#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fbu s PHE 2 N 0.00 1.29 -0.06 2.03 2.19 -1.26 -3.75 117.98 118.43 3fbu s PHE 2 Ca 0.00 -0.74 0.02 0.00 0.33 0.00 0.00 56.93 56.53 3fbu s PHE 2 Cb 0.00 -1.13 0.02 0.00 -1.31 0.00 0.00 43.02 40.60 3fbu s PHE 2 CO 0.00 -0.52 -0.09 0.42 1.83 0.00 0.00 175.22 176.86 3fbu s ILE 3 N 1.77 0.89 -0.20 3.12 1.01 -0.51 -4.98 121.20 122.30 3fbu s ILE 3 Ca 0.02 -0.34 -0.06 0.00 0.00 0.00 0.00 60.65 60.28 3fbu s ILE 3 Cb -0.14 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.46 3fbu s ILE 3 CO -0.07 0.30 0.02 -0.54 0.00 0.00 0.00 174.94 174.65 3fbu s LYS 4 N 0.73 3.69 0.00 2.79 1.02 -1.26 -0.83 119.74 125.88 3fbu s LYS 4 Ca -0.13 -0.48 0.00 0.00 0.02 0.00 0.00 55.97 55.38 3fbu s LYS 4 Cb -0.15 -3.14 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 3fbu s LYS 4 CO 0.02 0.04 0.00 0.00 -0.92 0.00 0.00 175.35 174.49 3fbu n ALA 5 N 4.20 0.00 0.32 5.17 0.00 0.66 -5.01 120.51 125.85 3fbu n ALA 5 Ca -0.17 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.10 3fbu n ALA 5 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.88 3fbu n ALA 5 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3fbu h GLU 6 N 0.00 -0.81 -0.00 0.00 5.08 -1.99 -3.37 114.58 113.49 3fbu h GLU 6 Ca 0.00 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3fbu h GLU 6 Cb 0.00 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3fbu h GLU 6 CO 0.00 -0.54 -0.31 0.54 -1.00 0.00 0.00 179.01 177.70 3fbu n ARG 7 N -5.47 2.76 -3.98 2.33 1.74 -1.26 -5.00 116.66 107.79 3fbu n ARG 7 Ca -0.12 -0.37 -0.09 0.00 -0.77 0.00 0.00 57.85 56.50 3fbu n ARG 7 Cb 0.36 -1.04 -0.08 0.00 -1.02 0.00 0.00 32.46 30.68 3fbu n ARG 7 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 3fbu s LEU 8 N -1.96 1.40 0.16 0.55 0.05 -1.26 -1.43 118.68 116.19 3fbu s LEU 8 Ca 0.07 -0.89 0.06 0.00 0.05 0.00 0.00 54.13 53.42 3fbu s LEU 8 Cb 0.08 0.87 -0.04 0.00 -2.05 0.00 0.00 46.19 45.05 3fbu s LEU 8 CO 0.31 -0.79 -0.13 -1.48 -0.55 0.00 0.00 176.35 173.71 3fbu s LEU 9 N -2.95 2.49 -0.07 1.48 0.05 0.07 -0.25 118.68 119.50 3fbu s LEU 9 Ca 0.14 -0.94 0.05 0.00 0.05 0.00 0.00 54.13 53.44 3fbu s LEU 9 Cb 0.05 -0.56 -0.01 0.00 -2.05 0.00 0.00 46.19 43.63 3fbu s LEU 9 CO -0.04 -0.19 -0.24 -0.63 -0.55 0.00 0.00 176.35 174.70 3fbu s ILE 10 N -2.73 2.00 0.33 1.48 1.01 -0.01 -0.59 121.20 122.70 3fbu s ILE 10 Ca 0.16 -1.02 0.03 0.00 0.00 0.00 0.00 60.65 59.83 3fbu s ILE 10 Cb -0.02 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.73 3fbu s ILE 10 CO 0.04 0.55 0.35 0.00 0.00 0.00 0.00 174.94 175.88 3fbu s ARG 11 N 0.04 1.81 0.53 2.79 1.70 -1.04 -1.42 118.95 123.35 3fbu s ARG 11 Ca -0.09 -1.91 -0.14 0.00 -0.47 0.00 0.00 55.73 53.12 3fbu s ARG 11 Cb -0.15 0.37 -0.07 0.00 -0.57 0.00 0.00 34.95 34.54 3fbu s ARG 11 CO 0.05 -0.70 0.97 0.15 -1.08 0.00 0.00 175.30 174.69 3fbu s LYS 12 N -3.30 3.82 0.43 3.89 1.02 -1.25 -2.94 119.74 121.42 3fbu s LYS 12 Ca 0.37 0.83 -0.25 0.00 0.02 0.00 0.00 55.97 56.94 3fbu s LYS 12 Cb 0.01 -2.15 -0.08 0.00 -0.52 0.00 0.00 37.83 35.09 3fbu s LYS 12 CO 0.24 -0.33 1.26 -0.06 -0.92 0.00 0.00 175.35 175.54 3fbu s PHE 13 N -2.76 2.81 0.13 3.18 0.08 -1.26 -4.80 117.98 115.35 3fbu s PHE 13 Ca 0.57 1.45 0.05 0.00 0.12 0.00 0.00 56.93 59.12 3fbu s PHE 13 Cb -0.10 -3.59 -0.04 0.00 -0.57 0.00 0.00 43.02 38.72 3fbu s PHE 13 CO 0.38 -1.95 0.04 -1.21 -0.10 0.00 0.00 175.22 172.38 3fbu s GLU 14 N -2.41 2.63 0.33 0.44 0.41 -1.26 -4.77 118.70 114.06 3fbu s GLU 14 Ca 0.60 -0.90 0.04 0.00 -0.41 0.00 0.00 54.97 54.30 3fbu s GLU 14 Cb -0.35 -2.54 0.66 0.00 -1.78 0.00 0.00 34.13 30.12 3fbu s GLU 14 CO 0.44 0.51 1.90 0.35 -0.49 0.00 0.00 175.26 177.97 3fbu h PHE 15 N 2.96 0.94 0.00 1.61 3.57 -1.97 -0.00 116.94 124.05 3fbu h PHE 15 Ca -0.47 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.05 3fbu h PHE 15 Cb 1.18 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.62 3fbu h PHE 15 CO 0.60 0.44 0.00 0.36 -2.23 0.00 0.00 178.31 177.48 3fbu n LYS 16 N -4.53 0.04 0.23 1.11 2.85 -1.26 -1.88 118.16 114.73 3fbu n LYS 16 Ca 0.15 0.28 0.16 0.00 -1.05 0.00 0.00 58.31 57.84 3fbu n LYS 16 Cb 0.31 -1.50 0.75 0.00 -0.65 0.00 0.00 35.03 33.94 3fbu n LYS 16 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3fbu h ASP 17 N 0.00 0.00 -0.88 -5.58 3.32 -1.40 -3.35 116.42 108.53 3fbu h ASP 17 Ca 0.00 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.13 3fbu h ASP 17 Cb 0.16 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 3fbu h ASP 17 CO 0.00 0.00 0.57 4.11 -1.72 0.00 0.00 179.24 182.20 3fbu h TRP 18 N 0.00 0.99 -0.62 4.55 5.08 -1.57 -2.42 115.95 121.95 3fbu h TRP 18 Ca 0.00 0.03 -0.04 0.00 1.08 0.00 0.00 58.89 59.96 3fbu h TRP 18 Cb 0.23 -0.32 -0.03 0.00 -3.00 0.00 0.00 29.16 26.04 3fbu h TRP 18 CO 0.00 0.49 0.23 0.93 -1.28 0.00 0.00 178.44 178.81 3fbu h GLU 19 N 0.95 0.94 -0.36 0.12 5.08 -1.85 0.17 114.58 119.63 3fbu h GLU 19 Ca 0.39 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.47 3fbu h GLU 19 Cb 0.28 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3fbu h GLU 19 CO -0.15 0.81 -0.20 0.00 -1.00 0.00 0.00 179.01 178.47 3fbu h ALA 20 N 1.09 0.97 -0.45 3.43 0.00 -1.73 -2.74 119.26 119.83 3fbu h ALA 20 Ca 0.21 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3fbu h ALA 20 Cb 0.23 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3fbu h ALA 20 CO -0.01 0.60 -0.02 0.28 0.00 0.00 0.00 179.25 180.10 3fbu h VAL 21 N 0.62 1.26 -0.11 0.00 2.07 -1.03 -3.08 116.25 115.97 3fbu h VAL 21 Ca 0.09 -1.08 0.03 0.00 0.82 0.00 0.00 66.70 66.56 3fbu h VAL 21 Cb 0.67 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3fbu h VAL 21 CO 0.05 0.37 0.09 -0.74 0.02 0.00 0.00 