#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 3.49 0.00 0.00 9.92 -1.26 -4.69 116.55 124.01 2dvh n ASP 2 Ca 0.00 -2.05 0.00 0.00 -0.53 0.00 0.00 54.79 52.21 2dvh n ASP 2 Cb 0.00 -0.85 0.00 0.00 -0.64 0.00 0.00 41.12 39.63 2dvh n ASP 2 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dvh n GLY 3 N 2.21 0.91 0.32 0.44 0.00 -1.25 -4.69 105.19 103.11 2dvh n GLY 3 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 2dvh n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvh h ALA 4 N 0.00 1.16 0.00 4.61 0.00 -1.90 0.12 119.26 123.25 2dvh h ALA 4 Ca 0.00 0.28 0.02 0.00 0.00 0.00 0.00 54.91 55.21 2dvh h ALA 4 Cb 0.00 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2dvh h ALA 4 CO 0.00 -0.52 -0.16 0.00 0.00 0.00 0.00 179.25 178.58 2dvh h ALA 5 N 1.85 -0.19 -0.77 0.00 0.00 -1.92 -2.63 119.26 115.61 2dvh h ALA 5 Ca 0.55 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.41 2dvh h ALA 5 Cb 1.12 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 2dvh h ALA 5 CO -0.77 -0.65 0.27 -0.07 0.00 0.00 0.00 179.25 178.03 2dvh h LEU 6 N -0.26 1.08 -1.96 0.00 4.07 -1.35 -2.85 115.31 114.04 2dvh h LEU 6 Ca 0.05 -0.19 0.06 0.00 0.08 0.00 0.00 57.88 57.88 2dvh h LEU 6 Cb 0.33 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 2dvh h LEU 6 CO -0.15 0.98 0.40 0.22 -1.08 0.00 0.00 178.44 178.81 2dvh h TYR 7 N 1.13 0.00 -0.55 1.13 3.20 -0.49 0.40 116.97 121.79 2dvh h TYR 7 Ca 0.25 0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.22 2dvh h TYR 7 Cb 0.26 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 2dvh h TYR 7 CO 0.02 0.00 0.37 0.87 -1.64 0.00 0.00 178.16 177.78 2dvh h LYS 8 N 0.00 0.29 -1.16 1.82 1.57 -1.45 0.02 116.57 117.66 2dvh h LYS 8 Ca 0.09 -0.02 -0.51 0.00 -1.87 0.00 0.00 60.65 58.35 2dvh h LYS 8 Cb 0.89 -0.06 -0.23 0.00 0.08 0.00 0.00 32.23 32.90 2dvh h LYS 8 CO -0.00 0.19 0.65 0.43 -0.57 0.00 0.00 179.45 180.15 2dvh n SER 9 N -4.46 6.36 0.00 0.86 7.64 0.13 -4.12 113.62 120.03 2dvh n SER 9 Ca 0.09 -3.45 0.00 0.00 1.01 0.00 0.00 58.87 56.52 2dvh n SER 9 Cb 0.40 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 2dvh n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dvh n ILE 11 N -2.11 1.87 0.00 0.00 -5.35 -0.50 -1.53 119.36 111.75 2dvh n ILE 11 Ca 0.00 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 2dvh n ILE 11 Cb 0.00 -1.23 0.00 0.00 -1.74 0.00 0.00 39.64 36.67 2dvh n ILE 11 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dvh n GLY 12 N 1.16 3.14 0.13 3.28 0.00 -1.26 -4.75 105.19 106.89 2dvh n GLY 12 Ca 0.08 -0.96 -0.23 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 -3.84 0.73 0.00 0.00 8.25 -0.79 -3.24 115.22 116.33 2dvh n HIS 14 Ca -0.45 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 2dvh n HIS 14 Cb 0.91 -1.12 0.00 0.00 1.12 0.00 0.00 29.99 30.90 2dvh