#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdh n ALA 20 N 0.00 0.00 -2.34 3.14 0.00 -1.26 -5.11 120.51 114.94 2wdh n ALA 20 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2wdh n ALA 20 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2wdh n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wdh s LYS 21 N 0.00 4.27 0.65 0.00 1.02 -1.26 -4.90 119.74 119.53 2wdh s LYS 21 Ca 0.00 1.80 0.33 0.00 0.02 0.00 0.00 55.97 58.12 2wdh s LYS 21 Cb 0.00 -3.69 1.80 0.00 -0.52 0.00 0.00 37.83 35.42 2wdh s LYS 21 CO 0.00 -0.62 2.04 0.28 -0.92 0.00 0.00 175.35 176.13 2wdh h VAL 22 N 5.23 0.08 0.00 3.17 2.07 -1.52 -3.26 116.25 122.02 2wdh h VAL 22 Ca -0.33 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2wdh h VAL 22 Cb 1.15 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2wdh h VAL 22 CO 0.93 0.00 0.00 1.17 0.02 0.00 0.00 177.57 179.69 2wdh n LYS 23 N -3.09 0.00 -1.97 1.57 3.00 -0.63 -2.63 118.16 114.42 2wdh n LYS 23 Ca -0.01 0.71 -0.38 0.00 -0.00 0.00 0.00 58.31 58.63 2wdh n LYS 23 Cb 0.33 -1.35 -0.01 0.00 0.00 0.00 0.00 35.03 34.00 2wdh n LYS 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wdh n ALA 24 N -2.16 6.72 -0.62 3.14 0.00 -1.23 -3.55 120.51 122.81 2wdh n ALA 24 Ca 0.00 -3.98 0.00 0.00 0.00 0.00 0.00 53.44 49.46 2wdh n ALA 24 Cb 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 19.45 16.80 2wdh n ALA 24 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2wdh n THR 25 N 1.48 0.23 -4.08 0.00 -1.04 -1.08 -5.03 114.28 104.76 2wdh n THR 25 Ca 0.60 -0.31 -0.09 0.00 -2.04 0.00 0.00 64.05 62.21 2wdh n THR 25 Cb 0.29 1.12 -0.10 0.00 -1.82 0.00 0.00 70.33 69.81 2wdh n THR 25 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2wdh s LEU 26 N -0.23 2.41 0.00 -4.42 1.43 -1.23 -5.10 118.68 111.53 2wdh s LEU 26 Ca 0.00 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 2wdh s LEU 26 Cb 0.00 0.05 0.00 0.00 0.03 0.00 0.00 46.19 46.27 2wdh s LEU 26 CO 0.00 -0.44 0.00 0.61 0.23 0.00 0.00 176.35 176.75 2wdh n GLY 27 N 0.58 0.23 3.71 -3.19 0.00 -1.26 -4.95 105.19 100.32 2wdh n GLY 27 Ca -0.17 -1.34 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 2wdh n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdh s GLU 28 N 0.00 4.51 -0.11 1.61 2.12 -1.26 -5.04 118.70 120.53 2wdh s GLU 28 Ca 0.00 1.18 -0.13 0.00 0.36 0.00 0.00 54.97 56.38 2wdh s GLU 28 Cb 0.00 -3.45 0.03 0.00 0.26 0.00 0.00 34.13 30.97 2wdh s GLU 28 CO 0.00 0.01 0.35 -0.59 -0.54 0.00 0.00 175.26 174.49 2wdh s PHE 29 N 0.89 -0.35 -0.92 5.30 -0.12 -1.26 -5.10 117.98 116.42 2wdh s PHE 29 Ca 0.46 0.82 -0.24 0.00 -0.05 0.00 0.00 56.93 57.92 2wdh s PHE 29 Cb -0.20 0.13 0.03 0.00 -0.63 0.00 0.00 43.02 42.35 2wdh s PHE 29 