#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdx n GLU 6 N 0.00 0.01 -1.05 -0.52 1.02 -1.26 -4.89 120.64 113.95 1wdx n GLU 6 Ca 0.00 0.33 0.00 0.00 -0.02 0.00 0.00 57.16 57.47 1wdx n GLU 6 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1wdx n GLU 6 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1wdx n VAL 7 N -1.49 -3.71 -2.69 2.62 0.31 -1.26 -4.97 118.33 107.15 1wdx n VAL 7 Ca 0.02 1.51 -0.40 0.00 -0.01 0.00 0.00 64.34 65.47 1wdx n VAL 7 Cb 0.10 -2.34 -0.06 0.00 -0.91 0.00 0.00 33.84 30.64 1wdx n VAL 7 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1wdx s PRO 8 N -3.22 4.76 0.15 5.55 0.04 -1.26 -5.10 135.00 135.91 1wdx s PRO 8 Ca 0.00 1.54 0.05 0.00 0.04 0.00 0.00 61.00 62.63 1wdx s PRO 8 Cb 0.00 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 1wdx s PRO 8 CO 0.00 0.40 -0.11 -0.59 0.04 0.00 0.00 177.00 176.75 1wdx s PHE 9 N -1.24 1.29 0.25 0.56 -0.12 -0.96 -4.97 117.98 112.80 1wdx s PHE 9 Ca 0.43 -0.72 -0.10 0.00 -0.05 0.00 0.00 56.93 56.49 1wdx s PHE 9 Cb -0.26 -0.66 -0.07 0.00 -0.63 0.00 0.00 43.02 41.40 1wdx s PHE 9 CO 0.33 0.10 0.59 0.15 -0.05 0.00 0.00 175.22 176.34 1wdx s LYS 10 N -3.58 3.83 0.04 1.99 1.02 -1.26 -1.30 119.74 120.47 1wdx s LYS 10 Ca 0.16 0.33 -0.08 0.00 0.02 0.00 0.00 55.97 56.40 1wdx s LYS 10 Cb 0.01 -2.60 -0.00 0.00 -0.52 0.00 0.00 37.83 34.72 1wdx s LYS 10 CO 0.01 0.27 0.16 0.14 -0.92 0.00 0.00 175.35 175.02 1wdx s VAL 11 N -1.88 0.12 -0.07 3.17 -7.23 -0.36 -4.64 120.40 109.52 1wdx s VAL 11 Ca 0.48 -0.97 0.04 0.00 -1.81 0.00 0.00 61.98 59.73 1wdx s VAL 11 Cb -0.11 -0.92 -0.00 0.00 0.56 0.00 0.00 36.38 35.91 1wdx s VAL 11 CO 0.21 -0.53 -0.20 -0.69 -0.31 0.00 0.00 175.10 173.58 1wdx s VAL 12 N -2.62 1.71 -0.17 1.32 1.01 -1.05 -1.12 120.40 119.47 1wdx s VAL 12 Ca -0.05 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 1wdx s VAL 12 Cb -0.01 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1wdx s VAL 12 CO -0.04 0.48 1.77 0.00 0.00 0.00 0.00 175.10 177.31 1wdx s ALA 13 N 0.19 3.24 -0.43 5.51 0.00 -1.03 -1.25 121.76 127.99 1wdx s ALA 13 Ca -0.10 0.67 0.25 0.00 0.00 0.00 0.00 51.96 52.77 1wdx s ALA 13 Cb -0.15 -3.88 0.54 0.00 0.00 0.00 0.00 23.12 19.63 1wdx s ALA 13 CO 0.05 -2.01 1.68 1.96 0.00 0.00 0.00 175.76 177.44 1wdx h GLN 14 N 11.37 0.00 -3.99 0.00 1.08 -1.70 -1.37 115.11 120.49 1wdx h GLN 14 Ca -0.37 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 