n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dvh n GLY 15 N 1.73 -0.42 0.30 -1.41 0.00 -1.26 -0.23 105.19 103.90 2dvh n GLY 15 Ca -0.25 -1.76 0.07 0.00 0.00 0.00 0.00 46.02 44.08 2dvh n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvh h ALA 16 N 0.00 0.83 -3.00 4.61 0.00 -1.96 -3.28 119.26 116.47 2dvh h ALA 16 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2dvh h ALA 16 Cb 0.00 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2dvh h ALA 16 CO 0.00 -0.45 0.00 -0.25 0.00 0.00 0.00 179.25 178.55 2dvh n ASP 17 N -5.43 0.00 0.00 0.00 9.92 -1.26 -5.06 116.55 114.72 2dvh n ASP 17 Ca 0.16 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.42 2dvh n ASP 17 Cb 0.54 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.02 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 3.90 -1.15 0.00 0.44 0.00 -1.23 -4.88 105.19 102.26 2dvh n GLY 18 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 0.00 0.00 -4.76 1.61 7.64 0.67 -0.80 113.62 117.98 2dvh n SER 19 Ca 0.00 -1.00 -0.29 0.00 1.01 0.00 0.00 58.87 58.59 2dvh n SER 19 Cb 0.00 0.00 0.13 0.00 -1.01 0.00 0.00 64.21 63.33 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 0.00 1.31 0.03 1.43 -2.85 -0.31 -4.80 119.74 114.56 2dvh s LYS 20 Ca 0.00 0.50 -0.30 0.00 -1.00 0.00 0.00 55.97 55.16 2dvh s LYS 20 Cb 0.00 -1.84 -0.07 0.00 -2.06 0.00 0.00 37.83 33.86 2dvh s LYS 20 CO 0.00 -2.12 1.59 0.00 0.10 0.00 0.00 175.35 174.92 2dvh s ALA 21 N -3.15 3.65 0.00 0.59 0.00 -1.26 -4.65 121.76 116.94 2dvh s ALA 21 Ca 0.63 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2dvh s ALA 21 Cb -0.16 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.29 2dvh s ALA 21 CO 0.55 -1.10 0.00 0.00 0.00 0.00 0.00 175.76 175.21 2dvh n ALA 22 N 5.77 0.00 -1.26 0.00 0.00 -1.20 -4.80 120.51 119.02 2dvh n ALA 22 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.23 2dvh n ALA 22 Cb 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.84 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 2.91 0.00 0.00 0.00 -1.26 -4.78 117.12 113.99 2dvh n MET 23 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 57.70 55.62 2dvh n MET 23 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 33.22 30.38 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 3.84 -1.72 3.66 3.17 0.00 -1.26 -4.98 105.19 107.90 2dvh n GLY 24 Ca 0.62 -1.99 -0.45 0.00 0.00 0.00 0.00 46.02 44.19 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 0.10 2.59 -3.67 1.61 7.64 -1.26 -4.83 113.62 115.80 2dvh n SER 25 Ca 0.00 1.14 -0.14 0.00 1.01 0.00 0.00 58.87 60.88 2dvh n SER 25 Cb 0.00 -1.40 -0.08 0.00 -1.01 0.00 0.00 64.21 61.72 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 -0.03 -1.41 0.30 -0.43 0.00 -1.26 -4.89 121.76 114.04 2dvh s ALA 26 Ca 0.69 1.52 -0.30 0.00 0.00 0.00 0.00 51.96 53.88 2dvh s ALA 26 Cb -0.68 -0.81 -0.12 0.00 0.00 0.00 0.00 