#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dvh n ASP 2 N 0.00 3.07 0.00 0.00 5.75 -1.26 -4.68 116.55 119.42 2dvh n ASP 2 Ca 0.00 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 2dvh n ASP 2 Cb 0.00 -0.63 0.00 0.00 -1.03 0.00 0.00 41.12 39.46 2dvh n ASP 2 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dvh n GLY 3 N 1.43 1.17 0.34 6.12 0.00 -1.26 -4.69 105.19 108.31 2dvh n GLY 3 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.03 2dvh n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvh n ALA 4 N 0.00 0.02 -0.24 4.61 0.00 -1.26 -0.15 120.51 123.49 2dvh n ALA 4 Ca 0.00 0.94 0.20 0.00 0.00 0.00 0.00 53.44 54.58 2dvh n ALA 4 Cb 0.00 -0.48 0.53 0.00 0.00 0.00 0.00 19.45 19.50 2dvh n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dvh h ALA 5 N 1.48 2.25 0.00 0.00 0.00 -1.93 0.01 119.26 121.07 2dvh h ALA 5 Ca 0.36 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.19 2dvh h ALA 5 Cb 0.59 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2dvh h ALA 5 CO -0.92 -0.54 -0.64 -0.07 0.00 0.00 0.00 179.25 177.09 2dvh h LEU 6 N 0.37 0.00 -0.98 0.00 4.07 -0.94 -3.39 115.31 114.45 2dvh h LEU 6 Ca 0.47 -0.53 0.28 0.00 0.08 0.00 0.00 57.88 58.18 2dvh h LEU 6 Cb 1.22 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 42.82 2dvh h LEU 6 CO -0.17 1.13 0.51 0.22 -1.08 0.00 0.00 178.44 179.05 2dvh h TYR 7 N -1.00 0.85 0.00 1.13 3.20 -0.21 0.20 116.97 121.13 2dvh h TYR 7 Ca -0.16 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.75 2dvh h TYR 7 Cb 0.96 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.01 2dvh h TYR 7 CO 0.10 -0.11 0.50 1.57 -1.64 0.00 0.00 178.16 178.58 2dvh h LYS 8 N 0.38 0.00 0.02 1.82 5.09 -1.22 0.35 116.57 123.01 2dvh h LYS 8 Ca 0.67 0.00 -0.22 0.00 0.09 0.00 0.00 60.65 61.19 2dvh h LYS 8 Cb 1.43 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 33.73 2dvh h LYS 8 CO -0.57 0.00 -1.19 0.77 -2.09 0.00 0.00 179.45 176.37 2dvh h SER 9 N 0.00 0.07 -0.04 7.07 0.02 -1.22 -3.39 113.55 116.06 2dvh h SER 9 Ca 0.00 -0.63 -0.00 0.00 -0.84 0.00 0.00 61.79 60.31 2dvh h SER 9 Cb 1.01 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.52 2dvh h SER 9 CO 0.00 1.48 0.02 0.00 -1.14 0.00 0.00 176.83 177.18 2dvh h ILE 11 N 0.09 0.39 -1.26 0.00 3.07 -1.32 -0.17 117.51 118.30 2dvh h ILE 11 Ca 0.02 0.00 0.39 0.00 1.55 0.00 0.00 64.86 66.82 2dvh h ILE 11 Cb 0.03 0.49 -0.11 0.00 -0.27 0.00 0.00 36.82 36.96 2dvh h ILE 11 CO -0.00 0.00 0.83 1.23 -1.05 0.00 0.00 178.15 179.16 2dvh h GLY 12 N 0.00 1.12 0.00 0.16 0.00 -1.62 0.15 103.07 102.88 2dvh h GLY 12 Ca 0.39 -0.12 -0.12 0.00 0.00 0.00 0.00 47.33 47.47 2dvh h GLY 12 CO -0.00 -0.28 -1.45 0.00 0.00 0.00 0.00 176.54 174.81 2dvh h HIS 14 N -0.11 0.00 -0.95 0.00 3.86 -0.91 -3.41 115.15 113.63 2dvh h HIS 14 Ca -0.19 0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.12 2dvh h HIS 14 Cb 1.24 