#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wf8 s SER 2 N 0.00 5.59 -0.30 1.61 0.01 -1.26 -5.10 113.70 114.25 1wf8 s SER 2 Ca 0.00 -0.00 -0.18 0.00 1.31 0.00 0.00 55.95 57.08 1wf8 s SER 2 Cb 0.00 -1.52 0.20 0.00 0.21 0.00 0.00 66.02 64.92 1wf8 s SER 2 CO 0.00 0.16 1.27 -0.55 0.41 0.00 0.00 173.24 174.53 1wf8 s SER 3 N -2.47 -0.07 0.00 2.44 0.15 -1.26 -5.09 113.70 107.40 1wf8 s SER 3 Ca 0.30 0.11 0.00 0.00 0.70 0.00 0.00 55.95 57.06 1wf8 s SER 3 Cb -0.12 1.06 0.00 0.00 -1.71 0.00 0.00 66.02 65.25 1wf8 s SER 3 CO 0.23 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.26 1wf8 n GLY 4 N 3.77 -2.28 0.44 9.45 0.00 -1.26 -5.00 105.19 110.30 1wf8 n GLY 4 Ca -0.12 0.76 -0.13 0.00 0.00 0.00 0.00 46.02 46.53 1wf8 n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1wf8 h SER 5 N 0.00 -1.96 -1.28 1.61 0.87 -2.07 -3.40 113.55 107.32 1wf8 h SER 5 Ca 0.00 0.27 -0.77 0.00 -1.23 0.00 0.00 61.79 60.07 1wf8 h SER 5 Cb 0.00 0.83 0.04 0.00 -0.44 0.00 0.00 62.40 62.83 1wf8 h SER 5 CO 0.00 -0.33 0.41 -0.24 -0.53 0.00 0.00 176.83 176.14 1wf8 n SER 6 N -5.29 1.04 -2.74 6.23 2.88 -1.26 -4.89 113.62 109.59 1wf8 n SER 6 Ca -0.01 1.14 -0.08 0.00 -1.33 0.00 0.00 58.87 58.59 1wf8 n SER 6 Cb 0.31 -1.02 0.06 0.00 -0.75 0.00 0.00 64.21 62.80 1wf8 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wf8 n GLY 7 N 2.63 -0.13 3.30 0.46 0.00 -1.26 -5.11 105.19 105.08 1wf8 n GLY 7 Ca 0.22 0.23 -0.27 0.00 0.00 0.00 0.00 46.02 46.20 1wf8 n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wf8 s LEU 8 N -0.74 2.21 -0.88 0.99 2.01 -1.26 -4.07 118.68 116.94 1wf8 s LEU 8 Ca 0.31 -0.60 -0.25 0.00 0.01 0.00 0.00 54.13 53.60 1wf8 s LEU 8 Cb 0.23 -1.09 0.04 0.00 0.01 0.00 0.00 46.19 45.37 1wf8 s LEU 8 CO -0.22 0.18 1.40 -0.70 1.01 0.00 0.00 176.35 178.02 1wf8 s GLU 9 N -1.42 3.34 -0.41 1.70 2.12 0.52 -4.81 118.70 119.73 1wf8 s GLU 9 Ca 0.10 -0.64 -0.18 0.00 0.36 0.00 0.00 54.97 54.60 1wf8 s GLU 9 Cb -0.09 -4.78 0.02 0.00 0.26 0.00 0.00 34.13 29.53 1wf8 s GLU 9 CO 0.03 -2.24 0.51 -0.51 -0.54 0.00 0.00 175.26 172.52 1wf8 s LEU 10 N 5.62 4.65 -0.03 2.70 1.43 -1.25 -0.70 118.68 131.09 1wf8 s LEU 10 Ca 0.42 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1wf8 s LEU 10 Cb -0.04 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.66 1wf8 s LEU 10 CO 0.03 -0.62 -0.09 0.72 0.23 0.00 0.00 