23.12 21.51 2dvh s ALA 26 CO 0.49 -0.28 1.53 1.63 0.00 0.00 0.00 175.76 179.14 2dvh n LYS 27 N 2.55 2.58 -2.27 0.00 4.76 -1.26 -4.89 118.16 119.63 2dvh n LYS 27 Ca -0.14 0.91 -0.41 0.00 -2.87 0.00 0.00 58.31 55.80 2dvh n LYS 27 Cb 0.56 -2.66 -0.03 0.00 -1.84 0.00 0.00 35.03 31.06 2dvh n LYS 27 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2dvh s PRO 28 N -0.87 4.46 0.06 1.97 0.04 -1.26 -4.93 135.00 134.46 2dvh s PRO 28 Ca 0.62 2.02 -0.07 0.00 0.04 0.00 0.00 61.00 63.61 2dvh s PRO 28 Cb -0.52 -3.15 -0.30 0.00 0.04 0.00 0.00 34.50 30.57 2dvh s PRO 28 CO 0.52 -0.08 1.09 -0.39 0.04 0.00 0.00 177.00 178.19 2dvh h VAL 29 N 3.30 1.43 0.00 -0.36 -1.51 -1.34 -3.43 116.25 114.35 2dvh h VAL 29 Ca -0.47 -2.97 -0.37 0.00 -1.23 0.00 0.00 66.70 61.66 2dvh h VAL 29 Cb 1.22 2.97 -0.09 0.00 -2.13 0.00 0.00 31.29 33.25 2dvh h VAL 29 CO 0.70 0.87 1.69 1.17 -1.23 0.00 0.00 177.57 180.77 2dvh n LYS 30 N -3.58 0.00 -3.39 5.19 4.81 -0.10 -1.19 118.16 119.91 2dvh n LYS 30 Ca -0.11 0.00 -0.19 0.00 -0.87 0.00 0.00 58.31 57.14 2dvh n LYS 30 Cb 1.05 -1.08 0.07 0.00 0.02 0.00 0.00 35.03 35.08 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 5.26 -0.30 0.26 3.14 0.00 0.38 -4.94 105.19 108.99 2dvh n GLY 31 Ca 0.59 0.10 -0.10 0.00 0.00 0.00 0.00 46.02 46.61 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 -2.16 -0.60 0.00 1.61 4.20 -1.36 -3.48 115.11 113.32 2dvh h GLN 32 Ca -0.49 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.26 2dvh h GLN 32 Cb 1.31 0.14 0.00 0.00 0.30 0.00 0.00 27.48 29.22 2dvh h GLN 32 CO 0.46 -0.40 0.00 0.41 -0.67 0.00 0.00 178.83 178.64 2dvh n GLY 33 N -1.32 2.16 0.33 3.46 0.00 -1.26 -4.97 105.19 103.58 2dvh n GLY 33 Ca -0.08 0.19 0.23 0.00 0.00 0.00 0.00 46.02 46.36 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 1.80 0.41 4.61 0.00 -1.87 0.26 119.26 124.47 2dvh h ALA 34 Ca 0.00 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2dvh h ALA 34 Cb 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2dvh h ALA 34 CO 0.00 -0.65 -0.27 0.93 0.00 0.00 0.00 179.25 179.26 2dvh h GLU 35 N 0.19 -0.63 0.60 0.00 5.08 -1.96 0.22 114.58 118.06 2dvh h GLU 35 Ca 0.72 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 59.10 2dvh h GLU 35 Cb 1.67 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 31.06 2dvh h GLU 35 CO -0.69 -0.42 -0.44 1.49 -1.00 0.00 0.00 179.01 177.94 2dvh h GLU 36 N -0.66 -0.97 -0.59 2.33 4.81 -1.09 -1.56 114.58 116.86 2dvh h GLU 36 Ca -0.04 0.07 0.10 0.00 -0.13 0.00 0.00 59.36 59.36 2dvh h GLU 36 Cb 0.55 0.22 -0.08 0.00 0.63 0.00 0.00 28.75 30.07 2dvh h GLU 36 CO 0.03 -0.65 0.17 -0.07 -0.73 0.00 0.00 179.01 177.77 2dvh h LEU 37 N -1.01 0.11 0.12 1.64 3.38 -0.64 0.82 115.31 119.74 2dvh h LEU 37 Ca -0.07 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2dvh h LEU 37 Cb 0.84 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2dvh