#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dvh s ASP 2 N 0.00 3.21 0.50 0.00 -1.08 -1.26 -4.65 116.67 113.39 2dvh s ASP 2 Ca 0.00 -0.44 0.37 0.00 -0.52 0.00 0.00 52.55 51.96 2dvh s ASP 2 Cb 0.00 -0.53 1.52 0.00 -1.46 0.00 0.00 42.92 42.45 2dvh s ASP 2 CO 0.00 0.31 1.69 1.23 0.52 0.00 0.00 175.17 178.91 2dvh h GLY 3 N 5.59 0.51 0.46 2.66 0.00 -1.77 -0.79 103.07 109.73 2dvh h GLY 3 Ca -0.41 -0.06 0.18 0.00 0.00 0.00 0.00 47.33 47.04 2dvh h GLY 3 CO 0.48 -0.13 0.56 0.00 0.00 0.00 0.00 176.54 177.45 2dvh h ALA 4 N 1.37 2.12 0.19 3.60 0.00 -1.93 0.84 119.26 125.46 2dvh h ALA 4 Ca 0.75 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.66 2dvh h ALA 4 Cb 2.69 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 20.43 2dvh h ALA 4 CO -0.16 -0.37 -0.09 0.00 0.00 0.00 0.00 179.25 178.63 2dvh h ALA 5 N 1.62 -0.26 -0.44 0.00 0.00 -1.57 -3.30 119.26 115.31 2dvh h ALA 5 Ca 0.43 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.23 2dvh h ALA 5 Cb 1.00 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.81 2dvh h ALA 5 CO -0.16 -0.43 -0.09 -0.07 0.00 0.00 0.00 179.25 178.50 2dvh h LEU 6 N -0.69 -0.37 -1.78 0.00 4.07 -1.38 -2.27 115.31 112.90 2dvh h LEU 6 Ca -0.03 0.13 0.32 0.00 0.08 0.00 0.00 57.88 58.38 2dvh h LEU 6 Cb 0.49 0.26 -0.06 0.00 1.08 0.00 0.00 40.66 42.42 2dvh h LEU 6 CO 0.04 -0.13 0.79 0.22 -1.08 0.00 0.00 178.44 178.28 2dvh h TYR 7 N 0.02 0.22 -0.50 1.13 3.20 -0.96 -0.90 116.97 119.18 2dvh h TYR 7 Ca 0.22 0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.24 2dvh h TYR 7 Cb 0.33 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 2dvh h TYR 7 CO -0.37 0.01 0.39 0.87 -1.64 0.00 0.00 178.16 177.43 2dvh h LYS 8 N 0.12 0.00 0.00 1.82 1.57 -1.52 0.21 116.57 118.78 2dvh h LYS 8 Ca 0.58 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.29 2dvh h LYS 8 Cb 2.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.33 2dvh h LYS 8 CO -0.11 0.00 -0.31 0.66 -0.57 0.00 0.00 179.45 179.12 2dvh h SER 9 N 0.00 0.00 0.61 0.86 4.64 -1.36 -3.22 113.55 115.08 2dvh h SER 9 Ca 0.24 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.28 2dvh h SER 9 Cb 1.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 2dvh h SER 9 CO -0.00 0.31 -1.35 0.00 -0.87 0.00 0.00 176.83 174.93 2dvh n ILE 11 N -3.44 1.67 0.00 0.00 5.41 -0.77 -1.41 119.36 120.82 2dvh n ILE 11 Ca -0.11 -0.42 0.00 0.00 1.00 0.00 0.00 62.75 63.23 2dvh n ILE 11 Cb 1.02 -1.36 0.00 0.00 -0.71 0.00 0.00 39.64 38.59 2dvh n ILE 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2dvh n GLY 12 N 1.31 3.10 0.11 7.39 0.00 -1.26 -4.78 105.19 111.06 2dvh n GLY 12 Ca 0.08 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 2dvh n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvh n HIS 14 N -3.07 0.00 -0.23 0.00 -0.00 -0.91 -3.75 115.22 107.26 2dvh n HIS 14 Ca -0.39 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.36 2dvh n HIS 14 Cb 0.98 