176.35 176.62 1wf8 s PHE 11 N 2.40 1.02 0.16 0.29 -0.71 -0.77 -4.96 117.98 115.40 1wf8 s PHE 11 Ca 0.17 -0.28 -0.30 0.00 -1.04 0.00 0.00 56.93 55.47 1wf8 s PHE 11 Cb -0.16 -0.75 -0.07 0.00 -1.21 0.00 0.00 43.02 40.83 1wf8 s PHE 11 CO 0.15 -0.14 1.13 -1.25 -1.34 0.00 0.00 175.22 173.77 1wf8 s PRO 12 N 0.37 4.55 -0.10 1.99 0.04 -1.26 -1.97 135.00 138.62 1wf8 s PRO 12 Ca -0.06 1.75 0.02 0.00 0.04 0.00 0.00 61.00 62.74 1wf8 s PRO 12 Cb -0.11 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.16 1wf8 s PRO 12 CO 0.01 -0.01 -0.14 0.08 0.04 0.00 0.00 177.00 176.98 1wf8 s VAL 13 N 0.01 1.39 0.26 -0.36 1.01 0.54 -4.88 120.40 118.37 1wf8 s VAL 13 Ca 0.51 -0.59 -0.20 0.00 0.00 0.00 0.00 61.98 61.71 1wf8 s VAL 13 Cb -0.30 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.72 1wf8 s VAL 13 CO 0.34 0.42 0.77 -1.61 0.00 0.00 0.00 175.10 175.02 1wf8 s GLU 14 N 0.93 4.27 -0.16 2.72 2.02 -1.25 0.18 118.70 127.42 1wf8 s GLU 14 Ca -0.08 0.93 -0.11 0.00 0.02 0.00 0.00 54.97 55.72 1wf8 s GLU 14 Cb -0.15 -2.77 0.05 0.00 0.10 0.00 0.00 34.13 31.35 1wf8 s GLU 14 CO -0.00 0.32 0.40 -0.51 0.02 0.00 0.00 175.26 175.49 1wf8 s LEU 15 N -2.18 0.21 -0.25 1.80 1.43 0.17 -4.92 118.68 114.94 1wf8 s LEU 15 Ca 0.47 0.83 -0.09 0.00 -1.03 0.00 0.00 54.13 54.31 1wf8 s LEU 15 Cb -0.16 1.33 -0.04 0.00 0.03 0.00 0.00 46.19 47.36 1wf8 s LEU 15 CO 0.21 -0.16 0.11 -1.61 0.23 0.00 0.00 176.35 175.12 1wf8 s GLU 16 N 0.80 3.82 0.55 1.70 2.02 -1.25 0.14 118.70 126.48 1wf8 s GLU 16 Ca -0.05 -0.40 -0.21 0.00 0.02 0.00 0.00 54.97 54.34 1wf8 s GLU 16 Cb -0.06 -3.43 -0.06 0.00 0.10 0.00 0.00 34.13 30.68 1wf8 s GLU 16 CO -0.06 -0.11 1.10 1.63 0.02 0.00 0.00 175.26 177.84 1wf8 n LYS 17 N 4.74 1.24 -4.69 1.61 5.02 0.46 -4.83 118.16 121.70 1wf8 n LYS 17 Ca -0.15 0.46 -0.31 0.00 -2.02 0.00 0.00 58.31 56.29 1wf8 n LYS 17 Cb 0.52 -2.28 -0.09 0.00 -0.02 0.00 0.00 35.03 33.16 1wf8 n LYS 17 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1wf8 s ASP 18 N -1.05 3.97 0.55 4.39 1.01 0.49 -4.91 116.67 121.14 1wf8 s ASP 18 Ca 0.72 -1.53 0.47 0.00 0.71 0.00 0.00 52.55 52.91 1wf8 s ASP 18 Cb -0.44 0.13 1.60 0.00 1.01 0.00 0.00 42.92 45.22 1wf8 s ASP 18 CO 0.49 -0.68 1.49 -1.84 0.21 0.00 0.00 175.17 174.84 1wf8 n GLU 19 N -1.13 0.00 -2.60 8.23 0.28 -1.26 0.19 120.64 124.35 1wf8 n GLU 19 Ca -0.13 1.05 -0.28 0.00 -0.16 0.00 