177.57 177.36 3fbu h HIS 22 N 0.64 0.00 -0.76 1.57 6.17 -0.40 -1.38 115.15 121.01 3fbu h HIS 22 Ca 0.12 0.00 0.16 0.00 0.71 0.00 0.00 60.37 61.36 3fbu h HIS 22 Cb 0.53 0.00 -0.05 0.00 2.52 0.00 0.00 27.41 30.41 3fbu h HIS 22 CO 0.04 0.00 0.51 1.49 0.71 0.00 0.00 177.93 180.68 3fbu h GLU 23 N 0.00 0.37 0.00 5.26 4.81 -1.41 -2.02 114.58 121.60 3fbu h GLU 23 Ca 0.05 -0.02 -0.24 0.00 -0.13 0.00 0.00 59.36 59.02 3fbu h GLU 23 Cb 0.23 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 3fbu h GLU 23 CO -0.00 0.25 -1.91 2.48 -0.73 0.00 0.00 179.01 179.10 3fbu n TYR 24 N -4.47 0.00 0.34 0.92 0.18 -0.62 -4.42 117.16 109.09 3fbu n TYR 24 Ca 0.15 0.00 0.15 0.00 1.88 0.00 0.00 57.90 60.07 3fbu n TYR 24 Cb 0.56 -0.65 0.58 0.00 -0.38 0.00 0.00 39.34 39.45 3fbu n TYR 24 CO 0.00 0.00 0.00 1.79 -2.08 0.00 0.00 176.86 176.57 3fbu h THR 25 N 0.00 0.00 -0.01 -3.48 1.35 -1.20 -1.88 112.91 107.70 3fbu h THR 25 Ca -0.36 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 3fbu h THR 25 Cb 1.81 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 69.54 3fbu h THR 25 CO 0.02 0.00 -0.12 -1.54 -0.25 0.00 0.00 175.52 173.62 3fbu n SER 26 N -2.73 0.73 -4.64 5.36 3.41 -0.77 -0.86 113.62 114.13 3fbu n SER 26 Ca 0.01 -0.83 -0.39 0.00 -0.26 0.00 0.00 58.87 57.41 3fbu n SER 26 Cb 0.29 -0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.16 3fbu n SER 26 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fbu s ASP 27 N -2.37 6.43 0.33 4.04 -1.08 -0.71 -4.83 116.67 118.48 3fbu s ASP 27 Ca 0.30 0.51 0.17 0.00 -0.52 0.00 0.00 52.55 53.02 3fbu s ASP 27 Cb 0.20 -2.26 0.36 0.00 -1.46 0.00 0.00 42.92 39.77 3fbu s ASP 27 CO 0.46 -0.18 1.58 0.77 0.52 0.00 0.00 175.17 178.32 3fbu h SER 28 N 7.73 0.00 -0.36 -0.34 4.64 -1.90 -1.77 113.55 121.55 3fbu h SER 28 Ca -0.33 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.88 3fbu h SER 28 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 3fbu h SER 28 CO 0.71 0.42 -0.22 0.44 -0.87 0.00 0.00 176.83 177.31 3fbu h ASP 29 N 0.00 0.81 -0.72 4.97 3.32 -1.94 -2.40 116.42 120.46 3fbu h ASP 29 Ca -0.00 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.62 3fbu h ASP 29 Cb 1.16 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 3fbu h ASP 29 CO 0.05 1.06 0.45 0.58 -1.72 0.00 0.00 179.24 179.67 3fbu h VAL 30 N 0.56 1.19 -0.62 -1.35 2.07 -1.73 -3.15 116.25 113.23 3fbu h VAL 30 Ca 0.07 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.20 3fbu h VAL 30 Cb 0.78 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3fbu h VAL 30 CO 0.06 0.19 0.00 0.23 0.02 0.00 0.00 177.57 178.08 3fbu n MET 31 N -4.56 2.70 -0.26 1.57 2.81 -0.71 -4.51 117.12 114.16 3fbu n MET 31 Ca 0.06 -2.34 0.06 0.00 -1.81 0.00 0.00 57.70 53.67 3fbu n MET 31 Cb 0.04 -1.57 0.19 0.00 -0.71 0.00 0.00 33.22 31.16 3fbu n MET 31 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3fbu h LYS 32 N 3.70 0.17 -0.40 0.03 1.63 -1.38 -1.89 116.57 118.42 3fbu h LYS 32 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 3fbu h LYS 32 Cb 0.96 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.55 3fbu h LYS 32 CO 0.05 0.11 0.00 0.66 -3.45 0.00 0.00 179.45 176.82 3fbu n TYR 33 N -5.26 0.52 -3.26 1.91 4.01 -1.26 -4.88 117.16 108.95 3fbu n TYR 33 Ca 0.15 -0.26 -0.38 0.00 -0.16 0.00 0.00 57.90 57.25 3fbu n TYR 33 Cb 0.50 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.47 3fbu n TYR 33 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3fbu s ILE 34 N -1.48 5.16 0.20 -0.72 -1.09 -0.71 -4.97 121.20 117.58 3fbu s ILE 34 Ca 0.39 1.05 -0.15 0.00 -2.23 0.00 0.00 60.65 59.71 3fbu s ILE 34 Cb 0.23 -3.86 0.19 0.00 -1.58 0.00 0.00 42.46 37.44 3fbu s ILE 34 CO 0.32 0.30 1.63 -0.65 -1.23 0.00 0.00 174.94 175.31 3fbu h PRO 35 N 6.78 -0.03 -0.30 2.79 0.11 -1.89 -1.59 132.00 137.87 3fbu h PRO 35 Ca -0.40 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.80 3fbu h PRO 35 Cb 1.18 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3fbu h PRO 35 CO 0.76 -0.02 0.23 0.93 -0.21 0.00 0.00 178.00 179.69 3fbu h GLU 36 N -0.03 0.00 0.00 1.05 5.08 -1.93 -3.48 114.58 115.27 3fbu h GLU 36 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3fbu h GLU 36 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3fbu h GLU 36 CO -0.59 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 177.83 3fbu n GLY 37 N -1.57 -0.13 3.77 -3.84 0.00 -0.60 -4.87 105.19 97.95 3fbu n GLY 37 Ca 0.04 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.62 3fbu n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fbu s VAL 38 N 0.00 2.58 0.11 1.61 1.01 -1.26 -4.94 120.40 119.51 3fbu s VAL 38 Ca 0.00 0.57 -0.20 0.00 0.00 0.00 0.00 61.98 62.35 3fbu s VAL 38 Cb 0.00 -3.36 -0.07 0.00 0.00 0.00 0.00 36.38 32.95 3fbu s VAL 38 CO 0.00 0.12 0.62 -0.36 0.00 0.00 0.00 175.10 175.48 3fbu s PHE 39 N -1.17 3.79 0.84 5.22 0.40 -0.04 -5.00 117.98 122.02 3fbu s PHE 39 Ca 0.51 1.33 -0.12 0.00 -0.60 0.00 0.00 56.93 58.05 3fbu s PHE 39 Cb -0.40 -2.54 0.10 0.00 0.51 0.00 0.00 43.02 40.68 3fbu s PHE 39 CO 0.54 0.53 1.15 0.95 0.70 0.00 0.00 175.22 179.09 3fbu s THR 40 N -1.20 2.18 0.22 0.64 -4.23 -1.26 -4.28 115.64 107.71 3fbu s THR 40 Ca 0.33 0.06 -0.08 0.00 -1.18 0.00 0.00 61.69 60.81 3fbu s THR 40 Cb -0.19 -2.95 0.16 0.00 1.34 0.00 0.00 72.50 70.85 3fbu s THR 40 CO 0.21 -0.08 1.82 -0.33 -0.54 0.00 0.00 174.62 175.70 3fbu h GLU 41 N -1.19 0.74 -0.78 3.99 5.08 -1.99 -1.12 114.58 119.32 3fbu h GLU 41 Ca -0.48 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 3fbu h GLU 41 Cb 1.32 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 30.37 3fbu h GLU 41 CO 0.64 0.49 0.47 1.49 -1.00 0.00 0.00 179.01 181.10 3fbu h GLU 42 N 0.76 1.06 -0.17 2.33 