56.72 1wdx h GLN 14 Cb 1.18 0.00 -0.15 0.00 -0.05 0.00 0.00 27.48 28.47 1wdx h GLN 14 CO 0.98 0.00 -0.51 -0.06 -0.95 0.00 0.00 178.83 178.29 1wdx s PHE 15 N -3.24 0.31 0.30 2.96 0.08 -1.21 -4.91 117.98 112.27 1wdx s PHE 15 Ca 0.07 -0.79 -0.28 0.00 0.12 0.00 0.00 56.93 56.05 1wdx s PHE 15 Cb 0.07 -0.21 -0.09 0.00 -0.57 0.00 0.00 43.02 42.22 1wdx s PHE 15 CO 0.64 -0.47 1.09 -1.25 -0.10 0.00 0.00 175.22 175.14 1wdx s PRO 16 N -3.83 4.54 -0.25 0.24 0.04 -1.26 -4.34 135.00 130.14 1wdx s PRO 16 Ca 0.05 1.76 0.02 0.00 0.04 0.00 0.00 61.00 62.87 1wdx s PRO 16 Cb 0.06 -3.07 0.06 0.00 0.04 0.00 0.00 34.50 31.60 1wdx s PRO 16 CO -0.10 0.14 -0.06 -0.47 0.04 0.00 0.00 177.00 176.55 1wdx s TYR 17 N -1.25 2.74 -0.06 0.56 5.04 -0.90 -4.97 117.35 118.51 1wdx s TYR 17 Ca 0.47 -2.02 0.05 0.00 -2.44 0.00 0.00 57.07 53.13 1wdx s TYR 17 Cb -0.30 -1.79 -0.02 0.00 0.35 0.00 0.00 41.96 40.20 1wdx s TYR 17 CO 0.39 -0.82 -0.20 0.15 -1.34 0.00 0.00 175.55 173.72 1wdx s LYS 18 N 1.28 2.54 0.14 4.97 3.01 -1.26 -2.40 119.74 128.02 1wdx s LYS 18 Ca -0.05 -0.81 -0.24 0.00 -1.01 0.00 0.00 55.97 53.85 1wdx s LYS 18 Cb -0.19 -2.27 0.07 0.00 -1.01 0.00 0.00 37.83 34.43 1wdx s LYS 18 CO -0.07 0.48 0.75 -1.54 0.51 0.00 0.00 175.35 175.49 1wdx s SER 19 N -0.39 -0.40 -0.14 2.83 1.04 -1.26 -5.07 113.70 110.30 1wdx s SER 19 Ca 0.04 -0.18 0.17 0.00 0.48 0.00 0.00 55.95 56.46 1wdx s SER 19 Cb -0.12 0.56 -0.25 0.00 0.10 0.00 0.00 66.02 66.31 1wdx s SER 19 CO 0.02 -0.95 0.25 -0.90 0.98 0.00 0.00 173.24 172.64 1wdx n ASP 20 N -0.38 0.20 -4.77 7.02 5.68 -1.26 -4.95 116.55 118.10 1wdx n ASP 20 Ca -0.11 0.10 -0.40 0.00 -0.50 0.00 0.00 54.79 53.88 1wdx n ASP 20 Cb 0.62 0.84 0.01 0.00 -1.14 0.00 0.00 41.12 41.45 1wdx n ASP 20 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 1wdx s TYR 21 N -2.61 2.53 0.17 2.11 2.02 -1.26 -4.93 117.35 115.38 1wdx s TYR 21 Ca -0.08 1.23 -0.03 0.00 -0.37 0.00 0.00 57.07 57.81 1wdx s TYR 21 Cb 0.07 -3.95 0.05 0.00 -0.40 0.00 0.00 41.96 37.73 1wdx s TYR 21 CO 0.83 -2.92 1.44 1.05 -1.57 0.00 0.00 175.55 174.39 1wdx h GLU 22 N 2.63 0.49 0.00 -0.62 4.11 -2.03 -3.09 114.58 116.07 1wdx h GLU 22 Ca -0.51 -0.37 -0.03 0.00 0.07 0.00 0.00 59.36 58.52 1wdx h GLU 22 Cb 1.25 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.57 1wdx h GLU 22 CO 0.62 1.00 -0.14 -0.44 0.07 0.00 0.00 179.01 180.12 1wdx h ASP 23 N 0.35 0.00 -3.84 3.06 