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.99 30.93 2dvh n HIS 14 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2dvh n GLY 15 N 1.43 -1.67 1.99 -1.41 0.00 -1.26 -0.45 105.19 103.83 2dvh n GLY 15 Ca 0.08 -1.46 -0.12 0.00 0.00 0.00 0.00 46.02 44.52 2dvh n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvh n ALA 16 N -1.83 6.30 0.01 4.61 0.00 -1.26 -3.90 120.51 124.44 2dvh n ALA 16 Ca -0.00 -1.80 0.00 0.00 0.00 0.00 0.00 53.44 51.64 2dvh n ALA 16 Cb 0.11 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.28 2dvh n ALA 16 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2dvh n ASP 17 N 2.43 -0.19 0.00 0.00 5.75 -1.26 -5.03 116.55 118.25 2dvh n ASP 17 Ca 0.42 0.25 0.00 0.00 -0.01 0.00 0.00 54.79 55.44 2dvh n ASP 17 Cb 0.90 0.40 0.00 0.00 -1.03 0.00 0.00 41.12 41.39 2dvh n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dvh n GLY 18 N -1.05 0.50 0.21 6.12 0.00 -0.68 -4.04 105.19 106.26 2dvh n GLY 18 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2dvh n GLY 18 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dvh n SER 19 N 0.00 0.54 -4.56 1.61 3.41 0.41 -0.20 113.62 114.83 2dvh n SER 19 Ca 0.00 0.09 -0.29 0.00 -0.26 0.00 0.00 58.87 58.41 2dvh n SER 19 Cb 0.00 -0.49 0.22 0.00 -0.26 0.00 0.00 64.21 63.68 2dvh n SER 19 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2dvh s LYS 20 N -1.52 -0.24 -0.48 4.33 -2.85 -1.24 -4.66 119.74 113.08 2dvh s LYS 20 Ca -0.07 1.01 -0.27 0.00 -1.00 0.00 0.00 55.97 55.63 2dvh s LYS 20 Cb 0.01 -1.62 -0.27 0.00 -2.06 0.00 0.00 37.83 33.89 2dvh s LYS 20 CO 0.11 -3.32 1.79 0.00 0.10 0.00 0.00 175.35 174.03 2dvh n ALA 21 N -4.65 1.48 -1.65 0.59 0.00 -1.26 -4.77 120.51 110.24 2dvh n ALA 21 Ca 0.06 -2.82 -0.47 0.00 0.00 0.00 0.00 53.44 50.21 2dvh n ALA 21 Cb 0.54 -3.64 -0.04 0.00 0.00 0.00 0.00 19.45 16.31 2dvh n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dvh n ALA 22 N 10.77 1.12 0.00 0.00 0.00 -1.25 -3.07 120.51 128.07 2dvh n ALA 22 Ca 0.47 0.18 0.00 0.00 0.00 0.00 0.00 53.44 54.08 2dvh n ALA 22 Cb 0.43 -2.59 0.00 0.00 0.00 0.00 0.00 19.45 17.29 2dvh n ALA 22 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2dvh n MET 23 N 7.21 0.00 0.00 0.00 2.81 -1.26 -4.05 117.12 121.82 2dvh n MET 23 Ca 0.25 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.14 2dvh n MET 23 Cb 0.33 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.84 2dvh n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dvh n GLY 24 N 0.00 3.28 2.32 3.03 0.00 -1.18 -5.02 105.19 107.62 2dvh n GLY 24 Ca 0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 2dvh n GLY 24 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dvh n SER 25 N 0.00 3.71 -4.81 1.61 7.64 -1.26 -4.43 113.62 116.08 2dvh n SER 25 Ca 0.00 -2.15 -0.34 0.00 1.01 0.00 0.00 58.87 57.38 2dvh n SER 25 Cb 0.00 -0.92 -0.06 0.00 -1.01 0.00 0.00 64.21 62.22 2dvh n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dvh