyh s VAL 297 Cb -0.08 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 3fyh s VAL 297 CO -0.00 0.49 -0.01 0.00 0.00 0.00 0.00 175.10 175.57 3fyh s ALA 298 N 0.77 2.94 -0.25 5.51 0.00 0.79 -0.78 121.76 130.73 3fyh s ALA 298 Ca -0.10 -1.09 -0.05 0.00 0.00 0.00 0.00 51.96 50.72 3fyh s ALA 298 Cb -0.16 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.19 3fyh s ALA 298 CO 0.01 -0.32 0.01 0.21 0.00 0.00 0.00 175.76 175.67 3fyh s LYS 299 N 1.30 3.22 -0.27 0.00 2.47 -0.20 0.22 119.74 126.49 3fyh s LYS 299 Ca 0.04 -0.74 -0.28 0.00 -1.56 0.00 0.00 55.97 53.42 3fyh s LYS 299 Cb -0.15 -3.16 0.01 0.00 -1.46 0.00 0.00 37.83 33.07 3fyh s LYS 299 CO -0.00 -0.31 1.02 -1.17 0.16 0.00 0.00 175.35 175.05 3fyh s LEU 300 N 1.48 4.03 0.00 5.43 1.98 -0.40 -1.29 118.68 129.91 3fyh s LEU 300 Ca 0.04 1.19 0.04 0.00 -2.89 0.00 0.00 54.13 52.51 3fyh s LEU 300 Cb -0.16 -3.49 -0.01 0.00 0.66 0.00 0.00 46.19 43.19 3fyh s LEU 300 CO -0.01 -0.73 0.36 0.00 -1.89 0.00 0.00 176.35 174.08 3fyh n TYR 301 N 6.50 0.00 -3.71 5.38 4.11 -0.37 -2.84 117.16 126.22 3fyh n TYR 301 Ca 0.11 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.90 3fyh n TYR 301 Cb 0.47 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.69 3fyh n TYR 301 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 3fyh s ASP 302 N -0.96 -0.43 0.16 9.48 3.68 -1.16 -4.95 116.67 122.49 3fyh s ASP 302 Ca 0.03 0.77 -0.24 0.00 2.13 0.00 0.00 52.55 55.25 3fyh s ASP 302 Cb 0.03 0.67 0.06 0.00 -1.45 0.00 0.00 42.92 42.24 3fyh s ASP 302 CO 0.12 -0.18 0.77 -0.94 0.13 0.00 0.00 175.17 175.07 3fyh s SER 303 N 1.18 -0.36 0.23 -0.34 1.04 -1.26 -1.33 113.70 112.86 3fyh s SER 303 Ca -0.08 -0.26 0.24 0.00 0.48 0.00 0.00 55.95 56.32 3fyh s SER 303 Cb -0.08 0.57 0.33 0.00 0.10 0.00 0.00 66.02 66.94 3fyh s SER 303 CO -0.10 -1.00 1.38 1.55 0.98 0.00 0.00 173.24 176.05 3fyh h PRO 304 N 2.00 0.00 0.00 4.02 0.13 -1.99 -3.40 132.00 132.76 3fyh h PRO 304 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3fyh h PRO 304 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3fyh h PRO 304 CO 0.30 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 175.68 3fyh n HIS 305 N -2.50 0.00 -4.43 1.56 1.44 -1.26 -5.10 115.22 104.93 3fyh n HIS 305 Ca 0.03 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.44 3fyh n HIS 305 Cb 0.49 0.01 -0.12 0.00 0.12 0.00 0.00 29.99 30.49 3fyh n HIS 305 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3fyh s LEU 306 N 0.00 2.62 0.65 2.39 1.43 -1.26 -5.12 118.68 119.38 3fyh s LEU 306 Ca 0.00 -0.54 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 3fyh s LEU 306 Cb 0.00 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.72 3fyh s LEU 306 CO 0.00 0.20 1.07 -2.16 0.23 0.00 0.00 176.35 175.70 3fyh s PRO 307 N -1.90 3.01 0.38 1.29 0.04 -1.26 -4.62 135.00 131.93 3fyh s PRO 307 Ca 0.16 1.18 -0.28 0.00 0.04 0.00 0.00 61.00 62.11 3fyh s PRO 307 Cb -0.10 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.34 3fyh s PRO 307 CO 0.08 -1.06 1.39 -0.51 0.04 0.00 0.00 177.00 176.94 3fyh s ASP 308 N -3.03 6.42 0.03 6.66 1.11 -1.26 -4.93 116.67 121.66 3fyh s ASP 308 Ca 0.63 2.86 -0.27 0.00 0.18 0.00 0.00 52.55 55.94 3fyh s ASP 308 Cb -0.17 -2.66 0.08 0.00 1.07 0.00 0.00 42.92 41.25 3fyh s ASP 308 CO 0.44 -0.80 0.74 0.00 1.18 0.00 0.00 175.17 176.73 3fyh s ALA 309 N -1.16 -1.74 -0.02 5.23 0.00 -1.13 -4.99 121.76 117.95 3fyh s ALA 309 Ca 0.53 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.46 3fyh s ALA 309 Cb -0.43 