0.00 57.16 57.64 1wf8 n GLU 19 Cb 0.67 -2.45 -0.01 0.00 1.43 0.00 0.00 31.44 31.08 1wf8 n GLU 19 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1wf8 n ASP 20 N -3.79 4.91 0.00 -1.84 2.03 -1.26 -5.08 116.55 111.53 1wf8 n ASP 20 Ca 0.41 -3.72 0.00 0.00 0.52 0.00 0.00 54.79 52.00 1wf8 n ASP 20 Cb 1.92 -0.56 0.00 0.00 -0.72 0.00 0.00 41.12 41.76 1wf8 n ASP 20 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wf8 n GLY 21 N -0.39 1.58 0.30 0.27 0.00 0.50 -3.39 105.19 104.06 1wf8 n GLY 21 Ca 0.38 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 1wf8 n GLY 21 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wf8 h LEU 22 N 0.00 -0.59 0.00 0.99 3.38 -1.88 1.44 115.31 118.65 1wf8 h LEU 22 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1wf8 h LEU 22 Cb 0.00 0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1wf8 h LEU 22 CO 0.00 -0.22 0.00 0.61 0.09 0.00 0.00 178.44 178.92 1wf8 n GLY 23 N -0.45 0.94 3.15 0.83 0.00 -1.22 -0.71 105.19 107.73 1wf8 n GLY 23 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 1wf8 n GLY 23 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wf8 s ILE 24 N -1.83 0.44 0.20 -0.61 -4.36 -1.26 -2.32 121.20 111.45 1wf8 s ILE 24 Ca 0.00 -1.90 0.09 0.00 -0.26 0.00 0.00 60.65 58.58 1wf8 s ILE 24 Cb 0.00 -1.76 -0.04 0.00 1.25 0.00 0.00 42.46 41.91 1wf8 s ILE 24 CO 0.00 -0.78 -0.07 -0.44 0.24 0.00 0.00 174.94 173.89 1wf8 s SER 25 N -3.02 4.34 0.29 4.36 0.01 -0.32 -4.95 113.70 114.41 1wf8 s SER 25 Ca 0.14 -0.58 0.04 0.00 1.31 0.00 0.00 55.95 56.86 1wf8 s SER 25 Cb 0.07 -0.76 -0.06 0.00 0.21 0.00 0.00 66.02 65.48 1wf8 s SER 25 CO -0.04 0.08 0.02 0.27 0.41 0.00 0.00 173.24 173.98 1wf8 s ILE 26 N -1.85 1.20 -0.10 1.44 -4.36 -1.26 -2.27 121.20 114.00 1wf8 s ILE 26 Ca 0.26 -2.03 -0.10 0.00 -0.26 0.00 0.00 60.65 58.52 1wf8 s ILE 26 Cb -0.08 -2.60 0.03 0.00 1.25 0.00 0.00 42.46 41.06 1wf8 s ILE 26 CO 0.16 -0.15 0.28 -0.51 0.24 0.00 0.00 174.94 174.97 1wf8 s ILE 27 N -3.30 0.00 -0.39 8.37 2.07 0.16 -4.30 121.20 123.81 1wf8 s ILE 27 Ca 0.33 -0.03 -0.16 0.00 -1.41 0.00 0.00 60.65 59.38 1wf8 s ILE 27 Cb 0.07 -0.41 0.01 0.00 0.13 0.00 0.00 42.46 42.26 1wf8 s ILE 27 CO 0.13 -0.02 0.38 -0.83 -1.91 0.00 0.00 174.94 172.69 1wf8 s GLY 28 N 0.06 1.92 0.19 1.50 0.00 -1.26 -1.74 107.32 108.00 1wf8 s GLY 28 Ca -0.01 -1.46 0.05 0.00 0.00 0.00 0.00 