CO 0.24 -0.24 1.51 0.34 -0.05 0.00 0.00 175.22 177.02 2wdh s ASP 30 N -0.15 6.16 0.00 1.98 2.15 -1.26 -4.86 116.67 120.70 2wdh s ASP 30 Ca -0.03 -1.02 0.00 0.00 0.43 0.00 0.00 52.55 51.93 2wdh s ASP 30 Cb -0.03 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 2wdh s ASP 30 CO 0.01 -1.81 1.22 0.00 -0.17 0.00 0.00 175.17 174.42 2wdh n LEU 31 N 9.94 3.43 -0.03 -1.34 -0.00 -1.26 -1.70 117.00 126.04 2wdh n LEU 31 Ca 0.27 -1.62 -0.03 0.00 -0.00 0.00 0.00 56.01 54.62 2wdh n LEU 31 Cb 0.50 -0.65 -0.03 0.00 -0.00 0.00 0.00 43.42 43.23 2wdh n LEU 31 CO 0.66 0.61 -0.67 -1.14 -0.00 0.00 0.00 177.39 176.86 2wdh n ARG 32 N 0.95 2.21 -1.81 1.47 3.00 -1.26 -4.26 116.66 116.96 2wdh n ARG 32 Ca 0.00 0.01 -0.42 0.00 -0.00 0.00 0.00 57.85 57.44 2wdh n ARG 32 Cb 0.44 -1.12 -0.03 0.00 0.00 0.00 0.00 32.46 31.75 2wdh n ARG 32 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2wdh s ASP 33 N -3.92 6.53 -0.58 6.15 3.68 -0.69 -4.87 116.67 122.97 2wdh s ASP 33 Ca -0.04 2.52 -0.02 0.00 2.13 0.00 0.00 52.55 57.14 2wdh s ASP 33 Cb 0.02 -2.54 0.35 0.00 -1.45 0.00 0.00 42.92 39.29 2wdh s ASP 33 CO 0.18 -0.99 2.09 0.00 0.13 0.00 0.00 175.17 176.57 2wdh n TYR 34 N 7.03 2.63 0.00 -5.34 0.18 -1.26 -4.53 117.16 115.87 2wdh n TYR 34 Ca 0.18 -2.59 0.00 0.00 1.88 0.00 0.00 57.90 57.38 2wdh n TYR 34 Cb 0.41 -1.29 0.00 0.00 -0.38 0.00 0.00 39.34 38.09 2wdh n TYR 34 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2wdh n ARG 35 N -0.40 0.00 -0.06 -3.48 1.74 -1.26 -4.44 116.66 108.77 2wdh n ARG 35 Ca 0.52 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.58 2wdh n ARG 35 Cb 0.58 -0.35 -0.01 0.00 -1.02 0.00 0.00 32.46 31.66 2wdh n ARG 35 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2wdh n ASN 36 N -1.84 0.05 -0.52 0.55 6.94 -1.26 -4.62 115.26 114.55 2wdh n ASN 36 Ca 0.00 -1.94 0.39 0.00 -0.02 0.00 0.00 54.58 53.02 2wdh n ASN 36 Cb 0.01 -0.47 0.61 0.00 -2.36 0.00 0.00 39.78 37.57 2wdh n ASN 36 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2wdh n VAL 37 N 4.96 -0.02 0.03 3.53 0.24 -1.26 0.12 118.33 125.93 2wdh n VAL 37 Ca 0.02 1.15 -0.13 0.00 -2.04 0.00 0.00 64.34 63.34 2wdh n VAL 37 Cb 0.02 -1.91 -0.09 0.00 -1.47 0.00 0.00 33.84 30.40 2wdh n VAL 37 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2wdh h GLU 38 N 0.00 -0.05 0.68 7.34 5.08 -1.99 1.22 114.58 126.86 2wdh h GLU 38 Ca 0.71 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 59.04 2wdh h GLU 38 Cb 2.79 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 32.04 2wdh h GLU 38 CO -0.04 0.22 -0.49 0.28 -1.00 0.00 0.00 179.01 177.97 2wdh h VAL 39 N -0.32 0.03 0.26 3.13 2.07 0.59 -3.22 116.25 118.79 2wdh h VAL 39 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2wdh