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 3fyh s ALA 309 CO 0.57 -0.59 0.01 -1.21 0.00 0.00 0.00 175.76 174.54 3fyh s GLU 310 N -2.61 2.88 -0.12 0.00 2.02 -1.26 -1.27 118.70 118.35 3fyh s GLU 310 Ca -0.02 -0.53 0.01 0.00 0.02 0.00 0.00 54.97 54.45 3fyh s GLU 310 Cb -0.01 -2.73 0.02 0.00 0.10 0.00 0.00 34.13 31.51 3fyh s GLU 310 CO -0.04 0.65 -0.15 0.00 0.02 0.00 0.00 175.26 175.74 3fyh s ALA 311 N -1.05 1.76 -0.16 5.21 0.00 0.13 -4.96 121.76 122.70 3fyh s ALA 311 Ca 0.18 -0.80 -0.15 0.00 0.00 0.00 0.00 51.96 51.19 3fyh s ALA 311 Cb -0.12 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 3fyh s ALA 311 CO 0.09 -0.16 0.36 0.42 0.00 0.00 0.00 175.76 176.47 3fyh s ILE 312 N 1.11 5.26 0.32 0.00 1.01 -1.26 -0.15 121.20 127.49 3fyh s ILE 312 Ca -0.03 0.68 0.02 0.00 0.00 0.00 0.00 60.65 61.32 3fyh s ILE 312 Cb -0.14 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.61 3fyh s ILE 312 CO -0.04 0.34 0.35 0.72 0.00 0.00 0.00 174.94 176.31 3fyh s PHE 313 N 0.69 1.38 0.12 3.97 -0.12 -0.46 -4.73 117.98 118.84 3fyh s PHE 313 Ca 0.19 -1.46 0.04 0.00 -0.05 0.00 0.00 56.93 55.65 3fyh s PHE 313 Cb -0.14 -0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 41.79 3fyh s PHE 313 CO 0.06 -0.96 -0.11 1.03 -0.05 0.00 0.00 175.22 175.20 3fyh s ARG 314 N -3.38 0.97 -0.19 1.99 0.52 -0.10 -0.51 118.95 118.25 3fyh s ARG 314 Ca 0.36 -1.31 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 3fyh s ARG 314 Cb 0.02 -0.61 0.01 0.00 0.52 0.00 0.00 34.95 34.89 3fyh s ARG 314 CO 0.23 0.09 -0.15 0.42 0.02 0.00 0.00 175.30 175.90 3fyh s ILE 315 N -2.85 2.49 0.03 1.52 1.01 -0.75 -1.32 121.20 121.34 3fyh s ILE 315 Ca 0.11 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.97 3fyh s ILE 315 Cb -0.00 -2.08 -0.00 0.00 0.01 0.00 0.00 42.46 40.38 3fyh s ILE 315 CO 0.00 0.50 0.01 0.35 0.00 0.00 0.00 174.94 175.81 3fyh n THR 316 N 4.65 0.00 0.30 2.92 -2.24 -0.32 -4.86 114.28 114.72 3fyh n THR 316 Ca -0.20 -0.19 0.18 0.00 -2.27 0.00 0.00 64.05 61.57 3fyh n THR 316 Cb 0.50 0.07 0.89 0.00 -2.10 0.00 0.00 70.33 69.70 3fyh n THR 316 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3fyh h GLU 317 N 0.00 0.00 0.00 -0.78 -0.00 -2.00 -1.48 114.58 110.32 3fyh h GLU 317 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.33 3fyh h GLU 317 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.85 3fyh h GLU 317 CO 0.04 0.03 0.00 1.63 -0.00 0.00 0.00 179.01 180.71 3fyh n LYS 318 N -3.22 0.25 0.00 1.06 5.02 -1.26 -4.53 118.16 115.48 3fyh n LYS 318 Ca -0.01 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 3fyh n LYS 318 Cb 0.21 -1.81 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 3fyh n LYS 318 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fyh n GLY 319 N 1.15 0.36 3.72 0.72 0.00 -0.56 -4.58 105.19 106.00 3fyh n GLY 319 Ca 0.05 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 43.93 3fyh n GLY 319 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fyh s ILE 320 N 0.00 4.90 0.24 -0.61 -1.09 -1.26 -1.18 121.20 122.21 3fyh s ILE 320 Ca 0.00 1.65 -0.07 0.00 -2.23 0.00 0.00 60.65 60.00 3fyh s ILE 320 Cb 0.00 -4.13 -0.02 0.00 -1.58 0.00 0.00 42.46 36.73 3fyh s ILE 320 CO 0.00 0.27 0.35 0.00 -1.23 0.00 0.00 174.94 174.33 3fyh s GLN 321 N 0.58 1.47 0.00 2.79 -2.07 -0.43 -4.62 119.66 117.38 3fyh s GLN 321 Ca 0.41 -1.46 0.00 0.00 -1.82 0.00 0.00 55.36 52.49 3fyh s GLN 321 Cb -0.19 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.12 3fyh s GLN 321 CO 0.22 -0.57 0.00 -0.25 -1.32 0.00 0.00 175.29 173.37