4.81 -1.99 -1.33 114.58 120.05 3fbu h GLU 42 Ca 0.31 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3fbu h GLU 42 Cb 0.17 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3fbu h GLU 42 CO -0.17 0.74 0.09 -0.44 -0.73 0.00 0.00 179.01 178.50 3fbu h ASP 43 N 1.07 0.20 -0.29 1.04 3.32 -1.67 -0.69 116.42 119.41 3fbu h ASP 43 Ca 0.28 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 3fbu h ASP 43 Cb -0.04 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3fbu h ASP 43 CO -0.05 0.21 0.14 0.74 -1.72 0.00 0.00 179.24 178.57 3fbu h THR 44 N 0.18 1.15 -0.72 0.35 2.02 -0.98 -0.22 112.91 114.68 3fbu h THR 44 Ca 0.06 -0.41 0.07 0.00 0.77 0.00 0.00 66.41 66.90 3fbu h THR 44 Cb 0.05 0.89 -0.06 0.00 -1.74 0.00 0.00 68.15 67.29 3fbu h THR 44 CO -0.01 0.15 0.41 0.03 0.37 0.00 0.00 175.52 176.46 3fbu h ARG 45 N 0.34 0.71 -0.40 6.66 3.08 -1.14 -0.93 114.38 122.69 3fbu h ARG 45 Ca 0.10 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 3fbu h ARG 45 Cb 0.10 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3fbu h ARG 45 CO -0.01 0.47 0.22 -0.91 -1.07 0.00 0.00 179.97 178.66 3fbu h ASN 46 N 0.73 0.50 -0.04 7.04 2.35 -0.87 -0.87 115.58 124.42 3fbu h ASN 46 Ca 0.33 -0.09 0.02 0.00 -0.55 0.00 0.00 56.30 56.01 3fbu h ASN 46 Cb 0.23 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 3fbu h ASN 46 CO -0.20 0.45 -0.05 0.15 -1.65 0.00 0.00 177.43 176.13 3fbu h PHE 47 N 0.52 -0.11 -0.34 1.19 3.57 -0.59 0.23 116.94 121.40 3fbu h PHE 47 Ca 0.14 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 3fbu h PHE 47 Cb 0.06 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 3fbu h PHE 47 CO -0.02 -0.07 0.15 0.28 -2.23 0.00 0.00 178.31 176.42 3fbu h VAL 48 N -0.06 1.17 -0.47 1.41 2.07 -1.08 -2.31 116.25 116.99 3fbu h VAL 48 Ca 0.04 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 67.08 3fbu h VAL 48 Cb 0.11 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 3fbu h VAL 48 CO -0.08 0.18 0.27 -1.13 0.02 0.00 0.00 177.57 176.83 3fbu h ASN 49 N 0.41 0.43 0.06 0.57 -1.24 -1.00 -2.38 115.58 112.43 3fbu h ASN 49 Ca 0.12 0.01 -0.02 0.00 0.71 0.00 0.00 56.30 57.11 3fbu h ASN 49 Cb 0.14 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.10 3fbu h ASN 49 CO -0.01 0.31 -0.08 0.50 -1.29 0.00 0.00 177.43 176.86 3fbu h LYS 50 N 0.54 0.06 -0.62 6.67 3.64 -0.68 -2.80 116.57 123.38 3fbu h LYS 50 Ca 0.19 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3fbu h LYS 50 Cb 0.03 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3fbu h LYS 50 CO -0.09 0.15 0.00 0.09 -2.27 0.00 0.00 179.45 177.33 3fbu n ASN 51 N -4.41 5.30 0.08 4.20 3.02 -0.89 -4.16 115.26 118.41 3fbu n ASN 51 Ca -0.02 -2.85 0.07 0.00 -0.03 0.00 0.00 54.58 51.75 3fbu n ASN 51 Cb 0.18 -0.67 -0.03 0.00 -0.61 0.00 0.00 39.78 38.65 3fbu n ASN 51 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 3fbu h MET 52 N 3.61 0.00 0.00 3.52 2.86 -1.33 -3.39 114.93 120.20 3fbu h MET 52 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3fbu h MET 52 Cb 1.86 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.52 3fbu h MET 52 CO 0.45 0.12 0.00 0.41 1.06 0.00 0.00 176.91 178.96 3fbu n GLY 53 N 1.26 -2.15 0.00 8.32 0.00 -1.26 -4.90 105.19 106.46 3fbu n GLY 53 Ca -0.04 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.44 3fbu n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fbu n ALA 56 N -0.81 0.00 -0.22 4.61 0.00 -1.26 -5.10 120.51 117.73 3fbu n ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3fbu n ALA 56 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3fbu n ALA 56 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fbu n LYS 57 N 0.00 -0.52 -3.93 0.00 5.02 -1.26 -4.95 118.16 112.51 3fbu n LYS 57 Ca 0.00 -0.46 -0.13 0.00 -2.02 0.00 0.00 58.31 55.70 3fbu n LYS 57 Cb 0.00 -0.89 -0.14 0.00 -0.02 0.00 0.00 35.03 33.98 3fbu n LYS 57 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3fbu s ASN 58 N -0.06 0.14 -0.04 4.39 0.01 -1.26 -1.20 114.94 116.91 3fbu s ASN 58 Ca 0.00 -0.03 -0.02 0.00 -0.71 0.00 0.00 52.86 52.10 3fbu s ASN 58 Cb 0.00 -0.01 0.03 0.00 0.41 0.00 0.00 41.25 41.68 3fbu s ASN 58 CO 0.00 0.01 0.07 -0.36 -1.51 0.00 0.00 177.10 175.31 3fbu s PHE 59 N -0.06 0.02 0.58 2.20 0.08 0.66 -4.64 117.98 116.82 3fbu s PHE 59 Ca 0.00 0.30 -0.19 0.00 0.12 0.00 0.00 56.93 57.16 3fbu s PHE 59 Cb -0.01 -0.41 -0.04 0.00 -0.57 0.00 0.00 43.02 42.00 3fbu s PHE 59 CO -0.00 -0.19 1.19 -1.25 -0.10 0.00 0.00 175.22 174.87 3fbu s PRO 60 N 2.01 3.05 -0.22 0.24 0.04 -1.15 -0.59 135.00 138.39 3fbu s PRO 60 Ca 0.02 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 62.81 3fbu s PRO 60 Cb -0.12 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 3fbu s PRO 60 CO -0.03 -1.14 -0.04 0.08 0.04 0.00 0.00 177.00 175.90 3fbu s VAL 61 N -1.63 3.39 -0.15 -0.36 1.01 0.26 -2.51 120.40 120.40 3fbu s VAL 61 Ca 0.76 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 62.26 3fbu s VAL 61 Cb -0.29 -2.54 -0.00 0.00 0.00 0.00 0.00 36.38 33.55 3fbu s VAL 61 CO 0.32 0.43 -0.16 -0.63 0.00 0.00 0.00 175.10 175.06 3fbu s ILE 62 N 1.41 2.61 -0.04 2.22 -1.09 0.24 -1.59 121.20 124.96 3fbu s ILE 62 Ca 0.05 -0.79 -0.30 0.00 -2.23 0.00 0.00 60.65 57.38 3fbu s ILE 62 Cb -0.14 -2.09 -0.06 0.00 -1.58 0.00 0.00 42.46 38.59 3fbu s ILE 62 CO -0.03 0.52 1.60 -0.76 -1.23 0.00 0.00 174.94 175.04 3fbu s LEU 63 N 0.78 4.32 0.18 2.97 1.43 0.48 -0.75 118.68 128.09 3fbu s LEU 63 Ca -0.06 2.22 -0.30 0.00 -1.03 0.00 0.00 54.13 54.95 3fbu s LEU 63 Cb -0.15 -3.54 -0.09 0.00 0.03 0.00 0.00 46.19 42.44 3fbu s LEU 63 CO 0.00 -0.88 1.37 -0.63 0.23 0.00 0.00 176.35 176.44 3fbu s ILE 64 N 3.62 3.11 0.00 -0.59 1.01 -0.52 -0.54 121.20 127.30 3fbu s