44.72 43.29 1wf8 s GLY 28 CO 0.01 1.04 -0.06 1.06 0.00 0.00 0.00 173.10 175.14 1wf8 s MET 29 N 1.98 1.23 -0.33 2.90 1.00 -1.04 -4.99 119.30 120.06 1wf8 s MET 29 Ca 0.10 -1.58 -0.11 0.00 0.00 0.00 0.00 55.69 54.11 1wf8 s MET 29 Cb -0.17 -0.70 -0.01 0.00 0.00 0.00 0.00 34.83 33.95 1wf8 s MET 29 CO 0.12 0.01 0.19 0.20 0.00 0.00 0.00 175.02 175.54 1wf8 s GLY 30 N -3.25 1.91 -0.03 -0.03 0.00 -1.26 0.15 107.32 104.80 1wf8 s GLY 30 Ca 0.23 -1.43 -0.11 0.00 0.00 0.00 0.00 44.72 43.42 1wf8 s GLY 30 CO 0.05 0.74 0.30 0.14 0.00 0.00 0.00 173.10 174.33 1wf8 s VAL 31 N 1.64 5.23 -1.17 1.40 1.01 -0.76 -4.41 120.40 123.35 1wf8 s VAL 31 Ca 0.05 0.51 -0.10 0.00 0.00 0.00 0.00 61.98 62.43 1wf8 s VAL 31 Cb -0.17 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.64 1wf8 s VAL 31 CO 0.08 0.54 0.20 0.61 0.00 0.00 0.00 175.10 176.52 1wf8 n GLY 32 N 1.71 -0.30 3.57 4.51 0.00 -1.26 -2.59 105.19 110.83 1wf8 n GLY 32 Ca -0.15 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1wf8 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wf8 s ALA 33 N -4.02 2.40 -0.45 4.61 0.00 -1.26 -4.41 121.76 118.63 1wf8 s ALA 33 Ca 0.14 -0.23 -0.04 0.00 0.00 0.00 0.00 51.96 51.84 1wf8 s ALA 33 Cb -0.08 -4.19 0.08 0.00 0.00 0.00 0.00 23.12 18.93 1wf8 s ALA 33 CO 0.81 -3.44 2.71 -0.25 0.00 0.00 0.00 175.76 175.59 1wf8 n ASP 34 N 12.03 6.49 0.00 0.00 9.92 -1.13 -4.87 116.55 138.98 1wf8 n ASP 34 Ca 0.23 -3.21 0.00 0.00 -0.53 0.00 0.00 54.79 51.28 1wf8 n ASP 34 Cb 0.50 -1.22 0.00 0.00 -0.64 0.00 0.00 41.12 39.76 1wf8 n ASP 34 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wf8 n ALA 35 N 0.81 0.00 -0.02 2.24 0.00 -1.26 -2.43 120.51 119.85 1wf8 n ALA 35 Ca 0.48 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.93 1wf8 n ALA 35 Cb 0.55 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.93 1wf8 n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wf8 n GLY 36 N 0.00 -0.47 2.57 0.00 0.00 -1.26 -4.65 105.19 101.39 1wf8 n GLY 36 Ca 0.00 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 1wf8 n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wf8 n LEU 37 N -2.06 7.59 -4.92 0.99 4.77 -1.02 -4.96 117.00 117.39 1wf8 n LEU 37 Ca -0.08 -4.97 -0.29 0.00 -0.03 0.00 0.00 56.01 50.64 1wf8 n LEU 37 Cb 0.49 -1.