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.68 2dvh h HIS 14 CO -0.00 0.07 -0.13 0.41 0.86 0.00 0.00 177.93 179.13 2dvh n GLY 15 N 0.43 -2.05 0.00 2.45 0.00 0.49 -3.66 105.19 102.86 2dvh n GLY 15 Ca 0.02 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.65 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 -1.06 0.00 -1.24 4.61 0.00 -1.26 -4.16 120.51 117.39 2dvh n ALA 16 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 2dvh n ALA 16 Cb 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.50 2dvh n ALA 16 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dvh n ASP 17 N -0.48 6.15 0.00 0.00 9.92 -1.26 -4.80 116.55 126.08 2dvh n ASP 17 Ca 0.00 -2.74 0.00 0.00 -0.53 0.00 0.00 54.79 51.52 2dvh n ASP 17 Cb 0.00 -1.38 0.00 0.00 -0.64 0.00 0.00 41.12 39.10 2dvh n ASP 17 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dvh n GLY 18 N 2.10 0.00 1.94 0.44 0.00 -1.25 -4.79 105.19 103.63 2dvh n GLY 18 Ca 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 2dvh n GLY 18 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dvh n SER 19 N 0.21 5.04 -4.80 1.61 7.64 -1.25 -3.82 113.62 118.25 2dvh n SER 19 Ca 0.00 -2.43 -0.29 0.00 1.01 0.00 0.00 58.87 57.16 2dvh n SER 19 Cb 0.01 -1.32 0.13 0.00 -1.01 0.00 0.00 64.21 62.02 2dvh n SER 19 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 2dvh s LYS 20 N 0.92 1.32 -0.43 1.43 -2.85 -1.24 -5.01 119.74 113.89 2dvh s LYS 20 Ca 0.54 0.32 0.08 0.00 -1.00 0.00 0.00 55.97 55.91 2dvh s LYS 20 Cb 0.26 -1.86 0.26 0.00 -2.06 0.00 0.00 37.83 34.43 2dvh s LYS 20 CO 0.00 -2.08 0.72 0.00 0.10 0.00 0.00 175.35 174.09 2dvh n ALA 21 N -3.69 0.76 -1.00 0.59 0.00 -1.26 -4.68 120.51 111.23 2dvh n ALA 21 Ca 0.07 -2.53 0.00 0.00 0.00 0.00 0.00 53.44 50.97 2dvh n ALA 21 Cb 0.59 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 19.00 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 1.31 0.00 -1.45 0.00 0.00 -1.26 -4.74 120.51 114.36 2dvh n ALA 22 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.22 2dvh n ALA 22 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 2dvh n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dvh n MET 23 N 0.00 1.48 0.00 0.00 0.00 -1.26 -4.73 117.12 112.60 2dvh n MET 23 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 57.70 55.66 2dvh n MET 23 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 33.22 30.02 2dvh n MET 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2dvh n GLY 24 N 5.00 0.47 2.64 3.17 0.00 -1.26 -4.71 105.19 110.50 2dvh n GLY 24 Ca 0.48 -2.