5.19 -1.93 -3.45 116.42 115.79 1wdx h ASP 23 Ca -0.02 0.00 -0.51 0.00 -0.62 0.00 0.00 57.03 55.88 1wdx h ASP 23 Cb 1.25 0.00 0.04 0.00 0.18 0.00 0.00 39.33 40.80 1wdx h ASP 23 CO 0.12 0.14 0.54 -1.81 -3.12 0.00 0.00 179.24 175.12 1wdx s ASP 24 N -6.13 7.04 -0.45 6.45 1.11 -1.17 -2.32 116.67 121.20 1wdx s ASP 24 Ca -0.02 2.45 -0.20 0.00 0.18 0.00 0.00 52.55 54.96 1wdx s ASP 24 Cb 0.12 -2.64 0.03 0.00 1.07 0.00 0.00 42.92 41.50 1wdx s ASP 24 CO 0.59 -0.32 0.62 -0.22 1.18 0.00 0.00 175.17 177.02 1wdx s LEU 25 N -1.62 4.60 0.57 1.23 2.96 -0.59 -4.67 118.68 121.16 1wdx s LEU 25 Ca 0.47 -0.46 -0.09 0.00 -0.22 0.00 0.00 54.13 53.83 1wdx s LEU 25 Cb -0.35 -2.65 -0.04 0.00 0.50 0.00 0.00 46.19 43.65 1wdx s LEU 25 CO 0.46 -0.77 0.94 0.20 -1.32 0.00 0.00 176.35 175.86 1wdx s ASN 26 N 2.07 6.27 -0.09 3.68 0.01 -1.26 -4.62 114.94 121.00 1wdx s ASN 26 Ca 0.20 1.27 -0.30 0.00 -0.71 0.00 0.00 52.86 53.32 1wdx s ASN 26 Cb -0.15 -2.40 0.12 0.00 0.41 0.00 0.00 41.25 39.23 1wdx s ASN 26 CO 0.17 -0.75 0.96 0.72 -1.51 0.00 0.00 177.10 176.69 1wdx s PHE 27 N -3.00 -0.33 0.66 2.20 -0.12 -1.01 -5.03 117.98 111.35 1wdx s PHE 27 Ca 0.53 0.37 -0.07 0.00 -0.05 0.00 0.00 56.93 57.71 1wdx s PHE 27 Cb -0.11 0.50 0.04 0.00 -0.63 0.00 0.00 43.02 42.82 1wdx s PHE 27 CO 0.49 -0.43 0.97 -1.21 -0.05 0.00 0.00 175.22 174.99 1wdx s GLU 28 N -2.25 2.54 0.78 1.99 0.41 -1.26 -2.13 118.70 118.78 1wdx s GLU 28 Ca 0.03 -0.11 -0.14 0.00 -0.41 0.00 0.00 54.97 54.33 1wdx s GLU 28 Cb -0.01 -2.21 0.07 0.00 -1.78 0.00 0.00 34.13 30.20 1wdx s GLU 28 CO -0.04 -1.00 1.22 0.21 -0.49 0.00 0.00 175.26 175.16 1wdx s LYS 29 N -5.14 1.78 -1.47 1.61 2.20 -1.26 -3.18 119.74 114.28 1wdx s LYS 29 Ca 0.57 1.81 -0.11 0.00 -0.36 0.00 0.00 55.97 57.89 1wdx s LYS 29 Cb -0.11 -1.79 0.06 0.00 -1.51 0.00 0.00 37.83 34.49 1wdx s LYS 29 CO 0.45 -2.12 0.83 -0.25 -0.36 0.00 0.00 175.35 173.90 1wdx n ASP 30 N -3.07 -5.06 -4.49 1.43 8.00 -0.52 -4.95 116.55 107.89 1wdx n ASP 30 Ca 0.14 -0.57 -0.36 0.00 0.71 0.00 0.00 54.79 54.71 1wdx n ASP 30 Cb 0.50 -4.06 -0.12 0.00 -0.02 0.00 0.00 41.12 37.42 1wdx n ASP 30 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1wdx s GLN 31 N -6.28 3.74 -0.03 -1.24 2.00 -1.19 -4.89 119.66 111.77 1wdx s GLN 31 Ca 0.53 -0.44 -0.29 0.00 -2.00 0.00 0.00 55.36 53.17 1wdx s GLN 31 Cb -0.26 -3.35 -0.03 0.00 0.80 0.00 0.00 33.01 30.17 1wdx s GLN 31 CO 0.66 -0.13 