h LEU 37 CO 0.02 0.07 -0.06 0.22 0.09 0.00 0.00 178.44 178.79 2dvh h TYR 38 N 0.33 -0.15 -0.11 1.13 3.20 -0.39 0.25 116.97 121.22 2dvh h TYR 38 Ca 0.30 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.17 2dvh h TYR 38 Cb 0.42 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2dvh h TYR 38 CO -0.21 -0.05 0.07 0.87 -1.64 0.00 0.00 178.16 177.21 2dvh h LYS 39 N -0.21 0.15 0.14 1.82 1.57 -0.68 0.12 116.57 119.49 2dvh h LYS 39 Ca -0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2dvh h LYS 39 Cb 0.16 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2dvh h LYS 39 CO 0.03 0.11 -0.07 0.87 -0.57 0.00 0.00 179.45 179.82 2dvh h LYS 40 N 0.15 -0.18 -0.59 3.15 1.79 -0.79 0.22 116.57 120.31 2dvh h LYS 40 Ca 0.04 0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 58.48 2dvh h LYS 40 Cb -0.01 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 30.66 2dvh h LYS 40 CO -0.01 -0.07 0.19 0.00 -1.08 0.00 0.00 179.45 178.48 2dvh h MET 41 N -0.24 0.92 -0.61 3.15 -0.00 -0.40 0.17 114.93 117.92 2dvh h MET 41 Ca -0.02 -0.20 -0.04 0.00 -0.00 0.00 0.00 59.70 59.44 2dvh h MET 41 Cb 0.19 -0.13 -0.03 0.00 -0.00 0.00 0.00 31.60 31.63 2dvh h MET 41 CO 0.03 0.82 0.22 -0.22 -0.00 0.00 0.00 176.91 177.76 2dvh h LYS 42 N 0.84 0.92 -0.30 -0.10 3.64 -0.70 0.10 116.57 120.97 2dvh h LYS 42 Ca 0.19 -0.18 0.04 0.00 -1.27 0.00 0.00 60.65 59.43 2dvh h LYS 42 Cb 0.28 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 2dvh h LYS 42 CO -0.01 0.80 0.06 0.78 -2.27 0.00 0.00 179.45 178.81 2dvh h GLY 43 N 0.85 0.35 0.85 5.01 0.00 0.16 0.16 103.07 110.44 2dvh h GLY 43 Ca 0.20 -0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.51 2dvh h GLY 43 CO -0.01 -0.01 -0.17 -0.97 0.00 0.00 0.00 176.54 175.38 2dvh h TYR 44 N 0.17 -0.43 -0.59 5.60 0.05 -0.42 0.16 116.97 121.51 2dvh h TYR 44 Ca 0.14 -0.00 0.11 0.00 0.05 0.00 0.00 58.73 59.03 2dvh h TYR 44 Cb 0.15 0.16 -0.08 0.00 1.01 0.00 0.00 36.73 37.97 2dvh h TYR 44 CO -0.17 -0.25 0.15 0.00 -1.05 0.00 0.00 178.16 176.84 2dvh h ALA 45 N 0.38 0.72 -0.59 3.88 0.00 -0.53 -1.30 119.26 121.81 2dvh h ALA 45 Ca -0.01 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2dvh h ALA 45 Cb 0.34 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2dvh h ALA 45 CO -0.02 -0.28 0.02 0.22 0.00 0.00 0.00 179.25 179.20 2dvh h ASP 46 N 0.29 0.98 0.00 0.00 3.58 -0.46 -3.41 116.42 117.40 2dvh h ASP 46 Ca 0.31 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2dvh h ASP 46 Cb 0.44 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.23 2dvh h ASP 46 CO -0.37 1.02 0.00 0.61 -2.88 0.00 0.00 179.24 177.62 2dvh n GLY 47 N -0.51 0.41 0.30 -0.78 0.00 0.53 -4.99 105.19 100.15 2dvh n GLY 47 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 2dvh n GLY 47 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dvh h SER 