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.08 5.11 -4.81 1.61 7.64 -1.26 -4.82 113.62 117.02 2dvh n SER 25 Ca 0.00 -2.43 -0.34 0.00 1.01 0.00 0.00 58.87 57.11 2dvh n SER 25 Cb 0.00 -1.19 -0.05 0.00 -1.01 0.00 0.00 64.21 61.96 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 3.44 2.93 0.06 -0.43 0.00 -1.26 -4.99 121.76 121.51 2dvh s ALA 26 Ca 0.47 0.52 -0.31 0.00 0.00 0.00 0.00 51.96 52.64 2dvh s ALA 26 Cb 0.12 -3.21 -0.08 0.00 0.00 0.00 0.00 23.12 19.95 2dvh s ALA 26 CO -0.02 -0.17 1.67 0.15 0.00 0.00 0.00 175.76 177.40 2dvh s LYS 27 N -3.25 4.19 -0.13 0.00 1.02 -1.26 -4.88 119.74 115.43 2dvh s LYS 27 Ca 0.65 2.34 -0.29 0.00 0.02 0.00 0.00 55.97 58.69 2dvh s LYS 27 Cb -0.14 -3.67 -0.04 0.00 -0.52 0.00 0.00 37.83 33.46 2dvh s LYS 27 CO 0.18 -0.76 1.65 -1.25 -0.92 0.00 0.00 175.35 174.25 2dvh s PRO 28 N 2.90 3.99 0.31 -1.68 0.04 -1.26 -4.86 135.00 134.44 2dvh s PRO 28 Ca 0.75 1.97 0.16 0.00 0.04 0.00 0.00 61.00 63.92 2dvh s PRO 28 Cb -0.39 -4.01 1.09 0.00 0.04 0.00 0.00 34.50 31.22 2dvh s PRO 28 CO 0.33 -1.06 1.35 1.33 0.04 0.00 0.00 177.00 178.99 2dvh n VAL 29 N 5.92 -0.36 -0.43 -0.36 0.24 -1.25 -4.64 118.33 117.44 2dvh n VAL 29 Ca 0.18 1.76 -0.06 0.00 -2.04 0.00 0.00 64.34 64.18 2dvh n VAL 29 Cb 0.44 -2.82 -0.06 0.00 -1.47 0.00 0.00 33.84 29.93 2dvh n VAL 29 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2dvh n LYS 30 N -4.98 0.00 -3.53 7.34 4.81 -1.25 -0.83 118.16 119.71 2dvh n LYS 30 Ca 0.31 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.54 2dvh n LYS 30 Cb 1.04 -0.30 0.08 0.00 0.02 0.00 0.00 35.03 35.88 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 1.61 -0.47 0.25 3.14 0.00 0.03 -4.92 105.19 104.84 2dvh n GLY 31 Ca 0.19 0.19 -0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.36 -0.32 0.00 1.61 1.08 -1.22 -3.48 115.11 110.42 2dvh h GLN 32 Ca -0.58 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.64 2dvh h GLN 32 Cb 1.36 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.86 2dvh h GLN 32 CO 0.54 -0.21 0.00 0.41 -0.95 0.00 0.00 178.83 178.61 2dvh n GLY 33 N -1.34 3.62 0.23 3.46 0.00 -1.26 -4.93 105.19 104.96 2dvh n GLY 33 Ca -0.05 -0.68 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 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 0.59 0.26 4.61 0.00 -1.91 0.16 119.26 122.97 2dvh h ALA 34 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2dvh h ALA 34 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2dvh h ALA 34 CO 0.00 0.35 -0.12 0.93 0.00 0.00 0.00 179.25 180.41 2dvh h GLU 35 N 0.61 -0.33 -0.16 0.00 4.39 -1.96 0.16 114.58 117.29 2dvh h GLU 35 Ca 0.13 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.88 2dvh h GLU 35 Cb 0.44 0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 29.11 2dvh h GLU 35 CO 0.02 -0.16 -0.44 0.93 -1.16 0.00 0.00 179.01 178.20 2dvh h GLU 36 N -0.43 -0.41 0.37 2.33 3.07 -1.90 0.14 114.58 117.75 2dvh h GLU 36 Ca -0.04 0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2dvh h GLU 36 Cb 0.33 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.30 2dvh h GLU 36 CO 0.06 -0.28 -0.51 -0.07 -1.40 0.00 0.00 179.01 176.81 2dvh h LEU 37 N -0.43 -1.44 -0.78 1.33 3.38 -0.62 0.34 115.31 117.08 2dvh h LEU 37 Ca 0.03 0.13 0.13 0.00 0.09 0.00 0.00 57.88 58.26 