ILE 64 Ca 0.71 0.87 0.00 0.00 0.00 0.00 0.00 60.65 62.23 3fbu s ILE 64 Cb -0.33 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.58 3fbu s ILE 64 CO 0.29 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.94 3fbu n GLY 65 N 2.77 2.20 0.28 6.18 0.00 -1.26 -4.49 105.19 110.86 3fbu n GLY 65 Ca 0.08 -0.43 0.14 0.00 0.00 0.00 0.00 46.02 45.82 3fbu n GLY 65 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3fbu h GLU 66 N 0.00 0.00 -6.26 1.61 5.08 -1.97 -3.47 114.58 109.57 3fbu h GLU 66 Ca 0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 3fbu h GLU 66 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 3fbu h GLU 66 CO 0.00 0.08 -0.86 -1.71 -1.00 0.00 0.00 179.01 175.52 3fbu n ASN 67 N -3.58 -1.21 -4.31 1.42 5.15 0.30 -4.99 115.26 108.03 3fbu n ASN 67 Ca -0.02 -0.91 -0.32 0.00 -0.60 0.00 0.00 54.58 52.72 3fbu n ASN 67 Cb 0.20 -3.59 -0.15 0.00 -0.53 0.00 0.00 39.78 35.71 3fbu n ASN 67 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3fbu s ILE 68 N -3.77 2.55 -0.33 -1.44 1.01 -1.21 -4.91 121.20 113.11 3fbu s ILE 68 Ca 0.05 -0.86 -0.28 0.00 0.00 0.00 0.00 60.65 59.56 3fbu s ILE 68 Cb -0.02 -2.01 0.02 0.00 0.01 0.00 0.00 42.46 40.46 3fbu s ILE 68 CO 0.85 0.55 1.02 -0.22 0.00 0.00 0.00 174.94 177.14 3fbu s LEU 69 N 0.16 3.95 0.00 2.97 0.20 -1.26 -0.39 118.68 124.31 3fbu s LEU 69 Ca -0.10 0.93 0.12 0.00 0.69 0.00 0.00 54.13 55.77 3fbu s LEU 69 Cb -0.16 -3.45 -0.09 0.00 -0.43 0.00 0.00 46.19 42.06 3fbu s LEU 69 CO 0.06 -0.86 0.57 1.33 -0.29 0.00 0.00 176.35 177.17 3fbu n VAL 70 N 5.87 0.00 -3.16 1.68 0.24 -0.62 -4.90 118.33 117.44 3fbu n VAL 70 Ca 0.10 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 3fbu n VAL 70 Cb 0.47 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.89 3fbu n VAL 70 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fbu n GLY 71 N 1.20 -1.37 3.02 7.63 0.00 -1.24 -0.78 105.19 113.65 3fbu n GLY 71 Ca 0.03 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 3fbu n GLY 71 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3fbu s HIS 72 N -2.91 0.39 -0.17 1.61 -0.00 0.40 -0.58 115.29 114.04 3fbu s HIS 72 Ca 0.00 -0.65 -0.10 0.00 -0.00 0.00 0.00 55.06 54.31 3fbu s HIS 72 Cb 0.00 -0.27 -0.05 0.00 -0.00 0.00 0.00 32.58 32.26 3fbu s HIS 72 CO 0.00 -0.21 0.16 0.42 -0.00 0.00 0.00 174.74 175.11 3fbu s ILE 73 N -2.03 5.42 -0.18 -5.38 -1.09 0.25 -1.40 121.20 116.79 3fbu s ILE 73 Ca -0.09 0.25 -0.18 0.00 -2.23 0.00 0.00 60.65 58.40 3fbu s ILE 73 Cb -0.06 -3.47 -0.03 0.00 -1.58 0.00 0.00 42.46 37.31 3fbu s ILE 73 CO -0.03 0.49 0.50 -0.69 -1.23 0.00 0.00 174.94 173.99 3fbu s VAL 74 N -0.09 5.13 -0.25 2.92 1.01 0.09 -0.25 120.40 128.96 3fbu s VAL 74 Ca 0.12 0.94 -0.03 0.00 0.00 0.00 0.00 61.98 63.00 3fbu s VAL 74 Cb -0.12 -3.83 0.14 0.00 0.00 0.00 0.00 36.38 32.58 3fbu s VAL 74 CO 0.01 0.22 0.46 0.12 0.00 0.00 0.00 175.10 175.90 3fbu s PHE 75 N 1.37 -1.06 0.16 5.22 5.36 -0.34 -1.23 117.98 127.47 3fbu s PHE 75 Ca 0.24 1.24 -0.19 0.00 -0.96 0.00 0.00 56.93 57.26 3fbu s PHE 75 Cb -0.15 0.25 0.05 0.00 -0.34 0.00 0.00 43.02 42.82 3fbu s PHE 75 CO 0.10 -0.73 0.51 -3.38 -1.46 0.00 0.00 175.22 170.26 3fbu s HIS 76 N 2.66 -0.31 0.29 10.12 -3.43 -0.86 -4.58 115.29 119.18 3fbu s HIS 76 Ca 0.12 0.02 -0.29 0.00 -0.80 0.00 0.00 55.06 54.11 3fbu s HIS 76 Cb -0.15 0.41 -0.13 0.00 -1.43 0.00 0.00 32.58 31.28 3fbu s HIS 76 CO -0.17 -0.81 1.24 1.63 -2.00 0.00 0.00 174.74 174.63 3fbu n LYS 77 N -0.31 1.85 0.01 -0.38 5.02 -1.26 -0.95 118.16 122.15 3fbu n LYS 77 Ca -0.15 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 3fbu n LYS 77 Cb 0.64 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 3fbu n LYS 77 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3fbu n TYR 78 N 0.77 -0.07 -3.71 2.13 9.36 0.00 -4.68 117.16 120.97 3fbu n TYR 78 Ca 0.08 0.01 -0.28 0.00 3.32 0.00 0.00 57.90 61.04 3fbu n TYR 78 Cb 0.33 0.05 -0.16 0.00 -0.63 0.00 0.00 39.34 38.93 3fbu n TYR 78 CO 0.00 0.00 0.00 0.12 0.22 0.00 0.00 176.86 177.20 3fbu s PHE 79 N -2.00 0.94 0.00 2.98 5.36 -0.59 -5.01 117.98 119.66 3fbu s PHE 79 Ca 0.00 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.11 3fbu s PHE 79 Cb 0.00 -1.03 0.00 0.00 -0.34 0.00 0.00 43.02 41.65 3fbu s PHE 79 CO 0.00 -0.63 0.00 0.41 -1.46 0.00 0.00 175.22 173.54 3fbu n GLY 80 N 5.07 1.25 0.80 13.12 0.00 -1.26 -2.43 105.19 121.74 3fbu n GLY 80 Ca -0.08 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.49 3fbu n GLY 80 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fbu n GLU 81 N 1.89 1.95 0.01 1.61 1.02 -1.26 -4.49 120.64 121.37 3fbu n GLU 81 Ca 0.00 -1.61 0.11 0.00 -0.02 0.00 0.00 57.16 55.64 3fbu n GLU 81 Cb 0.00 -1.47 -0.10 0.00 -0.02 0.00 0.00 31.44 29.85 3fbu n GLU 81 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 3fbu n HIS 82 N 0.88 0.14 -4.17 -0.32 1.44 -1.20 -4.87 115.22 107.13 3fbu n HIS 82 Ca 0.12 0.04 -0.25 0.00 -2.01 0.00 0.00 57.72 55.63 3fbu n HIS 82 Cb 0.55 -0.42 -0.17 0.00 0.12 0.00 0.00 29.99 30.08 3fbu n HIS 82 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 3fbu s THR 83 N -3.33 0.96 0.31 0.61 2.01 -1.02 -0.86 115.64 114.32 3fbu s THR 83 Ca -0.01 -0.31 0.10 0.00 0.31 0.00 0.00 61.69 61.77 3fbu s THR 83 Cb 0.14 -0.95 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 3fbu s THR 83 CO 0.87 0.34 -0.01 -0.31 -0.69 0.00 0.00 174.62 174.82 3fbu s TYR 84 N 1.26 2.58 -0.04 4.92 4.12 -0.91 -0.82 117.35 128.47 3fbu s TYR 84 Ca -0.04 -0.34 0.04 0.00 0.02 0.00 0.00 57.07 56.75 3fbu s TYR 84 Cb -0.14 -1.33 -0.03 0.00 -1.52 0.00 0.00 41.96 38.94 3fbu s TYR 84 CO -0.03 0.55 -0.15 -2.00 0.02 0.00 0.00 175.55 173.93 3fbu s GLU 85 N -3.69 2.43 0.13 -0.62 2.12 -0.12 -0.75 