s ALA 26 N 2.26 3.04 0.10 -0.43 0.00 -1.26 -4.99 121.76 120.48 2dvh s ALA 26 Ca 0.40 0.49 -0.31 0.00 0.00 0.00 0.00 51.96 52.54 2dvh s ALA 26 Cb 0.17 -3.19 -0.11 0.00 0.00 0.00 0.00 23.12 19.99 2dvh s ALA 26 CO -0.01 0.02 1.86 1.63 0.00 0.00 0.00 175.76 179.26 2dvh n LYS 27 N -0.47 2.78 -1.69 0.00 5.02 -1.26 -4.80 118.16 117.75 2dvh n LYS 27 Ca 0.06 1.01 -0.41 0.00 -2.02 0.00 0.00 58.31 56.95 2dvh n LYS 27 Cb 0.53 -2.91 0.01 0.00 -0.02 0.00 0.00 35.03 32.63 2dvh n LYS 27 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2dvh n PRO 28 N 5.99 1.85 -0.04 1.97 -0.02 -1.26 -4.91 135.00 138.58 2dvh n PRO 28 Ca 0.19 0.66 -0.13 0.00 -2.02 0.00 0.00 63.50 62.20 2dvh n PRO 28 Cb 0.37 -2.32 -0.14 0.00 -0.02 0.00 0.00 33.50 31.40 2dvh n PRO 28 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2dvh n VAL 29 N -0.18 1.61 -1.49 -1.45 0.31 0.72 -4.62 118.33 113.22 2dvh n VAL 29 Ca 0.07 -0.75 -0.42 0.00 -0.01 0.00 0.00 64.34 63.23 2dvh n VAL 29 Cb 0.39 -1.15 -0.11 0.00 -0.91 0.00 0.00 33.84 32.07 2dvh n VAL 29 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2dvh n LYS 30 N -3.12 0.40 -3.11 5.55 4.81 0.13 -2.18 118.16 120.63 2dvh n LYS 30 Ca -0.26 0.02 -0.16 0.00 -0.87 0.00 0.00 58.31 57.04 2dvh n LYS 30 Cb 1.06 -2.15 0.05 0.00 0.02 0.00 0.00 35.03 34.01 2dvh n LYS 30 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dvh n GLY 31 N 6.42 -0.11 0.36 3.14 0.00 0.32 -4.94 105.19 110.38 2dvh n GLY 31 Ca 0.55 -0.06 -0.17 0.00 0.00 0.00 0.00 46.02 46.33 2dvh n GLY 31 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2dvh h GLN 32 N -1.60 -0.85 0.00 1.61 4.20 -1.67 -3.49 115.11 113.31 2dvh h GLN 32 Ca -0.39 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.38 2dvh h GLN 32 Cb 1.26 0.19 0.00 0.00 0.30 0.00 0.00 27.48 29.23 2dvh h GLN 32 CO 0.39 -0.55 0.00 0.41 -0.67 0.00 0.00 178.83 178.42 2dvh n GLY 33 N -1.32 4.34 0.35 3.46 0.00 -1.26 -4.93 105.19 105.83 2dvh n GLY 33 Ca -0.13 -0.50 0.01 0.00 0.00 0.00 0.00 46.02 45.39 2dvh n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvh h ALA 34 N 0.00 0.34 -0.09 4.61 0.00 -1.86 0.19 119.26 122.44 2dvh h ALA 34 Ca 0.00 0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2dvh h ALA 34 Cb 0.00 0.80 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2dvh h ALA 34 CO 0.00 -0.51 0.04 1.49 0.00 0.00 0.00 179.25 180.27 2dvh h GLU 35 N -0.03 0.13 -0.15 0.00 4.81 -1.96 0.20 114.58 117.58 2dvh h GLU 35 Ca 0.37 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.62 2dvh h GLU 35 Cb 0.61 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.92 2dvh h GLU 35 CO -0.89 0.21 -0.21 1.49 -0.73 0.00 0.00 179.01 178.88 2dvh h GLU 36 N 0.01 -0.25 0.35 1.92 4.57 -1.52 -0.41 114.58 119.26 2dvh h GLU 36 Ca 0.03 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 2dvh h GLU 36 Cb 0.13 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2dvh h GLU 36 CO -0.00 -0.17 -0.21 -0.07 -1.18 0.00 0.00 179.01 177.38 2dvh h LEU 37 N -0.26 -0.54 -0.87 1.64 3.38 -0.58 -2.83 115.31 115.26 2dvh h LEU 37 Ca 0.11 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.20 2dvh h LEU 37 Cb 0.41 0.16 -0.11 0.00 0.09 0.00 0.00 40.66 41.21 2dvh h LEU 37 CO -0.30 -0.33 -0.47 0.00 0.09 0.00 0.00 178.44 177.44 2dvh n TYR 38 N -3.62 -0.27 -0.26 1.13 9.36 0.70 -0.04 117.16 124.16 2dvh n TYR 38 Ca -0.06 1.08 0.07 0.00 3.32 0.00 0.00 57.90 62.30 2dvh n TYR 38 Cb 0.22 -0.64 0.21 0.00 -0.63 0.00 0.00 39.34 38.50 2dvh n TYR 38 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 2dvh h LYS 39 N 0.00 0.31 -0.00 2.98 1.79 -1.05 0.31 116.57 120.91 2dvh h LYS 39 Ca 0.18 -0.02 -0.11 0.00 -2.18 0.00 0.00 60.65 58.52 2dvh h LYS 39 Cb 0.40 -0.07 0.01 0.00 -1.58 0.00 0.00 32.23 30.99 2dvh h LYS 39 CO -0.83 0.21 -0.44 0.87 -1.08 0.00 0.00 179.45 178.18 2dvh h LYS 40 N 0.32 0.30 -0.63 3.15 1.79 -0.20 0.43 116.57 121.73 2dvh h LYS 40 Ca 0.44 -0.32 -0.01 0.00 -2.18 0.00 0.00 60.65 58.58 2dvh h LYS 40 Cb 0.76 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.47 2dvh h LYS 40 CO -0.50 1.02 0.34 0.00 -1.08 0.00 0.00 179.45 179.23 2dvh h MET 41 N -0.28 0.86 -0.41 3.15 -0.00 -0.64 0.15 114.93 117.76 2dvh h MET 41 Ca -0.06 -0.09 -0.08 0.00 -0.00 0.00 0.00 59.70 59.48 2dvh h MET 41 Cb 1.18 -0.17 -0.01 0.00 -0.00 0.00 0.00 31.60 32.59 2dvh h MET 41 CO 0.09 0.64 -0.05 -0.22 -0.00 0.00 0.00 176.91 177.37 2dvh h LYS 42 N 0.87 0.75 -0.50 -0.10 1.63 -0.42 0.48 116.57 119.29 2dvh h LYS 42 Ca 0.22 -0.27 0.05 0.00 -0.85 0.00 0.00 60.65 59.81 2dvh h LYS 42 Cb 0.03 -0.05 -0.08 0.00 -0.60 0.00 0.00 32.23 31.52 2dvh h LYS 42 CO -0.04 0.86 -0.51 0.78 -3.45 0.00 0.00 179.45 177.10 2dvh h GLY 43 N 0.58 -1.09 0.83 5.01 0.00 0.10 0.32 103.07 108.81 2dvh h GLY 43 Ca 0.11 0.76 -0.01 0.00 0.00 0.00 0.00 47.33 48.19 2dvh h GLY 43 CO 0.03 -0.15 0.03 -0.97 0.00 0.00 0.00 176.54 175.48 2dvh h TYR 44 N -0.26 0.18 -0.78 5.60 0.05 -0.69 0.43 116.97 121.49 2dvh h TYR 44 Ca 0.09 -0.02 0.08 0.00 0.05 0.00 0.00 58.73 58.93 2dvh h TYR 44 Cb 0.49 -0.05 -0.05 0.00 1.01 0.00 0.00 36.73 38.13 2dvh h TYR 44 CO -0.80 0.32 0.51 0.00 -1.05 0.00 0.00 178.16 177.14 2dvh h ALA 45 N 0.84 1.72 -0.00 3.88 0.00 -0.42 0.14 119.26 125.42 2dvh h ALA 45 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2dvh h ALA 45 Cb 0.23 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2dvh h ALA 45 CO -0.00 0.14 -0.00 -0.25 0.00 0.00 0.00 179.25 179.13 2dvh n ASP 46 N -4.50 0.10 -3.71 0.00 8.00 0.11 -4.78 116.55 111.77 2dvh n ASP 46 Ca 0.12 -0.84 -0.26 0.00 0.71 0.00 0.00 54.79 54.53 2dvh n ASP 46 Cb 0.28 -0.06 0.06 0.00 -0.02 0.00 0.00 41.12 41.38 2dvh n ASP 46 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dvh n GLY 47 N 1.08 -0.51 1.71 0.44 0.00 0.51 -4.90 105.19 103.51 2dvh n GLY 47 Ca 0.21 0.22 0.03 0.00 0.00 0.00 0.00 46.02 46.49 2dvh n GLY 47 