0.93 -2.00 -0.50 0.00 0.00 175.29 174.24 1wdx s GLU 32 N 1.47 4.52 -0.04 1.67 2.12 -1.26 -2.47 118.70 124.70 1wdx s GLU 32 Ca 0.06 1.30 0.03 0.00 0.36 0.00 0.00 54.97 56.72 1wdx s GLU 32 Cb -0.15 -3.47 0.01 0.00 0.26 0.00 0.00 34.13 30.78 1wdx s GLU 32 CO 0.04 -0.06 -0.11 0.42 -0.54 0.00 0.00 175.26 175.01 1wdx s ILE 33 N 1.10 0.95 -0.45 -3.70 1.01 -0.27 -4.73 121.20 115.10 1wdx s ILE 33 Ca 0.48 -0.42 -0.21 0.00 0.00 0.00 0.00 60.65 60.50 1wdx s ILE 33 Cb -0.20 -0.85 0.03 0.00 0.01 0.00 0.00 42.46 41.45 1wdx s ILE 33 CO 0.25 0.30 0.69 -0.63 0.00 0.00 0.00 174.94 175.54 1wdx s ILE 34 N 0.34 4.77 -0.04 2.92 1.01 -0.32 -1.22 121.20 128.66 1wdx s ILE 34 Ca -0.07 0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.40 1wdx s ILE 34 Cb -0.11 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 1wdx s ILE 34 CO 0.01 -0.67 1.45 -0.69 0.00 0.00 0.00 174.94 175.04 1wdx s VAL 35 N 2.96 3.74 -0.18 2.92 1.01 -0.42 -0.78 120.40 129.64 1wdx s VAL 35 Ca 0.24 1.04 0.15 0.00 0.00 0.00 0.00 61.98 63.41 1wdx s VAL 35 Cb -0.14 -3.67 -0.24 0.00 0.00 0.00 0.00 36.38 32.33 1wdx s VAL 35 CO 0.19 -0.04 0.14 0.35 0.00 0.00 0.00 175.10 175.74 1wdx n THR 36 N 4.99 1.44 -3.97 3.92 -2.24 -0.46 -2.27 114.28 115.70 1wdx n THR 36 Ca 0.14 -0.82 -0.09 0.00 -2.27 0.00 0.00 64.05 61.02 1wdx n THR 36 Cb 0.43 -0.67 -0.08 0.00 -2.10 0.00 0.00 70.33 67.91 1wdx n THR 36 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1wdx s SER 37 N -5.72 0.17 -0.20 3.42 1.04 -0.82 -4.62 113.70 106.97 1wdx s SER 37 Ca -0.12 -0.87 -0.05 0.00 0.48 0.00 0.00 55.95 55.39 1wdx s SER 37 Cb 0.07 0.35 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1wdx s SER 37 CO 0.81 -0.78 -0.00 -0.69 0.98 0.00 0.00 173.24 173.56 1wdx s VAL 38 N -3.94 3.94 -0.11 5.02 1.01 -1.26 -1.40 120.40 123.66 1wdx s VAL 38 Ca 0.13 -0.32 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 1wdx s VAL 38 Cb 0.05 -2.78 -0.27 0.00 0.00 0.00 0.00 36.38 33.38 1wdx s VAL 38 CO -0.05 0.43 0.67 -0.33 0.00 0.00 0.00 175.10 175.82 1wdx h GLU 39 N 7.47 0.18 0.00 2.72 4.39 -1.69 -3.48 114.58 124.18 1wdx h GLU 39 Ca -0.36 -0.31 0.00 0.00 0.34 0.00 0.00 59.36 59.03 1wdx h GLU 39 Cb 1.18 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1wdx h GLU 39 CO 0.61 1.15 0.00 -0.40 -1.16 0.00 0.00 179.01 179.21 1wdx n ASP 40 N -4.19 0.00 0.09 1.42 5.68 -1.14 -5.00 116.55 113.40 1wdx n ASP 40 Ca -0.19 0.00 -0.07 