h VAL 39 Cb 0.29 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2wdh h VAL 39 CO 0.01 0.00 -0.18 -0.07 0.02 0.00 0.00 177.57 177.35 2wdh h LEU 40 N -1.12 -0.45 -1.84 2.57 3.38 -1.45 -2.97 115.31 113.43 2wdh h LEU 40 Ca -0.09 0.03 0.53 0.00 0.09 0.00 0.00 57.88 58.44 2wdh h LEU 40 Cb 0.92 0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.72 2wdh h LEU 40 CO 0.04 -0.28 1.23 0.50 0.09 0.00 0.00 178.44 180.02 2wdh h LYS 41 N -0.43 0.01 0.00 1.13 1.63 0.15 0.62 116.57 119.68 2wdh h LYS 41 Ca -0.02 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2wdh h LYS 41 Cb 0.37 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.00 2wdh h LYS 41 CO 0.01 0.01 0.00 -2.13 -3.45 0.00 0.00 179.45 173.89 2wdh n ARG 42 N -4.16 0.05 0.00 1.90 0.63 -1.12 -2.51 116.66 111.46 2wdh n ARG 42 Ca 0.42 0.28 0.11 0.00 -0.92 0.00 0.00 57.85 57.73 2wdh n ARG 42 Cb 1.82 -1.60 0.04 0.00 0.45 0.00 0.00 32.46 33.18 2wdh n ARG 42 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2wdh n PHE 43 N -1.70 0.02 -3.21 -0.14 3.01 0.22 -4.90 117.46 110.76 2wdh n PHE 43 Ca 0.03 0.01 -0.39 0.00 1.01 0.00 0.00 57.45 58.11 2wdh n PHE 43 Cb 0.20 -0.14 -0.05 0.00 -0.01 0.00 0.00 39.48 39.47 2wdh n PHE 43 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2wdh s LEU 44 N -3.10 4.34 0.00 4.37 1.43 -1.04 -2.37 118.68 122.32 2wdh s LEU 44 Ca 0.09 1.05 -0.03 0.00 -1.03 0.00 0.00 54.13 54.20 2wdh s LEU 44 Cb 0.16 -2.88 0.05 0.00 0.03 0.00 0.00 46.19 43.56 2wdh s LEU 44 CO 0.80 0.02 0.12 -1.54 0.23 0.00 0.00 176.35 175.97 2wdh n SER 45 N 3.30 -2.00 -0.20 2.29 3.41 0.33 -4.77 113.62 115.99 2wdh n SER 45 Ca -0.06 -0.12 0.04 0.00 -0.26 0.00 0.00 58.87 58.47 2wdh n SER 45 Cb 0.51 -0.15 0.15 0.00 -0.26 0.00 0.00 64.21 64.46 2wdh n SER 45 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wdh n GLU 46 N -2.07 1.25 -0.01 4.33 -0.58 -1.26 -3.18 120.64 119.12 2wdh n GLU 46 Ca 0.02 -0.38 -0.01 0.00 -0.42 0.00 0.00 57.16 56.37 2wdh n GLU 46 Cb 0.08 -1.14 -0.01 0.00 -0.57 0.00 0.00 31.44 29.80 2wdh n GLU 46 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2wdh n THR 47 N -0.24 0.08 0.00 2.62 -1.04 -1.26 -4.61 114.28 109.83 2wdh n THR 47 Ca 0.06 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2wdh n THR 47 Cb 0.10 -0.96 0.00 0.00 -1.82 0.00 0.00 70.33 67.65 2wdh n THR 47 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wdh n GLY 48 N 2.93 1.12 2.94 3.41 0.00 -1.19 -0.99 105.19 113.41 2wdh n GLY 48 Ca -0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 2wdh n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wdh n LYS 49 N 0.00 0.00 -2.33 1.61 4.76 -1.26 -4.24 118.16 116.70 2wdh n LYS 49 Ca 0.00 