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dvh n SER 48 N -2.96 1.17 -3.68 1.61 2.88 0.11 -5.02 113.62 107.73 2dvh n SER 48 Ca -0.01 -2.10 -0.14 0.00 -1.33 0.00 0.00 58.87 55.29 2dvh n SER 48 Cb 0.56 -0.34 -0.07 0.00 -0.75 0.00 0.00 64.21 63.60 2dvh n SER 48 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 2dvh s TYR 49 N -0.86 -0.32 0.00 0.66 5.04 -1.07 -4.82 117.35 115.97 2dvh s TYR 49 Ca 0.33 0.48 0.00 0.00 -2.44 0.00 0.00 57.07 55.44 2dvh s TYR 49 Cb 0.38 0.21 0.00 0.00 0.35 0.00 0.00 41.96 42.89 2dvh s TYR 49 CO -0.14 -0.49 0.00 0.41 -1.34 0.00 0.00 175.55 173.99 2dvh n GLY 50 N 1.00 -0.80 0.21 8.97 0.00 -1.26 -4.19 105.19 109.12 2dvh n GLY 50 Ca -0.20 -1.08 -0.01 0.00 0.00 0.00 0.00 46.02 44.73 2dvh n GLY 50 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2dvh h GLY 51 N 0.00 0.52 -2.96 -0.02 0.00 -2.03 0.23 103.07 98.81 2dvh h GLY 51 Ca 0.00 0.10 -0.38 0.00 0.00 0.00 0.00 47.33 47.06 2dvh h GLY 51 CO 0.00 -0.18 0.07 -1.84 0.00 0.00 0.00 176.54 174.59 2dvh n GLU 52 N -5.29 2.32 0.00 4.80 -0.00 -1.26 -4.97 120.64 116.25 2dvh n GLU 52 Ca 0.06 -3.34 0.00 0.00 -0.00 0.00 0.00 57.16 53.88 2dvh n GLU 52 Cb 0.30 -2.03 0.00 0.00 -0.00 0.00 0.00 31.44 29.71 2dvh n GLU 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2dvh n ARG 53 N -1.03 0.00 -2.87 3.44 3.00 0.07 -3.84 116.66 115.42 2dvh n ARG 53 Ca 0.44 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 58.20 2dvh n ARG 53 Cb 1.07 -1.88 0.03 0.00 0.00 0.00 0.00 32.46 31.68 2dvh n ARG 53 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2dvh n LYS 54 N -0.40 -3.06 0.00 -0.14 5.02 -1.26 -4.43 118.16 113.89 2dvh n LYS 54 Ca 0.00 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 2dvh n LYS 54 Cb 0.00 -3.83 0.00 0.00 -0.02 0.00 0.00 35.03 31.18 2dvh n LYS 54 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dvh n ALA 55 N -3.29 0.00 -0.05 7.82 0.00 -1.25 -0.00 120.51 123.73 2dvh n ALA 55 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 2dvh n ALA 55 Cb 0.53 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 2dvh n ALA 55 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2dvh h MET 56 N 0.00 0.15 -0.64 0.00 2.86 -1.95 0.81 114.93 116.16 2dvh h MET 56 Ca 0.00 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 2dvh h MET 56 Cb 0.00 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 2dvh h MET 56 CO 0.00 0.10 0.28 1.98 1.06 0.00 0.00 176.91 180.33 2dvh h MET 57 N 0.16 0.94 -0.16 1.72 -1.53 -0.79 -0.22 114.93 115.05 2dvh h MET 57 Ca 0.10 -0.16 0.05 0.00 -3.44 0.00 0.00 59.70 56.25 2dvh h MET 57 Cb 0.08 -0.16 -0.07 0.00 -0.55 0.00 0.00 31.60 30.90 2dvh h MET 57 CO -0.11 0.77 -0.35 1.15 0.14 0.00 0.00 176.91 178.51 2dvh h THR 58 N 0.89 0.24 -0.84 -0.77 2.02 -0.02 -0.23 112.91 114.20 2dvh h THR 58 Ca 0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.40 2dvh h THR 58 Cb 0.16 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 