0.00 -0.50 0.00 0.00 54.79 54.03 1wdx n ASP 40 Cb 0.76 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.74 1wdx n ASP 40 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1wdx h ALA 41 N 2.00 0.55 -0.29 2.12 0.00 -2.04 -3.28 119.26 118.32 1wdx h ALA 41 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1wdx h ALA 41 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1wdx h ALA 41 CO 0.00 0.97 0.00 0.39 0.00 0.00 0.00 179.25 180.61 1wdx n GLU 42 N -3.61 2.49 -3.76 0.00 1.02 -1.26 -4.94 120.64 110.58 1wdx n GLU 42 Ca -0.02 -1.91 -0.14 0.00 -0.02 0.00 0.00 57.16 55.07 1wdx n GLU 42 Cb 0.81 -1.26 -0.15 0.00 -0.02 0.00 0.00 31.44 30.82 1wdx n GLU 42 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1wdx s TRP 43 N -0.99 -0.09 0.56 -0.32 0.52 -1.24 -3.01 118.94 114.38 1wdx s TRP 43 Ca 0.22 0.34 0.02 0.00 0.02 0.00 0.00 56.10 56.69 1wdx s TRP 43 Cb 0.12 -0.13 0.04 0.00 -1.15 0.00 0.00 33.47 32.35 1wdx s TRP 43 CO 0.15 -0.13 0.79 0.71 0.02 0.00 0.00 176.95 178.49 1wdx s TYR 44 N 1.04 2.68 -0.11 -1.98 2.02 -0.53 -2.05 117.35 118.43 1wdx s TYR 44 Ca -0.08 -0.08 -0.03 0.00 -0.37 0.00 0.00 57.07 56.50 1wdx s TYR 44 Cb -0.11 -2.74 0.04 0.00 -0.40 0.00 0.00 41.96 38.75 1wdx s TYR 44 CO -0.04 -0.95 0.06 0.12 -1.57 0.00 0.00 175.55 173.17 1wdx s PHE 45 N -2.78 0.33 0.00 2.71 5.36 -0.49 -2.14 117.98 120.97 1wdx s PHE 45 Ca 0.58 -0.15 0.00 0.00 -0.96 0.00 0.00 56.93 56.41 1wdx s PHE 45 Cb -0.10 -0.67 0.00 0.00 -0.34 0.00 0.00 43.02 41.91 1wdx s PHE 45 CO 0.39 -0.38 0.00 0.41 -1.46 0.00 0.00 175.22 174.18 1wdx n GLY 46 N 5.24 4.82 3.49 13.12 0.00 -0.99 -1.35 105.19 129.52 1wdx n GLY 46 Ca -0.06 -1.30 -0.16 0.00 0.00 0.00 0.00 46.02 44.51 1wdx n GLY 46 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wdx s GLU 47 N 1.04 1.11 0.10 1.61 -1.05 0.04 -2.57 118.70 118.97 1wdx s GLU 47 Ca 0.00 0.02 -0.19 0.00 -0.15 0.00 0.00 54.97 54.66 1wdx s GLU 47 Cb 0.00 0.52 0.04 0.00 -0.44 0.00 0.00 34.13 34.25 1wdx s GLU 47 CO 0.00 -0.40 0.46 1.52 0.95 0.00 0.00 175.26 177.79 1wdx s TYR 48 N -2.00 -0.31 -0.38 4.83 -0.85 -1.08 -1.18 117.35 116.38 1wdx s TYR 48 Ca -0.07 0.13 -0.29 0.00 -0.52 0.00 0.00 57.07 56.32 1wdx s TYR 48 Cb -0.00 0.32 0.02 0.00 0.38 0.00 0.00 41.96 42.67 1wdx s TYR 48 CO 0.02 -0.69 1.13 -1.14 -1.52 0.00 0.00 175.55 173.35 1wdx s GLN 49 N -3.32 3.92 0.46 -3.49 0.74 -1.26 -2.18 119.66 114.53 1wdx s GLN 49 