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.04 2wdh n LYS 49 Cb 0.00 -1.05 -0.03 0.00 -1.84 0.00 0.00 35.03 32.12 2wdh n LYS 49 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2wdh s ILE 50 N -0.46 3.62 0.24 -0.18 -1.09 -1.26 -0.51 121.20 121.55 2wdh s ILE 50 Ca 0.65 0.42 -0.28 0.00 -2.23 0.00 0.00 60.65 59.21 2wdh s ILE 50 Cb -0.92 -4.44 -0.16 0.00 -1.58 0.00 0.00 42.46 35.36 2wdh s ILE 50 CO 0.48 -1.33 0.77 0.18 -1.23 0.00 0.00 174.94 173.81 2wdh n LEU 51 N 10.55 0.26 -4.21 2.97 4.77 -1.00 -4.95 117.00 125.39 2wdh n LEU 51 Ca 0.12 1.15 -0.28 0.00 -0.03 0.00 0.00 56.01 56.97 2wdh n LEU 51 Cb 0.50 -1.12 0.26 0.00 -2.33 0.00 0.00 43.42 40.73 2wdh n LEU 51 CO 0.71 -2.20 0.28 -0.81 -1.33 0.00 0.00 177.39 174.04 2wdh n PRO 52 N 0.87 -3.96 0.19 3.23 -0.04 -1.26 -4.79 135.00 129.24 2wdh n PRO 52 Ca 0.14 -1.17 0.14 0.00 -0.04 0.00 0.00 63.50 62.57 2wdh n PRO 52 Cb 0.28 -1.86 0.48 0.00 -0.04 0.00 0.00 33.50 32.37 2wdh n PRO 52 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2wdh h ARG 53 N -3.30 0.00 0.00 0.54 9.65 -1.98 -3.04 114.38 116.26 2wdh h ARG 53 Ca -0.41 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.47 2wdh h ARG 53 Cb 1.22 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.80 2wdh h ARG 53 CO 0.27 0.00 0.00 0.54 2.80 0.00 0.00 179.97 183.58 2wdh n ARG 54 N -2.69 0.00 0.34 0.20 1.74 -1.26 0.11 116.66 115.10 2wdh n ARG 54 Ca 0.03 0.36 0.15 0.00 -0.77 0.00 0.00 57.85 57.61 2wdh n ARG 54 Cb 0.35 -1.15 0.78 0.00 -1.02 0.00 0.00 32.46 31.41 2wdh n ARG 54 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wdh h ARG 55 N 0.00 0.00 0.00 5.56 2.47 -1.92 -2.82 114.38 117.66 2wdh h ARG 55 Ca 0.00 0.00 -0.41 0.00 -1.26 0.00 0.00 59.98 58.31 2wdh h ARG 55 Cb 0.00 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.26 2wdh h ARG 55 CO 0.00 0.00 -2.38 0.25 0.56 0.00 0.00 179.97 178.40 2wdh n THR 56 N -2.87 1.35 -2.89 2.04 -2.24 -1.15 -2.07 114.28 106.46 2wdh n THR 56 Ca -0.02 -0.35 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 2wdh n THR 56 Cb 0.41 -1.80 0.04 0.00 -2.10 0.00 0.00 70.33 66.88 2wdh n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wdh n GLY 57 N 1.51 0.20 0.00 3.38 0.00 0.30 -1.60 105.19 108.98 2wdh n GLY 57 Ca -0.48 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2wdh n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wdh n LEU 58 N -2.53 0.00 -4.93 0.99 4.32 -1.26 -4.78 117.00 108.81 2wdh n LEU 58 Ca -0.04 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.69 2wdh n LEU 58 Cb 0.54 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 42.39 2wdh n LEU 58 CO 0.29 -0.43 0.54 -0.55 -1.22 0.00 0.00 177.39 176.02 2wdh s SER 59 N -1.00 5.26 0.33 -1.43 0.15 -1.26 -4.83 113.70 110.92 2wdh s SER 59 Ca 0.00 0.51 0.03 0.00 0.70 0.00 0.00 55.95 57.19 2wdh s SER 59 Cb 0.00 -1.37 0.62 0.00 -1.71 0.00 0.00 66.02 63.56 2wdh s SER 59 CO 0.00 -1.27 1.93 0.00 1.20 0.00 0.00 173.24 175.11 2wdh h ALA 60 N -0.29 1.59 0.27 5.45 0.00 -2.00 -0.85 119.26 123.43 2wdh h ALA 60 Ca -0.45 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2wdh h ALA 60 Cb 1.28 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2wdh h ALA 60 CO 0.59 0.29 -0.13 -0.22 0.00 0.00 0.00 179.25 179.78 2wdh h LYS 61 N 0.91 -0.34 -0.73 0.00 3.64 -2.01 -3.30 116.57 114.74 2wdh h LYS 61 Ca 0.35 0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.91 2wdh h LYS 61 Cb 0.21 0.08 -0.13 0.00 -0.41 0.00 0.00 32.23 31.98 2wdh h LYS 61 CO -0.12 -0.23 -0.10 0.93 -2.27 0.00 0.00 179.45 177.65 2wdh h GLU 62 N -0.97 0.04 -0.72 1.90 5.08 -1.90 -0.90 114.58 117.11 2wdh h GLU 62 Ca -0.04 -0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.47 2wdh h GLU 62 Cb 0.27 -0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.38 2wdh h GLU 62 CO 0.06 0.03 -0.13 0.37 -1.00 0.00 0.00 179.01 178.33 2wdh h GLN 63 N 0.04 0.02 0.48 2.33 5.75 -1.28 0.31 115.11 122.76 2wdh h GLN 63 Ca 0.37 -0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.85 2wdh h GLN 63 Cb 0.61 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.16 2wdh h GLN 63 CO -0.71 0.01 -0.23 0.00 -2.65 0.00 0.00 178.83 175.26 2wdh h ARG 64 N 0.02 -0.62 -1.70 1.69 3.08 -1.27 -1.48 114.38 114.11 2wdh h ARG 64 Ca 0.36 0.04 0.53 0.00 0.07 0.00 0.00 59.98 60.98 2wdh h ARG 64 Cb 0.57 0.14 -0.11 0.00 0.08 0.00 0.00 29.97 30.65 2wdh h ARG 64 CO -0.72 -0.41 1.17 -0.89 -1.07 0.00 0.00 179.97 178.05 2wdh n ILE 65 N -3.98 -0.13 0.02 2.04 5.41 -0.82 -1.06 119.36 120.85 2wdh n ILE 65 Ca -0.08 1.66 -0.01 0.00 1.00 0.00 0.00 62.75 65.32 2wdh n ILE 65 Cb 0.25 -2.74 -0.00 0.00 -0.71 0.00 0.00 39.64 36.44 2wdh n ILE 65 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2wdh h LEU 66 N 0.00 -0.05 -1.00 1.39 5.85 -0.12 -3.12 115.31 118.27 2wdh h LEU 66 Ca 0.92 0.00 0.29 0.00 0.84 0.00 0.00 57.88 59.93 2wdh h LEU 66 Cb 3.34 0.01 -0.14 0.00 0.37 0.00 0.00 40.66 44.25 2wdh h LEU 66 CO -0.24 -0.00 0.56 0.00 -0.34 0.00 0.00 178.44 178.42 2wdh h ALA 67 N -1.90 1.87 -0.64 1.25 0.00 -0.02 0.53 119.26 120.34 2wdh h ALA 67 Ca -0.01 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2wdh h ALA 67 Cb 0.05 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2wdh h ALA 67 CO 0.01 -0.45 0.19 0.87 0.00 0.00 0.00 179.25 179.86 2wdh h LYS 68 N 0.42 1.01 0.00 0.00 6.56 -1.28 0.43 116.57 123.70 2wdh h LYS 68 Ca 0.69 -0.23 -0.07 0.00 -1.06 0.00 0.00 60.65 59.99 2wdh h LYS 68 Cb 1.48 