118.70 118.19 3fbu s GLU 85 Ca 0.33 -0.74 0.09 0.00 0.36 0.00 0.00 54.97 55.01 3fbu s GLU 85 Cb -0.03 -2.33 -0.04 0.00 0.26 0.00 0.00 34.13 31.99 3fbu s GLU 85 CO 0.19 0.61 -0.23 -1.50 -0.54 0.00 0.00 175.26 173.80 3fbu s ILE 86 N -0.75 1.97 0.14 -3.70 2.07 -0.13 -2.04 121.20 118.76 3fbu s ILE 86 Ca 0.12 -1.72 -0.07 0.00 -1.41 0.00 0.00 60.65 57.57 3fbu s ILE 86 Cb -0.11 -1.80 0.03 0.00 0.13 0.00 0.00 42.46 40.72 3fbu s ILE 86 CO 0.01 -0.06 0.37 0.61 -1.91 0.00 0.00 174.94 173.96 3fbu n GLY 87 N 0.83 1.38 3.63 1.50 0.00 -0.36 -4.49 105.19 107.68 3fbu n GLY 87 Ca -0.17 -1.08 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 3fbu n GLY 87 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3fbu s TRP 88 N -5.53 -0.55 -0.06 1.61 -2.14 -1.26 -0.73 118.94 110.28 3fbu s TRP 88 Ca 0.08 1.32 -0.02 0.00 2.66 0.00 0.00 56.10 60.13 3fbu s TRP 88 Cb -0.02 0.34 0.04 0.00 -3.10 0.00 0.00 33.47 30.73 3fbu s TRP 88 CO 0.04 -0.27 0.11 0.08 -2.66 0.00 0.00 176.95 174.25 3fbu s VAL 89 N 0.19 -0.14 0.18 -0.66 1.01 -0.49 -4.96 120.40 115.53 3fbu s VAL 89 Ca 0.02 0.31 0.07 0.00 0.00 0.00 0.00 61.98 62.39 3fbu s VAL 89 Cb -0.05 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 3fbu s VAL 89 CO -0.04 0.13 -0.14 -0.36 0.00 0.00 0.00 175.10 174.69 3fbu s PHE 90 N 1.82 1.62 -0.12 5.22 0.40 -1.26 -0.45 117.98 125.20 3fbu s PHE 90 Ca -0.01 -0.59 -0.30 0.00 -0.60 0.00 0.00 56.93 55.43 3fbu s PHE 90 Cb -0.12 -0.77 -0.02 0.00 0.51 0.00 0.00 43.02 42.62 3fbu s PHE 90 CO -0.05 0.29 1.12 1.21 0.70 0.00 0.00 175.22 178.50 3fbu s ASN 91 N -3.14 7.10 0.59 1.36 3.84 0.04 -4.94 114.94 119.78 3fbu s ASN 91 Ca 0.20 1.63 0.29 0.00 0.21 0.00 0.00 52.86 55.19 3fbu s ASN 91 Cb -0.01 -2.55 1.63 0.00 -0.55 0.00 0.00 41.25 39.77 3fbu s ASN 91 CO 0.05 -0.59 2.05 -0.65 -2.79 0.00 0.00 177.10 175.18 3fbu h PRO 92 N 7.47 0.00 -0.11 0.43 0.11 -1.95 0.13 132.00 138.08 3fbu h PRO 92 Ca -0.29 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.85 3fbu h PRO 92 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3fbu h PRO 92 CO 0.90 0.00 0.17 0.87 -0.21 0.00 0.00 178.00 179.73 3fbu h LYS 93 N 0.00 0.00 -0.13 1.05 1.57 -1.96 -2.86 116.57 114.24 3fbu h LYS 93 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3fbu h LYS 93 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 3fbu h LYS 93 CO -0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 3fbu n TYR 94 N -3.53 0.28 -1.44 -1.35 4.01 0.45 -5.05 117.16 110.53 3fbu n TYR 94 Ca -0.00 -0.68 -0.33 0.00 -0.16 0.00 0.00 57.90 56.73 3fbu n TYR 94 Cb 0.27 -0.11 0.09 0.00 -0.31 0.00 0.00 39.34 39.27 3fbu n TYR 94 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3fbu s PHE 95 N -1.74 2.22 -1.58 -0.72 0.08 -1.08 -3.92 117.98 111.24 3fbu s PHE 95 Ca 0.20 1.60 0.00 0.00 0.12 0.00 0.00 56.93 58.86 3fbu s PHE 95 Cb 0.15 -3.33 0.00 0.00 -0.57 0.00 0.00 43.02 39.27 3fbu s PHE 95 CO 0.06 -2.29 0.00 0.09 -0.10 0.00 0.00 175.22 172.99 3fbu n ASN 96 N -2.85 -5.32 -0.30 1.36 3.02 -1.26 -4.84 115.26 105.07 3fbu n ASN 96 Ca 0.12 -0.01 0.03 0.00 -0.03 0.00 0.00 54.58 54.70 3fbu n ASN 96 Cb 0.51 -4.38 0.05 0.00 -0.61 0.00 0.00 39.78 35.35 3fbu n ASN 96 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3fbu n LYS 97 N -2.75 0.78 -0.61 3.52 5.02 -1.25 -5.00 118.16 117.86 3fbu n LYS 97 Ca -0.22 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 54.91 3fbu n LYS 97 Cb 0.66 -1.14 0.00 0.00 -0.02 0.00 0.00 35.03 34.54 3fbu n LYS 97 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fbu n GLY 98 N 0.30 0.71 0.13 0.72 0.00 -1.26 -4.97 105.19 100.81 3fbu n GLY 98 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 3fbu n GLY 98 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3fbu h TYR 99 N 0.00 0.38 -0.37 1.61 0.05 -1.95 -0.96 116.97 115.73 3fbu h TYR 99 Ca 0.00 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.70 3fbu h TYR 99 Cb 0.00 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 3fbu h TYR 99 CO 0.00 0.60 0.23 0.00 -1.05 0.00 0.00 178.16 177.94 3fbu h ALA 100 N 0.73 0.48 -0.59 3.88 0.00 -1.93 -0.19 119.26 121.63 3fbu h ALA 100 Ca 0.05 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3fbu h ALA 100 Cb 0.47 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3fbu h ALA 100 CO 0.02 -0.03 0.01 0.77 0.00 0.00 0.00 179.25 180.01 3fbu h SER 101 N 0.49 0.99 -0.36 0.00 0.02 -1.91 0.77 113.55 113.55 3fbu h SER 101 Ca 0.13 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.80 3fbu h SER 101 Cb 0.00 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 3fbu h SER 101 CO -0.03 1.04 0.17 -0.08 -1.14 0.00 0.00 176.83 176.79 3fbu h GLU 102 N 0.94 0.53 -0.48 3.45 4.81 -0.93 1.00 114.58 123.88 3fbu h GLU 102 Ca 0.17 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.23 3fbu h GLU 102 Cb 0.53 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 3fbu h GLU 102 CO 0.03 0.49 -0.03 0.00 -0.73 0.00 0.00 179.01 178.76 3fbu h ALA 103 N 1.01 0.66 -0.25 2.92 0.00 -0.78 -2.35 119.26 120.47 3fbu h ALA 103 Ca 0.12 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 3fbu h ALA 103 Cb 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3fbu h ALA 103 CO -0.01 0.49 -0.55 0.00 0.00 0.00 0.00 179.25 179.18 3fbu h ALA 104 N 0.91 0.57 -0.31 0.00 0.00 -0.70 -1.13 119.26 118.60 3fbu h ALA 104 Ca 0.13 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.55 3fbu h ALA 104 Cb 0.56 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3fbu h ALA 104 CO 0.03 0.68 0.14 0.37 0.00 0.00 0.00 179.25 180.48 3fbu h GLN 105 N 0.57 0.29 -0.80 0.00 4.15 -0.75 -1.41 115.11 117.16 3fbu h GLN 105 Ca 0.01 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 3fbu h GLN 105 Cb 