2dvh h THR 58 CO -0.02 0.00 0.53 -1.13 0.37 0.00 0.00 175.52 175.27 2dvh h ASN 59 N -0.41 0.99 0.32 4.18 -0.00 -0.57 0.14 115.58 120.24 2dvh h ASN 59 Ca 0.10 -0.05 -0.00 0.00 -0.00 0.00 0.00 56.30 56.35 2dvh h ASN 59 Cb 0.57 -0.25 -0.02 0.00 -0.00 0.00 0.00 38.32 38.62 2dvh h ASN 59 CO -0.38 0.75 -0.27 0.00 -0.00 0.00 0.00 177.43 177.52 2dvh h ALA 60 N 1.29 -0.60 0.00 1.57 0.00 -0.18 -2.45 119.26 118.89 2dvh h ALA 60 Ca 0.31 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 2dvh h ALA 60 Cb -0.08 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2dvh h ALA 60 CO -0.06 -0.86 -0.35 -0.39 0.00 0.00 0.00 179.25 177.58 2dvh h VAL 61 N -0.60 1.17 -0.59 0.00 -1.51 -0.85 -2.82 116.25 111.06 2dvh h VAL 61 Ca -0.02 -1.25 0.13 0.00 -1.23 0.00 0.00 66.70 64.33 2dvh h VAL 61 Cb 0.54 1.69 -0.03 0.00 -2.13 0.00 0.00 31.29 31.35 2dvh h VAL 61 CO -0.02 0.35 0.40 0.50 -1.23 0.00 0.00 177.57 177.57 2dvh h LYS 62 N 0.00 0.23 0.00 5.19 1.63 -0.24 0.12 116.57 123.49 2dvh h LYS 62 Ca -0.00 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 2dvh h LYS 62 Cb 0.66 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.24 2dvh h LYS 62 CO 0.05 0.15 -0.06 0.87 -3.45 0.00 0.00 179.45 177.01 2dvh h LYS 63 N 0.23 0.00 -6.02 1.90 6.56 -1.31 -3.44 116.57 114.50 2dvh h LYS 63 Ca 0.28 0.00 -0.56 0.00 -1.06 0.00 0.00 60.65 59.31 2dvh h LYS 63 Cb 0.79 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.39 2dvh h LYS 63 CO -0.06 0.06 0.06 0.00 -2.06 0.00 0.00 179.45 177.45 2dvh s ALA 64 N -3.72 3.36 0.88 3.86 0.00 0.41 -5.08 121.76 121.47 2dvh s ALA 64 Ca 0.01 0.11 -0.13 0.00 0.00 0.00 0.00 51.96 51.94 2dvh s ALA 64 Cb 0.10 -2.92 0.13 0.00 0.00 0.00 0.00 23.12 20.43 2dvh s ALA 64 CO 0.56 -0.07 1.17 -1.54 0.00 0.00 0.00 175.76 175.89 2dvh s SER 65 N 0.69 3.79 0.27 0.00 1.04 -1.26 -4.66 113.70 113.55 2dvh s SER 65 Ca 0.36 0.80 -0.01 0.00 0.48 0.00 0.00 55.95 57.58 2dvh s SER 65 Cb -0.18 -1.27 0.51 0.00 0.10 0.00 0.00 66.02 65.19 2dvh s SER 65 CO 0.18 -2.36 1.80 0.44 0.98 0.00 0.00 173.24 174.27 2dvh h ASP 66 N -1.37 0.70 -0.15 7.02 3.32 -1.98 0.19 116.42 124.15 2dvh h ASP 66 Ca -0.48 0.07 0.04 0.00 0.02 0.00 0.00 57.03 56.68 2dvh h ASP 66 Cb 1.32 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 40.74 2dvh h ASP 66 CO 0.60 0.35 -0.45 -0.08 -1.72 0.00 0.00 179.24 177.93 2dvh h GLU 67 N 0.78 -0.49 -0.00 3.56 4.81 -1.97 0.23 114.58 121.50 2dvh h GLU 67 Ca 0.46 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.72 2dvh h GLU 67 Cb 0.54 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.03 2dvh h GLU 67 CO -0.30 -0.33 0.00 0.93 -0.73 0.00 0.00 179.01 178.58 2dvh h GLU 68 N -0.51 0.01 -0.28 1.92 4.39 -1.54 -0.50 114.58 118.06 2dvh h GLU 68 Ca 0.07 -0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.83 2dvh h GLU 68 Cb 0.64 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.23 2dvh h GLU 68 CO -0.42 0.07 -0.12 -0.07 -1.16 0.00 0.00 179.01 177.31 2dvh h LEU 69 N -0.06 -0.40 -0.26 1.33 3.38 -0.40 0.43 115.31 119.32 2dvh h LEU 69 Ca 0.00 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2dvh h LEU 69 Cb 0.07 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2dvh h LEU 69 CO -0.00 -0.15 0.14 0.11 0.09 0.00 0.00 178.44 178.63 2dvh h LYS 70 N -0.07 0.28 -0.61 1.13 1.57 -0.82 -0.70 116.57 117.35 2dvh h LYS 70 Ca 0.14 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 2dvh h LYS 70 Cb 0.29 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 2dvh h LYS 70 CO -0.33 0.19 0.28 0.00 -0.57 0.00 0.00 179.45 179.02 2dvh h ALA 71 N 1.13 1.35 0.11 3.86 0.00 -0.26 0.15 119.26 125.59 2dvh h ALA 71 Ca 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2dvh h ALA 71 Cb 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2dvh h ALA 71 CO -0.06 0.50 -0.05 1.25 0.00 0.00 0.00 179.25 180.89 2dvh h LEU 72 N 0.86 -0.12 -0.05 0.00 5.85 0.33 0.10 115.31 122.27 2dvh h LEU 72 Ca 0.21 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.88 2dvh h LEU 72 Cb 0.11 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2dvh h LEU 72 CO -0.03 0.01 -0.15 0.00 -0.34 0.00 0.00 178.44 177.94 2dvh h ALA 73 N 0.64 -0.13 -0.40 1.25 0.00 -0.81 -1.04 119.26 118.77 2dvh h ALA 73 Ca -0.01 0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2dvh h ALA 73 Cb 0.20 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 2dvh h ALA 73 CO 0.02 -0.62 0.07 -0.44 0.00 0.00 0.00 179.25 178.28 2dvh h ASP 74 N -0.22 -0.00 0.40 0.00 3.32 -0.45 0.19 116.42 119.65 2dvh h ASP 74 Ca 0.07 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 2dvh h ASP 74 Cb 0.32 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 2dvh h ASP 74 CO -0.18 0.03 -0.39 0.22 -1.72 0.00 0.00 179.24 177.19 2dvh h TYR 75 N 0.20 -1.07 0.00 4.55 3.20 -0.50 -1.67 116.97 121.68 2dvh h TYR 75 Ca 0.20 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 2dvh h TYR 75 Cb 0.24 0.42 -0.00 0.00 1.54 0.00 0.00 36.73 38.92 2dvh h TYR 75 CO -0.21 -0.55 -0.03 0.52 -1.64 0.00 0.00 178.16 176.26 2dvh h MET 76 N -0.81 0.00 -0.08 1.82 2.86 -0.89 0.74 114.93 118.57 2dvh h MET 76 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2dvh h MET 76 Cb 0.72 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.38 2dvh h MET 76 CO -0.06 0.03 0.00 0.45 1.06 0.00 0.00 176.91 178.39 2dvh n SER 77 N -3.65 0.45 -2.75 1.22 2.88 0.64 -0.52 113.62 111.89 2dvh n SER 77 Ca -0.03 -1.93 -0.05 0.00 -1.33 0.00 0.00 58.87 55.54 2dvh n SER 77 Cb 0.12 -0.05 0.05 0.00 -0.75 0.00 0.00 64.21 63.58 2dvh n SER 77 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dvh n LYS 78 N -0.28 1.42 0.00 -1.46 4.81 0.25 -4.78 118.16 118.12 2dvh n LYS 78 Ca 0.04 -3.26 0.00 0.00 -0.87 0.00 0.00 58.31 54.23 2dvh n LYS 78 Cb 0.08 -1.32 0.00 0.00 0.02 0.00 0.00 35.03 33.81 2dvh n LYS 78 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85