48 N 0.00 -0.64 0.00 1.61 4.64 -1.72 -3.07 113.55 114.37 2dvh h SER 48 Ca 0.00 0.02 -0.67 0.00 -0.47 0.00 0.00 61.79 60.68 2dvh h SER 48 Cb 0.00 0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2dvh h SER 48 CO 0.00 -0.41 3.21 0.00 -0.87 0.00 0.00 176.83 178.76 2dvh n TYR 49 N -4.25 2.83 0.00 4.77 9.36 -1.08 -4.56 117.16 124.24 2dvh n TYR 49 Ca -0.09 -2.79 0.00 0.00 3.32 0.00 0.00 57.90 58.34 2dvh n TYR 49 Cb 0.30 -2.37 0.00 0.00 -0.63 0.00 0.00 39.34 36.64 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 0.79 5.00 2.98 0.00 -1.16 -3.39 105.19 113.38 2dvh n GLY 50 Ca 0.59 0.44 0.00 0.00 0.00 0.00 0.00 46.02 47.05 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 1.16 0.00 -0.02 0.00 -1.19 -4.82 105.19 100.32 2dvh n GLY 51 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2dvh n GLY 51 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dvh n GLU 52 N 0.00 3.27 -0.33 1.61 1.02 -1.26 -4.49 120.64 120.46 2dvh n GLU 52 Ca 0.00 0.00 0.29 0.00 -0.02 0.00 0.00 57.16 57.43 2dvh n GLU 52 Cb 0.00 0.00 0.54 0.00 -0.02 0.00 0.00 31.44 31.96 2dvh n GLU 52 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 2dvh h ARG 53 N 0.00 0.13 -1.60 3.49 0.11 -1.98 0.51 114.38 115.04 2dvh h ARG 53 Ca 0.00 -0.01 0.50 0.00 0.10 0.00 0.00 59.98 60.57 2dvh h ARG 53 Cb 0.00 -0.03 -0.11 0.00 1.11 0.00 0.00 29.97 30.95 2dvh h ARG 53 CO 0.00 0.09 1.10 0.87 0.10 0.00 0.00 179.97 182.12 2dvh h LYS 54 N 0.14 0.03 -0.71 0.08 1.79 -1.87 -3.13 116.57 112.89 2dvh h LYS 54 Ca 0.80 -0.00 0.18 0.00 -2.18 0.00 0.00 60.65 59.45 2dvh h LYS 54 Cb 2.02 -0.01 -0.13 0.00 -1.58 0.00 0.00 32.23 32.53 2dvh h LYS 54 CO -0.70 0.02 -0.03 0.00 -1.08 0.00 0.00 179.45 177.66 2dvh n ALA 55 N -2.70 0.32 0.20 3.86 0.00 0.17 -0.36 120.51 122.00 2dvh n ALA 55 Ca 0.40 0.76 -0.15 0.00 0.00 0.00 0.00 53.44 54.46 2dvh n ALA 55 Cb 1.69 -0.54 -0.07 0.00 0.00 0.00 0.00 19.45 20.53 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 -0.52 -0.03 0.00 2.86 -1.82 -0.17 114.93 115.24 2dvh h MET 56 Ca 0.41 0.04 0.02 0.00 -2.06 0.00 0.00 59.70 58.10 2dvh h MET 56 Cb 0.80 0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 2dvh h MET 56 CO -0.68 -0.35 -0.06 1.98 1.06 0.00 0.00 176.91 178.86 2dvh h MET 57 N -0.54 -0.09 -0.50 1.72 -1.53 -0.95 -0.90 114.93 112.14 2dvh h MET 57 Ca -0.03 0.01 0.07 0.00 -3.44 0.00 0.00 59.70 56.31 2dvh h MET 57 Cb 0.46 0.02 -0.09 0.00 -0.55 0.00 0.00 31.60 31.44 2dvh h MET 57 CO 0.01 -0.06 -0.50 1.15 0.14 0.00 0.00 176.91 177.66 2dvh h THR 58 N -0.09 0.05 -0.88 -0.77 2.02 -0.57 0.14 112.91 112.80 2dvh h THR 58 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.22 2dvh h THR 58 Cb 0.14 0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.55 2dvh h THR 58 CO -0.08 0.00 0.57 -1.13 0.37 0.00 0.00 175.52 175.24 2dvh h ASN 59 N -0.31 1.03 0.87 4.18 -0.00 -0.73 0.13 