Ca -0.00 0.90 -0.08 0.00 0.05 0.00 0.00 55.36 56.23 1wdx s GLN 49 Cb 0.01 -3.82 0.11 0.00 1.10 0.00 0.00 33.01 30.41 1wdx s GLN 49 CO -0.09 -1.11 0.45 -0.40 -0.55 0.00 0.00 175.29 173.59 1wdx n ASP 50 N 7.33 -1.11 0.03 6.67 5.75 -0.82 -4.87 116.55 129.53 1wdx n ASP 50 Ca 0.12 -0.85 0.12 0.00 -0.01 0.00 0.00 54.79 54.17 1wdx n ASP 50 Cb 0.48 -0.39 0.50 0.00 -1.03 0.00 0.00 41.12 40.68 1wdx n ASP 50 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1wdx n SER 51 N -3.64 0.19 -0.17 -1.12 7.64 -1.26 -2.46 113.62 112.80 1wdx n SER 51 Ca 0.06 0.53 0.12 0.00 1.01 0.00 0.00 58.87 60.59 1wdx n SER 51 Cb 0.23 -0.58 0.30 0.00 -1.01 0.00 0.00 64.21 63.16 1wdx n SER 51 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1wdx n ASN 52 N -1.69 0.90 0.00 6.43 3.02 -1.26 -4.96 115.26 117.69 1wdx n ASN 52 Ca 0.06 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.89 1wdx n ASN 52 Cb 0.31 0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 1wdx n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdx n GLY 53 N 1.40 0.74 3.76 7.41 0.00 -1.03 -5.06 105.19 112.41 1wdx n GLY 53 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1wdx n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wdx s ASP 54 N -2.12 6.57 -0.46 1.61 1.01 -1.26 -4.85 116.67 117.16 1wdx s ASP 54 Ca 0.00 0.67 -0.29 0.00 0.71 0.00 0.00 52.55 53.64 1wdx s ASP 54 Cb 0.00 -2.21 0.03 0.00 1.01 0.00 0.00 42.92 41.75 1wdx s ASP 54 CO 0.00 0.15 1.12 -0.69 0.21 0.00 0.00 175.17 175.95 1wdx s VAL 55 N 0.06 4.26 -0.02 -1.27 1.01 -1.26 -1.95 120.40 121.22 1wdx s VAL 55 Ca 0.20 1.25 -0.00 0.00 0.00 0.00 0.00 61.98 63.43 1wdx s VAL 55 Cb -0.14 -4.57 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 1wdx s VAL 55 CO 0.07 -0.94 0.04 0.27 0.00 0.00 0.00 175.10 174.54 1wdx s ILE 56 N 4.32 4.47 0.06 2.22 -4.36 -0.93 -4.98 121.20 122.00 1wdx s ILE 56 Ca 0.47 -0.43 0.01 0.00 -0.26 0.00 0.00 60.65 60.44 1wdx s ILE 56 Cb -0.08 -2.99 -0.03 0.00 1.25 0.00 0.00 42.46 40.60 1wdx s ILE 56 CO 0.30 0.41 -0.06 -1.83 0.24 0.00 0.00 174.94 174.00 1wdx s GLU 57 N -1.50 0.64 0.00 0.37 -1.05 -1.26 -2.62 118.70 113.28 1wdx s GLU 57 Ca 0.20 -1.08 0.00 0.00 -0.15 0.00 0.00 54.97 53.94 1wdx s GLU 57 Cb -0.12 -0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.49 1wdx s GLU 57 CO 0.10 -0.03 0.00 0.41 0.95 0.00 0.00 175.26 176.69 1wdx n GLY 58 N 0.57 0.13 3.85 -3.83 0.00 -1.06 -4.49 