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 32.99 2wdh h LYS 68 CO -0.56 0.89 -0.35 1.79 -2.06 0.00 0.00 179.45 179.16 2wdh h THR 69 N 0.93 0.61 0.81 -0.16 1.35 -0.36 -2.53 112.91 113.57 2wdh h THR 69 Ca 0.21 -1.83 -0.04 0.00 -0.55 0.00 0.00 66.41 64.20 2wdh h THR 69 Cb 0.32 2.27 0.01 0.00 -1.73 0.00 0.00 68.15 69.02 2wdh h THR 69 CO -0.00 0.34 -0.39 0.40 -0.25 0.00 0.00 175.52 175.62 2wdh h ILE 70 N 0.00 0.00 -0.94 6.82 1.08 0.24 -2.73 117.51 121.98 2wdh h ILE 70 Ca -0.00 -0.18 0.20 0.00 -0.39 0.00 0.00 64.86 64.48 2wdh h ILE 70 Cb 1.25 0.00 -0.18 0.00 -3.07 0.00 0.00 36.82 34.82 2wdh h ILE 70 CO 0.05 0.00 -0.20 0.11 -0.69 0.00 0.00 178.15 177.41 2wdh h LYS 71 N -1.27 0.00 -0.06 2.37 1.57 -0.91 -0.46 116.57 117.80 2wdh h LYS 71 Ca -0.11 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2wdh h LYS 71 Cb 0.84 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.10 2wdh h LYS 71 CO 0.18 0.00 -0.44 0.00 -0.57 0.00 0.00 179.45 178.62 2wdh h ARG 72 N 0.00 -0.49 -0.93 3.15 3.08 -1.30 -1.20 114.38 116.69 2wdh h ARG 72 Ca 0.46 0.03 0.16 0.00 0.07 0.00 0.00 59.98 60.71 2wdh h ARG 72 Cb 0.74 0.11 -0.08 0.00 0.08 0.00 0.00 29.97 30.82 2wdh h ARG 72 CO -0.96 -0.33 0.59 0.00 -1.07 0.00 0.00 179.97 178.21 2wdh h ALA 73 N -0.56 1.85 0.00 0.04 0.00 -0.82 0.20 119.26 119.96 2wdh h ALA 73 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wdh h ALA 73 Cb 0.57 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2wdh h ALA 73 CO -0.33 -0.12 0.04 0.00 0.00 0.00 0.00 179.25 178.84 2wdh h ARG 74 N 0.68 0.00 0.09 0.00 3.08 -0.13 0.20 114.38 118.29 2wdh h ARG 74 Ca 0.48 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 60.21 2wdh h ARG 74 Cb 0.82 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 2wdh h ARG 74 CO -0.24 0.00 -1.71 0.82 -1.07 0.00 0.00 179.97 177.77 2wdh h ILE 75 N 0.00 0.92 0.00 2.04 2.04 -0.30 -3.30 117.51 118.91 2wdh h ILE 75 Ca 0.00 -2.64 0.00 0.00 1.00 0.00 0.00 64.86 63.22 2wdh h ILE 75 Cb 0.08 2.59 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2wdh h ILE 75 CO 0.00 0.76 0.00 0.18 0.00 0.00 0.00 178.15 179.09 2wdh n LEU 76 N -3.35 0.36 0.00 1.44 7.99 0.67 -4.80 117.00 119.31 2wdh n LEU 76 Ca -0.21 -0.18 0.00 0.00 -0.01 0.00 0.00 56.01 55.61 2wdh n LEU 76 Cb 1.05 -0.18 0.00 0.00 -0.11 0.00 0.00 43.42 44.17 2wdh n LEU 76 CO 0.47 0.09 0.00 0.61 -1.51 0.00 0.00 177.39 177.05 2wdh n GLY 77 N 0.19 0.22 0.15 -0.72 0.00 -1.10 -4.82 105.19 99.11 2wdh n GLY 77 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2wdh n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wdh h LEU 78 N 0.00 -0.29-10.12 0.99 3.38 -1.79 -3.45 115.31 104.03 2wdh h LEU 78 Ca 0.00 0.01 -0.50 0.00 0.09 0.00 0.00 57.88 