115.58 120.74 2dvh h ASN 59 Ca 0.13 -0.04 -0.04 0.00 -0.00 0.00 0.00 56.30 56.34 2dvh h ASN 59 Cb 0.58 -0.26 0.01 0.00 -0.00 0.00 0.00 38.32 38.64 2dvh h ASN 59 CO -0.64 0.76 -0.43 0.00 -0.00 0.00 0.00 177.43 177.12 2dvh h ALA 60 N 1.31 -1.18 -0.04 1.57 0.00 0.31 -2.97 119.26 118.26 2dvh h ALA 60 Ca 0.32 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2dvh h ALA 60 Cb -0.11 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2dvh h ALA 60 CO -0.07 -1.17 -0.22 -0.39 0.00 0.00 0.00 179.25 177.40 2dvh h VAL 61 N -1.18 1.18 -0.23 0.00 -1.51 -0.68 -2.35 116.25 111.48 2dvh h VAL 61 Ca -0.12 -0.85 0.07 0.00 -1.23 0.00 0.00 66.70 64.57 2dvh h VAL 61 Cb 0.91 1.41 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 2dvh h VAL 61 CO 0.19 0.25 0.26 0.50 -1.23 0.00 0.00 177.57 177.54 2dvh h LYS 62 N 0.05 0.00 0.00 5.19 3.64 -0.58 0.05 116.57 124.93 2dvh h LYS 62 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2dvh h LYS 62 Cb 0.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2dvh h LYS 62 CO 0.03 0.00 0.00 0.87 -2.27 0.00 0.00 179.45 178.08 2dvh h LYS 63 N 0.00 0.00 -6.71 1.90 1.79 -1.38 -3.44 116.57 108.72 2dvh h LYS 63 Ca 0.11 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 58.07 2dvh h LYS 63 Cb 0.64 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.28 2dvh h LYS 63 CO -0.00 0.00 0.43 0.00 -1.08 0.00 0.00 179.45 178.80 2dvh s ALA 64 N -3.62 3.36 0.81 3.86 0.00 0.00 -5.06 121.76 121.11 2dvh s ALA 64 Ca 0.02 0.76 -0.12 0.00 0.00 0.00 0.00 51.96 52.61 2dvh s ALA 64 Cb 0.09 -3.30 0.08 0.00 0.00 0.00 0.00 23.12 19.99 2dvh s ALA 64 CO 0.52 -0.06 1.14 -1.12 0.00 0.00 0.00 175.76 176.24 2dvh s SER 65 N -0.59 4.50 0.20 0.00 0.01 -1.26 -4.67 113.70 111.89 2dvh s SER 65 Ca 0.45 0.98 -0.13 0.00 1.31 0.00 0.00 55.95 58.57 2dvh s SER 65 Cb -0.28 -1.60 0.22 0.00 0.21 0.00 0.00 66.02 64.56 2dvh s SER 65 CO 0.35 -1.93 1.66 -2.24 0.41 0.00 0.00 173.24 171.49 2dvh h ASP 66 N -1.07 -0.38 -0.35 2.44 2.03 -1.99 0.20 116.42 117.31 2dvh h ASP 66 Ca -0.47 0.15 0.07 0.00 -0.73 0.00 0.00 57.03 56.05 2dvh h ASP 66 Cb 1.30 0.29 -0.06 0.00 -0.83 0.00 0.00 39.33 40.03 2dvh h ASP 66 CO 0.64 -0.14 -0.06 -0.08 -1.03 0.00 0.00 179.24 178.57 2dvh h GLU 67 N 0.05 0.03 0.09 4.15 4.22 -1.99 -0.83 114.58 120.31 2dvh h GLU 67 Ca 0.28 -0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.71 2dvh h GLU 67 Cb 0.44 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2dvh h GLU 67 CO -0.53 0.02 -0.05 0.93 -2.18 0.00 0.00 179.01 177.21 2dvh h GLU 68 N 0.03 -0.12 -0.13 1.92 4.39 -1.44 -0.01 114.58 119.22 2dvh h GLU 68 Ca 0.17 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.92 2dvh h GLU 68 Cb 0.25 0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.87 2dvh h GLU 68 CO -0.34 0.05 -0.34 -0.07 -1.16 0.00 0.00 179.01 177.16 2dvh h LEU 69 N -0.28 -1.05 -0.24 