2dvh h LEU 37 Cb 0.52 0.50 -0.14 0.00 0.09 0.00 0.00 40.66 41.63 2dvh h LEU 37 CO -0.38 -0.63 -0.34 0.22 0.09 0.00 0.00 178.44 177.40 2dvh h TYR 38 N -0.92 -0.93 -0.25 1.13 3.20 -0.42 0.25 116.97 119.03 2dvh h TYR 38 Ca -0.04 0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.93 2dvh h TYR 38 Cb 0.83 0.53 -0.02 0.00 1.54 0.00 0.00 36.73 39.61 2dvh h TYR 38 CO -0.32 -0.39 0.13 0.87 -1.64 0.00 0.00 178.16 176.81 2dvh h LYS 39 N -0.08 0.26 -0.61 1.82 1.57 -0.70 -2.48 116.57 116.35 2dvh h LYS 39 Ca 0.30 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2dvh h LYS 39 Cb 0.58 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 2dvh h LYS 39 CO -0.83 0.17 0.37 0.87 -0.57 0.00 0.00 179.45 179.47 2dvh h LYS 40 N 0.27 0.83 -0.24 3.15 1.79 0.13 0.21 116.57 122.71 2dvh h LYS 40 Ca 0.10 -0.07 0.04 0.00 -2.18 0.00 0.00 60.65 58.54 2dvh h LYS 40 Cb 0.02 -0.18 -0.04 0.00 -1.58 0.00 0.00 32.23 30.46 2dvh h LYS 40 CO -0.07 0.59 -0.03 0.52 -1.08 0.00 0.00 179.45 179.38 2dvh h MET 41 N 0.83 0.04 -0.59 3.15 2.86 -0.40 0.15 114.93 120.97 2dvh h MET 41 Ca 0.22 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.86 2dvh h MET 41 Cb -0.03 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.59 2dvh h MET 41 CO -0.04 0.02 0.39 0.87 1.06 0.00 0.00 176.91 179.21 2dvh h LYS 42 N 0.04 0.77 -0.40 1.72 1.79 -1.13 0.13 116.57 119.49 2dvh h LYS 42 Ca 0.11 -0.05 0.08 0.00 -2.18 0.00 0.00 60.65 58.62 2dvh h LYS 42 Cb 0.16 -0.17 -0.07 0.00 -1.58 0.00 0.00 32.23 30.57 2dvh h LYS 42 CO -0.22 0.51 -0.04 0.78 -1.08 0.00 0.00 179.45 179.40 2dvh h GLY 43 N 0.80 0.36 1.00 3.86 0.00 0.37 0.49 103.07 109.95 2dvh h GLY 43 Ca 0.22 0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.49 2dvh h GLY 43 CO -0.05 -0.12 -0.40 -0.97 0.00 0.00 0.00 176.54 175.00 2dvh h TYR 44 N 0.06 0.89 -0.78 5.60 0.05 -0.47 0.42 116.97 122.75 2dvh h TYR 44 Ca 0.20 -0.30 0.13 0.00 0.05 0.00 0.00 58.73 58.80 2dvh h TYR 44 Cb 0.29 -0.17 -0.09 0.00 1.01 0.00 0.00 36.73 37.77 2dvh h TYR 44 CO -0.30 1.08 0.37 0.00 -1.05 0.00 0.00 178.16 178.26 2dvh h ALA 45 N 0.65 1.12 -0.16 3.88 0.00 -0.06 0.40 119.26 125.09 2dvh h ALA 45 Ca 0.02 0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 2dvh h ALA 45 Cb 1.00 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.80 2dvh h ALA 45 CO 0.09 -0.10 -0.72 0.22 0.00 0.00 0.00 179.25 178.74 2dvh h ASP 46 N 0.57 0.91 -0.57 0.00 3.58 -0.91 -3.45 116.42 116.56 2dvh h ASP 46 Ca 0.41 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 57.24 2dvh h ASP 46 Cb 0.55 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2dvh h ASP 46 CO -0.34 1.38 0.00 0.61 -2.88 0.00 0.00 179.24 178.01 2dvh n GLY 47 N 0.67 0.98 0.05 -0.78 0.00 0.13 -5.02 105.19 101.22 2dvh n GLY 47 Ca -0.07 -0.42 -0.05 0.00 0.00 0.00 0.00 46.02 45.48 2dvh n GLY 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dvh n SER 48 N 0.93 1.27 -4.68 1.61 3.41 -0.03 -4.77 113.62 111.35 2dvh n SER 48 Ca 0.00 0.38 -0.45 0.00 -0.26 0.00 0.00 58.87 58.53 2dvh n SER 48 Cb 0.30 -0.71 -0.04 0.00 -0.26 0.00 0.00 64.21 63.50 2dvh n SER 48 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dvh n TYR 49 N -3.85 2.41 0.00 7.33 9.36 -1.16 -3.48 117.16 127.76 2dvh n TYR 49 Ca -0.07 0.05 0.00 0.00 3.32 0.00 0.00 57.90 61.20 2dvh n TYR 49 Cb 0.26 -2.64 0.00 0.00 -0.63 0.00 0.00 39.34 36.33 2dvh n TYR 49 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2dvh n GLY 50 N 3.97 2.94 5.28 2.98 0.00 -1.26 -4.19 105.19 114.91 2dvh n GLY 50 Ca 0.19 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2dvh n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dvh n GLY 51 N 0.00 1.66 3.62 -0.02 0.00 -1.23 -4.57 105.19 104.65 2dvh n GLY 51 Ca 0.00 0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2dvh n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dvh s GLU 52 N 0.00 3.87 0.44 1.61 0.41 -1.26 -4.91 118.70 118.87 2dvh s GLU 52 Ca 0.00 1.09 0.31 0.00 -0.41 0.00 0.00 54.97 55.97 2dvh s GLU 52 Cb 0.00 -3.88 1.45 0.00 -1.78 0.00 0.00 34.13 29.93 2dvh s GLU 52 CO 0.00 -1.17 1.61 -0.09 -0.49 0.00 0.00 175.26 175.12 2dvh h ARG 53 N 9.26 0.06 -5.04 1.61 2.43 -1.86 -3.45 114.38 117.40 2dvh h ARG 53 Ca -0.25 -0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 58.63 2dvh h ARG 53 Cb 1.09 -0.01 0.13 0.00 -0.42 0.00 0.00 29.97 30.76 2dvh h ARG 53 CO 1.05 0.04 -0.62 1.63 -1.51 0.00 0.00 179.97 180.57 2dvh n LYS 54 N -4.67 -5.85 -0.32 0.20 5.02 -1.26 -4.66 118.16 106.62 2dvh n LYS 54 Ca 0.38 0.70 0.15 0.00 -2.02 0.00 0.00 58.31 57.52 2dvh n LYS 54 Cb 1.48 -5.31 0.31 0.00 -0.02 0.00 0.00 35.03 31.49 2dvh n LYS 54 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dvh h ALA 55 N 0.78 1.26 -0.03 7.82 0.00 -1.95 0.20 119.26 127.35 2dvh h ALA 55 Ca -0.49 0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2dvh h ALA 55 Cb 1.29 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 19.54 2dvh h ALA 55 CO 0.43 -0.56 0.01 0.52 0.00 0.00 0.00 179.25 179.65 2dvh h MET 56 N 0.08 0.03 0.05 0.00 2.86 -1.99 0.84 114.93 116.80 2dvh h MET 56 Ca 0.59 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 58.23 2dvh h MET 56 Cb 1.24 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2dvh h MET 56 CO -0.80 0.02 -0.02 1.98 1.06 0.00 0.00 176.91 179.15 2dvh h MET 57 N 0.03 -0.07 -0.40 1.72 -1.53 -1.10 -0.88 114.93 112.69 2dvh h MET 57 Ca 0.01 0.00 0.05 0.00 -3.44 0.00 0.00 59.70 56.33 2dvh h MET 57 Cb 0.00 0.01 -0.08 0.00 -0.55 0.00 0.00 31.60 30.99 2dvh h MET 57 CO -0.01 0.06 -0.55 1.15 0.14 0.00 0.00 176.91 177.70 2dvh h THR 58 N -0.18 0.01 -0.75 -0.77 2.02 -0.54 0.14 112.91 112.83 2dvh h THR 58 Ca -0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.18 2dvh h THR 58 Cb 0.16 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 66.54 2dvh h THR 58 CO 0.01 0.00 0.50 -1.13 0.37 