1.13 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.72 3fbu h GLN 105 CO 0.11 0.19 0.47 0.00 -1.93 0.00 0.00 178.83 177.68 3fbu h ALA 106 N 1.17 1.32 -0.30 3.38 0.00 -1.25 -1.96 119.26 121.62 3fbu h ALA 106 Ca 0.13 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3fbu h ALA 106 Cb 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3fbu h ALA 106 CO -0.10 0.58 0.02 1.15 0.00 0.00 0.00 179.25 180.89 3fbu h THR 107 N 1.11 1.25 -0.48 0.00 2.02 -0.80 -1.91 112.91 114.11 3fbu h THR 107 Ca 0.29 -0.89 0.06 0.00 0.77 0.00 0.00 66.41 66.64 3fbu h THR 107 Cb -0.03 1.24 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 3fbu h THR 107 CO -0.05 0.29 0.17 -0.07 0.37 0.00 0.00 175.52 176.23 3fbu h LEU 108 N 0.33 0.19 -0.37 2.58 3.38 -1.01 0.11 115.31 120.51 3fbu h LEU 108 Ca 0.09 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.13 3fbu h LEU 108 Cb 0.40 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 3fbu h LEU 108 CO 0.01 0.14 0.21 0.11 0.09 0.00 0.00 178.44 179.00 3fbu h LYS 109 N 0.35 0.41 -0.30 1.13 1.57 -1.26 -0.62 116.57 117.86 3fbu h LYS 109 Ca 0.23 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.99 3fbu h LYS 109 Cb 0.23 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3fbu h LYS 109 CO -0.23 0.27 0.17 -0.92 -0.57 0.00 0.00 179.45 178.17 3fbu h TYR 110 N 0.42 0.31 -0.55 -1.35 3.20 -0.99 0.89 116.97 118.90 3fbu h TYR 110 Ca 0.15 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.08 3fbu h TYR 110 Cb 0.02 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.15 3fbu h TYR 110 CO -0.08 0.18 0.29 0.78 -1.64 0.00 0.00 178.16 177.69 3fbu h GLY 111 N 0.35 0.79 0.67 1.82 0.00 -0.24 -0.45 103.07 106.01 3fbu h GLY 111 Ca 0.12 -0.20 -0.24 0.00 0.00 0.00 0.00 47.33 47.01 3fbu h GLY 111 CO -0.06 0.12 -1.14 0.74 0.00 0.00 0.00 176.54 176.20 3fbu h PHE 112 N 0.55 0.53 0.09 5.60 0.04 -1.00 -1.36 116.94 121.39 3fbu h PHE 112 Ca 0.25 -0.39 -0.12 0.00 2.80 0.00 0.00 57.97 60.50 3fbu h PHE 112 Cb 0.15 -0.02 0.01 0.00 2.20 0.00 0.00 35.95 38.29 3fbu h PHE 112 CO -0.10 1.44 -0.54 0.87 -0.60 0.00 0.00 178.31 179.38 3fbu h LYS 113 N -0.30 0.21 0.06 1.51 1.57 -0.87 -3.03 116.57 115.71 3fbu h LYS 113 Ca -0.23 -0.34 -0.38 0.00 -1.87 0.00 0.00 60.65 57.83 3fbu h LYS 113 Cb 1.74 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 34.13 3fbu h LYS 113 CO 0.12 1.16 -2.25 0.39 -0.57 0.00 0.00 179.45 178.30 3fbu n GLU 114 N -4.29 0.70 0.00 3.15 -0.58 -0.27 -4.28 120.64 115.08 3fbu n GLU 114 Ca -0.12 0.20 0.12 0.00 -0.42 0.00 0.00 57.16 56.93 3fbu n GLU 114 Cb 0.71 -1.61 0.25 0.00 -0.57 0.00 0.00 31.44 30.22 3fbu n GLU 114 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3fbu n MET 115 N -3.34 0.05 -3.70 3.49 2.81 -0.66 -4.97 117.12 110.79 3fbu n MET 115 Ca -0.39 -0.03 -0.27 0.00 -1.81 0.00 0.00 57.70 55.21 3fbu n MET 115 Cb 1.02 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 32.09 3fbu n MET 115 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3fbu n LYS 116 N -1.45 -6.73 -1.61 0.03 5.02 -0.61 -4.94 118.16 107.87 3fbu n LYS 116 Ca 0.06 0.73 -0.32 0.00 -2.02 0.00 0.00 58.31 56.76 3fbu n LYS 116 Cb 0.34 -5.70 0.05 0.00 -0.02 0.00 0.00 35.03 29.70 3fbu n LYS 116 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3fbu s LEU 117 N -7.26 3.24 -0.09 -0.35 1.43 -0.62 -4.99 118.68 110.02 3fbu s LEU 117 Ca 0.61 1.82 0.01 0.00 -1.03 0.00 0.00 54.13 55.54 3fbu s LEU 117 Cb -0.29 -4.53 -0.25 0.00 0.03 0.00 0.00 46.19 41.16 3fbu s LEU 117 CO 0.75 -1.63 0.48 1.57 0.23 0.00 0.00 176.35 177.75 3fbu n HIS 118 N -2.85 1.13 -3.64 0.29 -0.00 -0.04 -4.64 115.22 105.47 3fbu n HIS 118 Ca 0.09 0.30 -0.15 0.00 -0.00 0.00 0.00 57.72 57.96 3fbu n HIS 118 Cb 0.53 -1.17 -0.08 0.00 -0.00 0.00 0.00 29.99 29.27 3fbu n HIS 118 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 3fbu s ARG 119 N -2.57 0.82 -0.03 1.57 3.52 -1.06 -1.23 118.95 119.96 3fbu s ARG 119 Ca -0.15 0.41 0.02 0.00 -0.13 0.00 0.00 55.73 55.88 3fbu s ARG 119 Cb 0.07 0.39 0.01 0.00 -1.56 0.00 0.00 34.95 33.85 3fbu s ARG 119 CO 0.79 -0.19 -0.09 0.42 -0.81 0.00 0.00 175.30 175.42 3fbu s ILE 120 N -0.56 0.77 0.29 4.11 1.01 -0.32 -2.13 121.20 124.37 3fbu s ILE 120 Ca -0.07 -0.33 0.08 0.00 0.00 0.00 0.00 60.65 60.33 3fbu s ILE 120 Cb -0.03 -0.70 -0.06 0.00 0.01 0.00 0.00 42.46 41.68 3fbu s ILE 120 CO 0.05 0.25 -0.10 0.27 0.00 0.00 0.00 174.94 175.41 3fbu s ILE 121 N 0.32 1.96 0.03 2.92 -5.25 0.07 -0.70 121.20 120.56 3fbu s ILE 121 Ca -0.05 -2.20 -0.17 0.00 -0.99 0.00 0.00 60.65 57.23 3fbu s ILE 121 Cb -0.10 -2.44 0.03 0.00 2.95 0.00 0.00 42.46 42.90 3fbu s ILE 121 CO 0.01 -0.32 0.38 0.00 -1.79 0.00 0.00 174.94 173.22 3fbu s ALA 122 N -2.81 -0.93 0.10 2.27 0.00 -0.46 -0.96 121.76 118.96 3fbu s ALA 122 Ca 0.30 0.29 0.04 0.00 0.00 0.00 0.00 51.96 52.59 3fbu s ALA 122 Cb 0.02 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 3fbu s ALA 122 CO 0.13 -0.41 -0.10 0.95 0.00 0.00 0.00 175.76 176.33 3fbu s THR 123 N -2.24 0.94 0.16 0.00 -4.23 -1.26 -0.64 115.64 108.37 3fbu s THR 123 Ca -0.07 -1.63 -0.24 0.00 -1.18 0.00 0.00 61.69 58.57 3fbu s THR 123 Cb -0.01 -1.35 0.06 0.00 1.34 0.00 0.00 72.50 72.54 3fbu s THR 123 CO -0.01 -0.55 0.83 0.00 -0.54 0.00 0.00 174.62 174.35 3fbu s GLN 125 N -3.50 4.45 0.59 0.00 1.11 -1.26 0.62 119.66 121.66 3fbu s GLN 125 Ca 0.09 1.81 0.29 0.00 0.01 0.00 0.00 55.36 57.55 3fbu s GLN 125 Cb -0.03 -3.00 1.74 0.00 -1.01 0.00 0.00 33.01 30.72 3fbu s GLN 125 CO -0.01 0.03 2.20 -1.35 0.01 0.00 0.00 175.29 176.18 3fbu h PRO 126 N 3.38 0.00 0.00 2.91 0.11 -1.92 0.29 132.00 136.77 3fbu h PRO 126 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3fbu h PRO 126 