1.33 3.38 -0.34 0.50 115.31 118.62 2dvh h LEU 69 Ca -0.01 0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.15 2dvh h LEU 69 Cb 0.23 0.44 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 2dvh h LEU 69 CO 0.02 -0.37 -0.02 0.11 0.09 0.00 0.00 178.44 178.27 2dvh h LYS 70 N -0.41 0.05 -0.06 1.13 1.57 -1.10 -1.32 116.57 116.43 2dvh h LYS 70 Ca 0.09 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 2dvh h LYS 70 Cb 0.56 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 2dvh h LYS 70 CO -0.36 0.03 -0.11 0.00 -0.57 0.00 0.00 179.45 178.45 2dvh h ALA 71 N 1.21 1.71 -0.16 3.86 0.00 -0.28 -0.36 119.26 125.25 2dvh h ALA 71 Ca 0.11 -0.13 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 2dvh h ALA 71 Cb 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.91 2dvh h ALA 71 CO -0.21 0.21 -0.75 1.25 0.00 0.00 0.00 179.25 179.75 2dvh h LEU 72 N 0.09 0.90 0.10 0.00 5.85 0.79 0.75 115.31 123.78 2dvh h LEU 72 Ca 0.02 -0.58 -0.00 0.00 0.84 0.00 0.00 57.88 58.16 2dvh h LEU 72 Cb 0.25 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 2dvh h LEU 72 CO 0.02 1.37 -0.06 0.00 -0.34 0.00 0.00 178.44 179.43 2dvh h ALA 73 N 0.61 -0.15 -0.23 1.25 0.00 -0.77 0.24 119.26 120.21 2dvh h ALA 73 Ca -0.04 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2dvh h ALA 73 Cb 1.38 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.18 2dvh h ALA 73 CO 0.15 -0.59 -0.17 0.22 0.00 0.00 0.00 179.25 178.86 2dvh h ASP 74 N -0.16 -0.56 0.08 0.00 3.58 -0.93 0.96 116.42 119.40 2dvh h ASP 74 Ca -0.01 0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.58 2dvh h ASP 74 Cb 0.13 0.28 -0.05 0.00 1.72 0.00 0.00 39.33 41.41 2dvh h ASP 74 CO 0.01 -0.21 -0.43 0.22 -2.88 0.00 0.00 179.24 175.95 2dvh h TYR 75 N -0.17 -1.23 -0.17 0.28 3.20 -0.64 -1.27 116.97 116.98 2dvh h TYR 75 Ca 0.13 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.08 2dvh h TYR 75 Cb 0.37 0.53 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 2dvh h TYR 75 CO -0.33 -0.52 0.13 0.52 -1.64 0.00 0.00 178.16 176.31 2dvh h MET 76 N -0.64 0.00 0.00 1.82 2.86 -0.58 0.61 114.93 119.00 2dvh h MET 76 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2dvh h MET 76 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2dvh h MET 76 CO -0.27 0.00 0.00 0.45 1.06 0.00 0.00 176.91 178.15 2dvh n SER 77 N -4.37 0.00 -3.04 1.22 2.88 0.30 -0.47 113.62 110.15 2dvh n SER 77 Ca 0.01 -0.32 -0.15 0.00 -1.33 0.00 0.00 58.87 57.08 2dvh n SER 77 Cb 0.26 -0.18 -0.01 0.00 -0.75 0.00 0.00 64.21 63.53 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 -1.18 1.01 0.00 -1.46 4.81 0.20 -4.65 118.16 116.89 2dvh n LYS 78 Ca 0.14 -3.21 0.00 0.00 -0.87 0.00 0.00 58.31 54.37 2dvh n LYS 78 Cb 0.15 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 33.68 2dvh n LYS 78 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46