0.00 0.00 175.52 175.27 2dvh h ASN 59 N -0.40 0.86 0.86 4.18 -0.00 -0.72 0.91 115.58 121.27 2dvh h ASN 59 Ca 0.08 -0.02 -0.04 0.00 -0.00 0.00 0.00 56.30 56.31 2dvh h ASN 59 Cb 0.60 -0.21 0.01 0.00 -0.00 0.00 0.00 38.32 38.71 2dvh h ASN 59 CO -0.59 0.62 -0.41 0.00 -0.00 0.00 0.00 177.43 177.04 2dvh h ALA 60 N 1.28 -1.15 -0.61 1.57 0.00 -0.20 -3.07 119.26 117.07 2dvh h ALA 60 Ca 0.28 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2dvh h ALA 60 Cb -0.11 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2dvh h ALA 60 CO -0.06 -1.12 0.35 -0.24 0.00 0.00 0.00 179.25 178.18 2dvh h VAL 61 N -1.21 1.18 -0.20 0.00 3.04 -0.68 -2.17 116.25 116.20 2dvh h VAL 61 Ca -0.12 -0.41 0.06 0.00 -1.01 0.00 0.00 66.70 65.22 2dvh h VAL 61 Cb 0.89 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 30.49 2dvh h VAL 61 CO 0.19 0.19 0.25 0.50 -1.01 0.00 0.00 177.57 177.69 2dvh h LYS 62 N 0.84 0.00 0.00 4.17 3.64 -0.72 -0.29 116.57 124.21 2dvh h LYS 62 Ca 0.22 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2dvh h LYS 62 Cb -0.02 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2dvh h LYS 62 CO -0.04 0.00 -0.07 0.87 -2.27 0.00 0.00 179.45 177.94 2dvh h LYS 63 N 0.00 0.00 -6.54 1.90 1.79 -1.33 -3.43 116.57 108.95 2dvh h LYS 63 Ca 0.10 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 58.04 2dvh h LYS 63 Cb 0.59 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.22 2dvh h LYS 63 CO -0.00 0.07 0.23 0.00 -1.08 0.00 0.00 179.45 178.67 2dvh s ALA 64 N -3.82 3.39 0.77 3.86 0.00 -0.12 -5.08 121.76 120.77 2dvh s ALA 64 Ca -0.00 0.43 -0.09 0.00 0.00 0.00 0.00 51.96 52.29 2dvh s ALA 64 Cb 0.10 -3.05 0.09 0.00 0.00 0.00 0.00 23.12 20.26 2dvh s ALA 64 CO 0.55 0.20 1.11 -1.54 0.00 0.00 0.00 175.76 176.09 2dvh s SER 65 N -0.85 4.48 0.21 0.00 1.04 -1.26 -4.71 113.70 112.60 2dvh s SER 65 Ca 0.39 0.52 -0.11 0.00 0.48 0.00 0.00 55.95 57.23 2dvh s SER 65 Cb -0.23 -1.03 0.28 0.00 0.10 0.00 0.00 66.02 65.13 2dvh s SER 65 CO 0.27 -1.86 1.68 -2.24 0.98 0.00 0.00 173.24 172.07 2dvh h ASP 66 N -0.89 -0.19 -0.25 7.02 2.03 -1.98 0.16 116.42 122.32 2dvh h ASP 66 Ca -0.45 0.14 0.05 0.00 -0.73 0.00 0.00 57.03 56.04 2dvh h ASP 66 Cb 1.31 0.23 -0.05 0.00 -0.83 0.00 0.00 39.33 39.98 2dvh h ASP 66 CO 0.59 -0.07 -0.11 -0.08 -1.03 0.00 0.00 179.24 178.54 2dvh h GLU 67 N 0.15 -0.07 -0.10 4.15 4.22 -1.99 0.38 114.58 121.33 2dvh h GLU 67 Ca 0.31 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.75 2dvh h GLU 67 Cb 0.49 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2dvh h GLU 67 CO -0.47 -0.04 0.05 0.93 -2.18 0.00 0.00 179.01 177.29 2dvh h GLU 68 N -0.07 0.14 -0.11 1.92 4.39 -1.56 -0.38 114.58 118.91 2dvh h GLU 68 Ca 0.13 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.84 2dvh h GLU 68 Cb 0.26 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.85 2dvh h GLU 68 CO -0.29 0.22 -0.13 -0.07 -1.16 0.00 0.00 179.01 