105.19 100.35 1wdx n GLY 58 Ca -0.17 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 1wdx n GLY 58 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wdx s ILE 59 N -2.00 4.86 0.05 -0.61 -4.36 -0.98 -2.34 121.20 115.82 1wdx s ILE 59 Ca 0.00 0.76 -0.15 0.00 -0.26 0.00 0.00 60.65 61.00 1wdx s ILE 59 Cb 0.00 -3.70 0.02 0.00 1.25 0.00 0.00 42.46 40.03 1wdx s ILE 59 CO 0.00 0.14 0.33 0.72 0.24 0.00 0.00 174.94 176.37 1wdx s PHE 60 N -1.58 -0.14 0.31 1.37 -0.12 -0.91 -1.54 117.98 115.37 1wdx s PHE 60 Ca 0.41 0.01 -0.29 0.00 -0.05 0.00 0.00 56.93 57.01 1wdx s PHE 60 Cb -0.14 0.12 -0.10 0.00 -0.63 0.00 0.00 43.02 42.28 1wdx s PHE 60 CO 0.20 -0.52 1.28 -2.14 -0.05 0.00 0.00 175.22 173.99 1wdx s PRO 61 N -2.59 4.39 0.28 1.99 0.02 -1.26 -1.45 135.00 136.38 1wdx s PRO 61 Ca -0.05 2.15 -0.01 0.00 0.02 0.00 0.00 61.00 63.11 1wdx s PRO 61 Cb -0.01 -3.10 0.40 0.00 0.02 0.00 0.00 34.50 31.81 1wdx s PRO 61 CO -0.03 -0.15 1.81 0.87 -0.33 0.00 0.00 177.00 179.16 1wdx h LYS 62 N 3.74 0.78 0.00 5.54 1.57 -1.89 -2.64 116.57 123.67 1wdx h LYS 62 Ca -0.48 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 1wdx h LYS 62 Cb 1.22 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1wdx h LYS 62 CO 0.68 0.74 0.00 -1.13 -0.57 0.00 0.00 179.45 179.17 1wdx n SER 63 N -4.25 0.62 -0.58 0.86 3.41 -1.26 -1.97 113.62 110.45 1wdx n SER 63 Ca 0.03 0.67 0.09 0.00 -0.26 0.00 0.00 58.87 59.40 1wdx n SER 63 Cb 0.25 -0.79 0.31 0.00 -0.26 0.00 0.00 64.21 63.72 1wdx n SER 63 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1wdx n PHE 64 N -2.20 0.29 -3.91 7.33 3.01 -0.99 -4.92 117.46 116.07 1wdx n PHE 64 Ca 0.02 -0.15 -0.10 0.00 1.01 0.00 0.00 57.45 58.23 1wdx n PHE 64 Cb 0.20 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.58 1wdx n PHE 64 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1wdx s VAL 65 N -1.71 0.12 -0.22 -4.37 0.11 -0.83 -1.89 120.40 111.61 1wdx s VAL 65 Ca 0.29 -1.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.35 1wdx s VAL 65 Cb 0.16 -0.80 0.05 0.00 -1.53 0.00 0.00 36.38 34.27 1wdx s VAL 65 CO 0.23 -0.55 -0.06 0.00 -3.33 0.00 0.00 175.10 171.39 1wdx s ALA 66 N -2.35 1.83 -2.00 1.54 0.00 -0.38 -4.85 121.76 115.55 1wdx s ALA 66 Ca -0.07 -1.21 0.04 0.00 0.00 0.00 0.00 51.96 50.72 1wdx s ALA 66 Cb -0.03 -1.35 0.26 0.00 0.00 0.00 0.00 23.12 22.01 1wdx s ALA 66 CO -0.03 -1.07 0.73 0.28 0.00 0.00 0.00 175.76 175.67