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3fbu h PRO 126 CO 0.65 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.37 3fbu h GLU 127 N 0.00 0.00 -3.54 1.05 3.07 -1.95 -3.38 114.58 109.82 3fbu h GLU 127 Ca 0.03 0.00 -0.76 0.00 -0.50 0.00 0.00 59.36 58.13 3fbu h GLU 127 Cb 0.16 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 27.90 3fbu h GLU 127 CO -0.00 0.00 1.79 -1.71 -1.40 0.00 0.00 179.01 177.69 3fbu n ASN 128 N -2.66 5.27 -0.16 1.42 2.85 0.09 -4.84 115.26 117.23 3fbu n ASN 128 Ca 0.02 -3.14 -0.04 0.00 -0.11 0.00 0.00 54.58 51.31 3fbu n ASN 128 Cb 0.30 -1.46 0.05 0.00 1.24 0.00 0.00 39.78 39.91 3fbu n ASN 128 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3fbu h THR 129 N 3.78 0.93 0.00 -0.44 2.02 -1.82 -1.58 112.91 115.80 3fbu h THR 129 Ca 0.36 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 67.34 3fbu h THR 129 Cb 0.65 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 3fbu h THR 129 CO 1.55 0.08 -0.21 1.55 0.37 0.00 0.00 175.52 178.86 3fbu h PRO 130 N 0.44 0.00 -0.00 6.66 0.13 -1.97 -1.44 132.00 135.83 3fbu h PRO 130 Ca 0.22 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.35 3fbu h PRO 130 Cb 0.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.29 3fbu h PRO 130 CO -0.17 0.21 -0.00 1.03 -0.23 0.00 0.00 178.00 178.84 3fbu h SER 131 N 0.00 0.00 1.13 1.44 0.87 -1.69 -1.81 113.55 113.50 3fbu h SER 131 Ca -0.00 -0.35 -0.02 0.00 -1.23 0.00 0.00 61.79 60.19 3fbu h SER 131 Cb 0.38 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 3fbu h SER 131 CO 0.03 0.35 -0.11 0.10 -0.53 0.00 0.00 176.83 176.66 3fbu h TYR 132 N -0.34 0.00 -0.55 2.24 -0.00 -1.35 -2.30 116.97 114.67 3fbu h TYR 132 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 58.63 3fbu h TYR 132 Cb 0.35 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.06 3fbu h TYR 132 CO 0.04 0.11 -0.04 0.00 -0.00 0.00 0.00 178.16 178.28 3fbu h ARG 133 N 0.00 0.97 -0.53 0.10 2.47 -1.11 -1.20 114.38 115.08 3fbu h ARG 133 Ca -0.00 -0.31 0.03 0.00 -1.26 0.00 0.00 59.98 58.43 3fbu h ARG 133 Cb 0.71 -0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 28.91 3fbu h ARG 133 CO 0.01 0.98 0.31 0.28 0.56 0.00 0.00 179.97 182.12 3fbu h VAL 134 N 0.88 1.04 -0.54 2.04 2.07 -0.79 -0.88 116.25 120.06 3fbu h VAL 134 Ca 0.15 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.51 3fbu h VAL 134 Cb 0.58 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.67 3fbu h VAL 134 CO 0.03 0.11 0.28 0.24 0.02 0.00 0.00 177.57 178.25 3fbu h MET 135 N 0.62 0.52 -0.28 1.57 2.86 -0.99 -1.85 114.93 117.38 3fbu h MET 135 Ca 0.22 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.78 3fbu h MET 135 Cb 0.04 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 3fbu h MET 135 CO -0.10 0.34 -0.02 0.93 1.06 0.00 0.00 176.91 179.12 3fbu h GLU 136 N 0.53 0.50 -0.56 1.72 5.08 -0.98 -1.29 114.58 119.59 3fbu h GLU 136 Ca 0.24 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 3fbu h GLU 136 Cb 0.16 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3fbu h GLU 136 CO -0.17 0.67 0.37 0.87 -1.00 0.00 0.00 179.01 179.76 3fbu h LYS 137 N 0.28 0.62 -0.14 2.33 1.57 -0.72 -1.49 116.57 119.02 3fbu h LYS 137 Ca 0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3fbu h LYS 137 Cb 0.46 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3fbu h LYS 137 CO 0.02 0.41 0.00 0.44 -0.57 0.00 0.00 179.45 179.75 3fbu n ILE 138 N -4.47 0.18 0.00 1.86 -5.35 -0.74 -4.92 119.36 105.92 3fbu n ILE 138 Ca 0.07 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 3fbu n ILE 138 Cb 0.15 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 3fbu n ILE 138 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fbu n GLY 139 N 1.16 0.97 3.81 3.28 0.00 -0.56 -4.96 105.19 108.89 3fbu n GLY 139 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3fbu n GLY 139 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3fbu s MET 140 N -0.78 4.06 -0.11 1.61 -1.94 -0.50 -4.85 119.30 116.80 3fbu s MET 140 Ca 0.00 1.21 -0.02 0.00 -1.71 0.00 0.00 55.69 55.17 3fbu s MET 140 Cb 0.00 -2.15 -0.03 0.00 2.01 0.00 0.00 34.83 34.66 3fbu s MET 140 CO 0.00 -0.19 -0.02 1.03 -0.01 0.00 0.00 175.02 175.83 3fbu s ARG 141 N -3.21 3.18 -0.31 2.03 0.52 0.13 -4.42 118.95 116.87 3fbu s ARG 141 Ca 0.64 -0.46 -0.29 0.00 -0.52 0.00 0.00 55.73 55.10 3fbu s ARG 141 Cb -0.12 -2.81 -0.01 0.00 0.52 0.00 0.00 34.95 32.54 3fbu s ARG 141 CO 0.16 0.55 1.51 0.50 0.02 0.00 0.00 175.30 178.04 3fbu s ARG 142 N -0.46 3.70 -0.03 3.54 3.52 -1.26 -0.97 118.95 126.98 3fbu s ARG 142 Ca 0.08 1.33 0.18 0.00 -0.13 0.00 0.00 55.73 57.19 3fbu s ARG 142 Cb -0.12 -4.02 -0.28 0.00 -1.56 0.00 0.00 34.95 28.97 3fbu s ARG 142 CO 0.02 -1.41 0.39 0.39 -0.81 0.00 0.00 175.30 173.89 3fbu n GLU 143 N 7.80 0.58 -3.77 5.12 1.02 0.80 -4.98 120.64 127.21 3fbu n GLU 143 Ca 0.18 -0.16 -0.12 0.00 -0.02 0.00 0.00 57.16 57.03 3fbu n GLU 143 Cb 0.47 -1.44 -0.08 0.00 -0.02 0.00 0.00 31.44 30.37 3fbu n GLU 143 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3fbu s GLY 144 N -4.16 -0.11 -0.28 0.62 0.00 -0.82 -4.99 107.32 97.57 3fbu s GLY 144 Ca -0.07 0.06 -0.04 0.00 0.00 0.00 0.00 44.72 44.68 3fbu s GLY 144 CO 0.77 -0.15 0.14 -0.47 0.00 0.00 0.00 173.10 173.39 3fbu s TYR 145 N -2.21 0.23 -0.23 1.90 5.04 -1.26 -0.87 117.35 119.95 3fbu s TYR 145 Ca -0.07 -0.76 -0.10 0.00 -2.44 0.00 0.00 57.07 53.70 3fbu s TYR 145 Cb -0.02 -0.84 -0.05 0.00 0.35 0.00 0.00 41.96 41.40 3fbu s TYR 145 CO -0.01 -0.81 0.13 -0.06 -1.34 0.00 0.00 175.55 173.46 3fbu s PHE 146 N 2.13 3.30 -0.18 4.97 0.08 0.28 -4.96 117.98 123.59 3fbu s PHE 146 Ca 0.09 0.16 -0.19 0.00 0.12 0.00 0.00 56.93 57.11 3fbu s PHE 146 Cb -0.16 -2.23 -0.03 0.00 -0.57 0.00 0.00 43.02 40.03 3fbu s PHE 146 CO -0.34 0.07 0.52 0.15 -0.10 0.00 0.00 175.22 175.51 3fbu s LYS 147 N 0.93 4.23 -1.34 0.44 1.02 -1.26 -1.04 119.74 122.72 3fbu s LYS 147 Ca 0.07 0.44 -0.00 0.00 0.02 0.00 0.00 55.97 56.50 3fbu s LYS 147 Cb -0.13 -3.53 0.00 0.00 -0.52 0.00 0.00 37.83 33.65 3fbu s LYS 147 CO 0.03 -0.08 0.61 1.63 -0.92 0.00 0.00 175.35 176.62 3fbu n LYS 148 N 4.54 -4.38 -0.01 1.68 5.02 -1.23 -4.89 118.16 118.90 3fbu n LYS 148 Ca -0.05 0.55 0.09 0.00 -2.02 0.00 0.00 58.31 56.88 3fbu n LYS 148 Cb 0.51 -4.97 -0.13 0.00 -0.02 0.00 0.00 35.03 30.42 3fbu n LYS 148 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fbu s ILE 150 N -3.18 3.94 -0.22 0.00 1.01 -0.73 -4.93 121.20 117.09 3fbu s ILE 150 Ca -0.06 -0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.05 3fbu s ILE 150 Cb 0.11 -2.79 -0.01 0.00 0.01 0.00 0.00 42.46 39.78 3fbu s ILE 150 CO 0.73 0.42 0.75 -2.16 0.00 0.00 0.00 174.94 174.68 3fbu s PRO 151 N 1.11 4.20 -0.28 2.79 0.04 -1.26 -0.47 135.00 141.13 3fbu s PRO 151 Ca 0.03 0.81 -0.00 0.00 0.04 0.00 0.00 61.00 61.88 3fbu s PRO 151 Cb -0.14 -3.62 0.08 0.00 0.04 0.00 0.00 34.50 30.86 3fbu s PRO 151 CO 0.01 -0.40 0.05 -1.58 0.04 0.00 0.00 177.00 175.13 3fbu s HIS 152 N 2.43 1.93 0.00 0.56 2.46 0.20 -4.96 115.29 117.91 3fbu s HIS 152 Ca 0.33 -1.70 0.00 0.00 0.47 0.00 0.00 55.06 54.15 3fbu s HIS 152 Cb -0.16 -1.68 0.00 0.00 -0.13 0.00 0.00 32.58 30.61 3fbu s HIS 152 CO 0.09 -0.81 0.00 0.41 -2.47 0.00 0.00 174.74 171.96 3fbu n GLY 153 N 4.79 2.80 2.21 1.59 0.00 -1.26 -0.59 105.19 114.73 3fbu n GLY 153 Ca -0.05 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 3fbu n GLY 153 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fbu n ASN 154 N 4.54 5.99 -4.46 1.61 3.02 -1.26 -4.96 115.26 119.75 3fbu n ASN 154 Ca 0.00 -3.73 -0.25 0.00 -0.03 0.00 0.00 54.58 50.56 3fbu n ASN 154 Cb 0.00 -0.88 -0.11 0.00 -0.61 0.00 0.00 39.78 38.19 3fbu n ASN 154 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3fbu s GLU 155 N -3.62 1.64 -0.23 3.52 0.41 0.25 -5.14 118.70 115.54 3fbu s GLU 155 Ca 0.60 -1.62 -0.02 0.00 -0.41 0.00 0.00 54.97 53.52 3fbu s GLU 155 Cb 0.49 -1.84 0.01 0.00 -1.78 0.00 0.00 34.13 31.01 3fbu s GLU 155 CO 0.03 0.37 -0.07 -1.58 -0.49 0.00 0.00 175.26 173.52 3fbu s TRP 156 N -2.08 2.98 0.17 1.61 0.52 -1.25 0.58 118.94 121.47 3fbu s TRP 156 Ca 0.25 -1.32 0.03 0.00 0.02 0.00 0.00 56.10 55.09 3fbu s TRP 156 Cb -0.07 -2.06 -0.03 0.00 -1.15 0.00 0.00 33.47 30.16 3fbu s TRP 156 CO 0.13 -0.67 0.30 -1.58 0.02 0.00 0.00 176.95 175.15 3fbu s TRP 157 N 1.38 3.48 0.66 -1.98 0.51 0.37 -4.66 118.94 118.70 3fbu s TRP 157 Ca 0.03 0.09 -0.09 0.00 -2.12 0.00 0.00 56.10 54.01 3fbu s TRP 157 Cb -0.15 -1.65 0.01 0.00 -0.81 0.00 0.00 33.47 30.87 3fbu s TRP 157 CO -0.05 0.50 1.02 -0.51 -0.51 0.00 0.00 176.95 177.39 3fbu s ASP 158 N -3.40 5.49 -0.06 2.95 1.01 -1.26 -1.13 116.67 120.28 3fbu s ASP 158 Ca 0.34 0.95 -0.03 0.00 0.71 0.00 0.00 52.55 54.52 3fbu s ASP 158 Cb -0.11 -1.82 0.03 0.00 1.01 0.00 0.00 42.92 42.03 3fbu s ASP 158 CO 0.29 -1.23 0.14 -0.70 0.21 0.00 0.00 175.17 173.87 3fbu s GLU 159 N -5.21 0.11 0.14 8.23 2.12 -0.20 -4.41 118.70 119.48 3fbu s GLU 159 Ca 0.56 0.31 -0.16 0.00 0.36 0.00 0.00 54.97 56.04 3fbu s GLU 159 Cb -0.11 -0.10 -0.07 0.00 0.26 0.00 0.00 34.13 34.11 3fbu s GLU 159 CO 0.49 -0.12 0.57 0.71 -0.54 0.00 0.00 175.26 176.37 3fbu s TYR 160 N 0.81 3.65 -0.15 5.30 2.02 0.20 -0.56 117.35 128.63 3fbu s TYR 160 Ca -0.06 1.14 0.01 0.00 -0.37 0.00 0.00 57.07 57.79 3fbu s TYR 160 Cb -0.08 -2.42 0.02 0.00 -0.40 0.00 0.00 41.96 39.07 3fbu s TYR 160 CO -0.04 0.45 -0.18 -0.47 -1.57 0.00 0.00 175.55 173.74 3fbu s TYR 161 N -1.40 2.46 0.16 2.71 5.04 -0.05 -1.61 117.35 124.66 3fbu s TYR 161 Ca 0.36 -1.34 0.08 0.00 -2.44 0.00 0.00 57.07 53.73 3fbu s TYR 161 Cb -0.16 -1.73 -0.04 0.00 0.35 0.00 0.00 41.96 40.38 3fbu s TYR 161 CO 0.19 -0.67 -0.11 0.71 -1.34 0.00 0.00 175.55 174.34 3fbu s TYR 162 N 1.17 2.65 0.03 4.97 1.51 0.18 -0.14 117.35 127.72 3fbu s TYR 162 Ca 0.00 -0.21 -0.13 0.00 -1.01 0.00 0.00 57.07 55.72 3fbu s TYR 162 Cb -0.14 -1.33 0.02 0.00 -0.11 0.00 0.00 41.96 40.40 3fbu s TYR 162 CO -0.08 0.48 0.28 0.00 -1.11 0.00 0.00 175.55 175.11 3fbu s ALA 163 N -1.52 -0.62 0.00 3.71 0.00 -0.15 -1.36 121.76 121.83 3fbu s ALA 163 Ca 0.23 -0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.20 3fbu s ALA 163 Cb -0.10 0.26 -0.00 0.00 0.00 0.00 0.00 23.12 23.28 3fbu s ALA 163 CO 0.14 -0.37 -0.02 -1.50 0.00 0.00 0.00 175.76 174.01 3fbu s ILE 164 N -2.29 0.18 0.16 0.00 2.07 0.12 -0.70 121.20 120.75 3fbu s ILE 164 Ca -0.07 -0.20 0.04 0.00 -1.41 0.00 0.00 60.65 59.01 3fbu s ILE 164 Cb -0.02 -0.18 -0.04 0.00 0.13 0.00 0.00 42.46 42.35 3fbu s ILE 164 CO -0.02 -0.02 0.17 -0.76 -1.91 0.00 0.00 174.94 172.41 3fbu s LEU 165 N -0.24 3.93 0.43 8.50 1.43 -1.26 -1.17 118.68 130.30 3fbu s LEU 165 Ca -0.01 -0.06 0.21 0.00 -1.03 0.00 0.00 54.13 53.24 3fbu s LEU 165 Cb -0.02 -2.53 1.17 0.00 0.03 0.00 0.00 46.19 44.84 3fbu s LEU 165 CO -0.00 0.06 1.81 1.05 0.23 0.00 0.00 176.35 179.50 3fbu h GLU 166 N 2.33 0.32 0.00 1.70 4.11 -1.43 -1.52 114.58 120.08 3fbu h GLU 166 Ca -0.48 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 58.93 3fbu h GLU 166 Cb 1.20 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 3fbu h GLU 166 CO 0.64 0.21 -0.02 0.93 0.07 0.00 0.00 179.01 180.84 3fbu h GLU 167 N 0.33 0.00 -0.02 1.06 5.08 -1.95 -3.51 114.58 115.56 3fbu h GLU 167 Ca 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 3fbu h GLU 167 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 3fbu h GLU 167 CO -0.20 0.02 0.00 0.39 -1.00 0.00 0.00 179.01 178.22