177.58 2dvh h LEU 69 N 0.03 -0.39 -0.59 1.33 3.38 -0.34 0.42 115.31 119.14 2dvh h LEU 69 Ca 0.03 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.14 2dvh h LEU 69 Cb 0.13 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 2dvh h LEU 69 CO -0.00 -0.17 0.29 0.11 0.09 0.00 0.00 178.44 178.76 2dvh h LYS 70 N -0.16 0.54 -0.33 1.13 1.57 -0.82 -0.31 116.57 118.18 2dvh h LYS 70 Ca 0.08 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 2dvh h LYS 70 Cb 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2dvh h LYS 70 CO -0.21 0.35 -0.19 0.00 -0.57 0.00 0.00 179.45 178.84 2dvh h ALA 71 N 1.33 1.06 -0.21 3.86 0.00 -0.33 0.82 119.26 125.79 2dvh h ALA 71 Ca 0.27 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2dvh h ALA 71 Cb 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2dvh h ALA 71 CO -0.20 0.57 0.06 1.25 0.00 0.00 0.00 179.25 180.93 2dvh h LEU 72 N 0.54 0.32 0.40 0.00 5.85 0.60 0.12 115.31 123.14 2dvh h LEU 72 Ca 0.09 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2dvh h LEU 72 Cb 0.63 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2dvh h LEU 72 CO 0.04 0.46 -0.43 0.00 -0.34 0.00 0.00 178.44 178.17 2dvh h ALA 73 N 0.87 -0.94 -0.88 1.25 0.00 -0.95 -1.58 119.26 117.03 2dvh h ALA 73 Ca 0.07 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 55.02 2dvh h ALA 73 Cb 0.26 0.64 -0.11 0.00 0.00 0.00 0.00 17.79 18.58 2dvh h ALA 73 CO 0.00 -1.07 0.41 0.22 0.00 0.00 0.00 179.25 178.81 2dvh h ASP 74 N -0.86 0.41 0.71 0.00 3.58 -0.58 0.13 116.42 119.82 2dvh h ASP 74 Ca -0.04 0.13 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 2dvh h ASP 74 Cb 0.77 0.08 -0.00 0.00 1.72 0.00 0.00 39.33 41.90 2dvh h ASP 74 CO -0.09 0.09 -0.43 0.22 -2.88 0.00 0.00 179.24 176.16 2dvh h TYR 75 N 0.49 -1.14 -0.09 0.28 3.20 -0.45 -2.78 116.97 116.48 2dvh h TYR 75 Ca 0.52 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.40 2dvh h TYR 75 Cb 0.90 0.40 -0.00 0.00 1.54 0.00 0.00 36.73 39.57 2dvh h TYR 75 CO -0.12 -0.64 0.13 0.52 -1.64 0.00 0.00 178.16 176.41 2dvh h MET 76 N -1.06 0.00 0.00 1.82 2.86 -0.47 -0.48 114.93 117.59 2dvh h MET 76 Ca -0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2dvh h MET 76 Cb 0.85 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.51 2dvh h MET 76 CO 0.10 0.00 0.00 0.77 1.06 0.00 0.00 176.91 178.84 2dvh h SER 77 N 0.00 0.00 -2.07 1.22 0.02 -0.48 0.13 113.55 112.36 2dvh h SER 77 Ca 0.04 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.47 2dvh h SER 77 Cb 0.30 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.44 2dvh h SER 77 CO -0.00 0.00 -1.03 0.29 -1.14 0.00 0.00 176.83 174.95 2dvh n LYS 78 N -2.76 1.52 0.00 3.45 5.02 -0.19 -4.47 118.16 120.72 2dvh n LYS 78 Ca 0.00 -3.75 0.00 0.00 -2.02 0.00 0.00 58.31 52.54 2dvh n LYS 78 Cb 0.22 -1.79 0.00 0.00 -0.02 0.00 0.00 35.03 33.44 2dvh n LYS 78 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77