57.48 2wdh h LEU 78 Cb 0.08 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2wdh h LEU 78 CO 0.00 -0.10 0.09 -0.76 0.09 0.00 0.00 178.44 177.76 2wdh s LEU 79 N -6.49 3.90 0.00 1.67 1.43 -1.22 -4.99 118.68 112.98 2wdh s LEU 79 Ca -0.05 1.12 -0.07 0.00 -1.03 0.00 0.00 54.13 54.10 2wdh s LEU 79 Cb 0.01 -3.98 0.12 0.00 0.03 0.00 0.00 46.19 42.37 2wdh s LEU 79 CO 0.15 -0.34 0.75 -0.81 0.23 0.00 0.00 176.35 176.33 2wdh n PRO 80 N -1.08 -0.53 -0.01 1.29 -0.04 -1.26 -4.31 135.00 129.06 2wdh n PRO 80 Ca 0.02 -1.35 -0.01 0.00 -0.04 0.00 0.00 63.50 62.12 2wdh n PRO 80 Cb 0.54 -0.71 -0.01 0.00 -0.04 0.00 0.00 33.50 33.28 2wdh n PRO 80 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2wdh n PHE 81 N -2.89 0.00 -3.72 0.54 3.72 -1.26 -4.81 117.46 109.04 2wdh n PHE 81 Ca 0.10 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.42 2wdh n PHE 81 Cb 0.35 -0.06 -0.02 0.00 -0.94 0.00 0.00 39.48 38.81 2wdh n PHE 81 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2wdh s THR 82 N -2.03 0.00 -0.30 4.37 2.01 -1.26 -4.51 115.64 113.92 2wdh s THR 82 Ca -0.02 -0.67 -0.16 0.00 0.31 0.00 0.00 61.69 61.15 2wdh s THR 82 Cb 0.01 -1.70 0.17 0.00 0.01 0.00 0.00 72.50 70.99 2wdh s THR 82 CO 0.03 0.00 1.14 -1.83 -0.69 0.00 0.00 174.62 173.28 2wdh s GLU 83 N -3.79 0.11 0.61 4.92 -1.05 -0.16 -4.93 118.70 114.41 2wdh s GLU 83 Ca 0.08 0.19 -0.18 0.00 -0.15 0.00 0.00 54.97 54.92 2wdh s GLU 83 Cb -0.04 0.11 -0.05 0.00 -0.44 0.00 0.00 34.13 33.71 2wdh s GLU 83 CO 0.01 -0.12 0.91 1.63 0.95 0.00 0.00 175.26 178.65 2wdh n LYS 84 N 5.47 0.82 -2.59 -4.83 4.76 -1.26 -4.38 118.16 116.15 2wdh n LYS 84 Ca -0.08 0.32 -0.22 0.00 -2.87 0.00 0.00 58.31 55.46 2wdh n LYS 84 Cb 0.54 -2.12 0.04 0.00 -1.84 0.00 0.00 35.03 31.66 2wdh n LYS 84 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2wdh s LEU 85 N -1.81 3.21 -0.08 -0.35 2.96 -1.26 -5.00 118.68 116.34 2wdh s LEU 85 Ca 0.76 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.72 2wdh s LEU 85 Cb -0.41 -2.83 -0.01 0.00 0.50 0.00 0.00 46.19 43.44 2wdh s LEU 85 CO 0.47 -1.24 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.36 2wdh s VAL 86 N -2.83 2.35 0.00 1.68 1.01 -1.26 -5.08 120.40 116.26 2wdh s VAL 86 Ca 0.58 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.61 2wdh s VAL 86 Cb -0.10 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.39 2wdh s VAL 86 CO 0.39 0.56 0.00 -2.11 0.00 0.00 0.00 175.10 173.95 2wdh n ARG 87 N 3.09 0.00 0.00 2.72 0.00 -1.26 -5.28 116.66 115.93 2wdh n ARG 87 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.67 2wdh n ARG 87 Cb 0.52 -0.48 0.00 0.00 -0.00 0.00 0.00 32.46 32.51 2wdh n ARG 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80