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.29 1wf8 n LEU 37 CO 0.21 2.00 -0.04 -1.83 -1.33 0.00 0.00 177.39 176.40 1wf8 s GLU 38 N -2.59 3.52 -0.34 3.23 -1.05 -1.26 -2.84 118.70 117.36 1wf8 s GLU 38 Ca 0.49 -0.33 0.01 0.00 -0.15 0.00 0.00 54.97 54.99 1wf8 s GLU 38 Cb 0.23 -2.91 0.10 0.00 -0.44 0.00 0.00 34.13 31.11 1wf8 s GLU 38 CO -0.15 0.49 0.10 0.15 0.95 0.00 0.00 175.26 176.81 1wf8 s LYS 39 N -2.91 1.04 0.15 -4.83 1.02 -1.07 -4.93 119.74 108.21 1wf8 s LYS 39 Ca 0.38 -1.46 -0.34 0.00 0.02 0.00 0.00 55.97 54.56 1wf8 s LYS 39 Cb -0.12 -2.42 -0.14 0.00 -0.52 0.00 0.00 37.83 34.62 1wf8 s LYS 39 CO 0.27 -1.00 1.53 -0.11 -0.92 0.00 0.00 175.35 175.13 1wf8 n LEU 40 N 4.47 2.83 -4.34 3.17 7.94 -1.26 -1.83 117.00 127.98 1wf8 n LEU 40 Ca 0.01 1.09 -0.34 0.00 -1.11 0.00 0.00 56.01 55.66 1wf8 n LEU 40 Cb 0.41 -1.38 -0.14 0.00 0.53 0.00 0.00 43.42 42.84 1wf8 n LEU 40 CO 0.17 -0.43 -0.39 -0.83 -1.11 0.00 0.00 177.39 174.80 1wf8 s GLY 41 N 0.84 1.61 -0.42 -3.96 0.00 0.40 -0.28 107.32 105.50 1wf8 s GLY 41 Ca 0.80 -1.07 -0.25 0.00 0.00 0.00 0.00 44.72 44.20 1wf8 s GLY 41 CO 0.39 0.25 0.90 -0.42 0.00 0.00 0.00 173.10 174.23 1wf8 s ILE 42 N 1.12 4.54 0.33 0.90 -1.09 -1.25 -2.49 121.20 123.27 1wf8 s ILE 42 Ca 0.01 0.87 0.08 0.00 -2.23 0.00 0.00 60.65 59.39 1wf8 s ILE 42 Cb -0.15 -4.38 -0.04 0.00 -1.58 0.00 0.00 42.46 36.32 1wf8 s ILE 42 CO -0.01 -0.70 0.15 -0.36 -1.23 0.00 0.00 174.94 172.79 1wf8 s PHE 43 N 3.58 2.74 -0.55 3.97 0.40 -0.71 -0.47 117.98 126.93 1wf8 s PHE 43 Ca 0.36 -0.36 -0.22 0.00 -0.60 0.00 0.00 56.93 56.11 1wf8 s PHE 43 Cb -0.11 -1.62 0.05 0.00 0.51 0.00 0.00 43.02 41.85 1wf8 s PHE 43 CO 0.23 0.34 0.83 0.08 0.70 0.00 0.00 175.22 177.41 1wf8 s VAL 44 N -2.40 4.55 0.23 -0.44 1.01 0.21 0.39 120.40 123.95 1wf8 s VAL 44 Ca 0.38 -0.10 -0.07 0.00 0.00 0.00 0.00 61.98 62.18 1wf8 s VAL 44 Cb -0.03 -4.48 0.18 0.00 0.00 0.00 0.00 36.38 32.05 1wf8 s VAL 44 CO 0.23 -1.06 1.83 0.50 0.00 0.00 0.00 175.10 176.60 1wf8 h LYS 45 N 9.24 0.83 -2.32 2.72 1.63 -1.64 1.08 116.57 128.11 1wf8 h LYS 45 Ca -0.27 -0.05 0.23 0.00 -0.85 0.00 0.00 60.65 59.71 1wf8 h LYS 45 Cb 1.08 -0.19 -0.05 0.00 -0.60 0.00 0.00 32.23 32.47 1wf8 h LYS 45 CO 1.06 0.55 0.69 -0.08 -3.45 0.00 0.00 179.45 178.22 1wf8 s THR 46 N -6.08 0.00 -0.07 1.00 -1.32 -1.25 -4.54 115.64 103.38 1wf8 s THR 46 Ca -0.13 -0.45 0.01 0.00 -1.21 0.00 0.00 61.69 59.92 1wf8 s THR 46 Cb 0.17 -2.77 0.02 0.00 -1.51 0.00 0.00 72.50 68.41 1wf8 s THR 46 CO 0.78 0.00 -0.08 -0.69 -2.21 0.00 0.00 174.62 172.42 1wf8 s VAL 47 N -2.23 0.87 0.46 5.08 1.01 -1.26 -1.17 120.40 123.16 1wf8 s VAL 47 Ca 0.23 -0.29 -0.24 0.00 0.00 0.00 0.00 61.98 61.67 1wf8 s VAL 47 Cb -0.01 -0.85 -0.08 0.00 0.00 0.00 0.00 36.38 35.44 1wf8 s VAL 47 CO 0.03 0.31 1.33 0.41 0.00 0.00 0.00 175.10 177.17 1wf8 n THR 48 N 4.13 2.91 -2.26 3.92 -1.04 -0.98 -4.87 114.28 116.10 1wf8 n THR 48 Ca -0.21 -0.50 -0.39 0.00 -2.04 0.00 0.00 64.05 60.91 1wf8 n THR 48 Cb 0.51 -1.66 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 1wf8 n THR 48 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1wf8 s GLU 49 N -2.43 2.88 0.00 -2.82 2.12 -1.26 -2.10 118.70 115.09 1wf8 s GLU 49 Ca 0.64 0.19 0.00 0.00 0.36 0.00 0.00 54.97 56.15 1wf8 s GLU 49 Cb -0.47 -4.34 0.00 0.00 0.26 0.00 0.00 34.13 29.58 1wf8 s GLU 49 CO 0.56 -2.50 0.00 0.41 -0.54 0.00 0.00 175.26 173.19 1wf8 n GLY 50 N 5.63 1.01 1.84 -1.50 0.00 -1.26 -5.10 105.19 105.81 1wf8 n GLY 50 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 1wf8 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wf8 n GLY 51 N -1.97 -1.27 0.09 -0.02 0.00 -0.89 -4.75 105.19 96.38 1wf8 n GLY 51 Ca 0.00 -1.70 -0.13 0.00 0.00 0.00 0.00 46.02 44.20 1wf8 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wf8 h ALA 52 N -1.87 -0.08 0.00 4.61 0.00 -1.14 -0.18 119.26 120.60 1wf8 h ALA 52 Ca -0.20 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1wf8 h ALA 52 Cb 0.57 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1wf8 h ALA 52 CO 0.15 -0.25 -0.21 0.00 0.00 0.00 0.00 179.25 178.94 1wf8 h ALA 53 N 0.18 1.38 0.28 0.00 0.00 -1.81 -1.11 119.26 118.18 1wf8 h ALA 53 Ca -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1wf8 h ALA 53 Cb 0.57 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wf8 h ALA 53 CO 0.01 0.26 -0.13 0.37 0.00 0.00 0.00 179.25 179.76 1wf8 h GLN 54 N 0.00 -0.36 -0.79 0.00 -0.00 -1.78 -3.06 115.11 109.13 1wf8 h GLN 54 Ca -0.00 0.02 0.16 0.00 -0.00 0.00 0.00 58.65 58.83 1wf8 h GLN 54 Cb 0.45 0.08 -0.10 0.00 0.00 0.00 0.00 27.48 27.91 1wf8 h GLN 54 CO 0.03 -0.24 0.30 0.00 0.00 0.00 0.00 178.83 178.92 1wf8 h ARG 55 N -0.69 0.40 -0.72 1.69 3.08 -0.99 0.59 114.38 117.74 1wf8 h ARG 55 Ca -0.04 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.14 1wf8 h ARG 55 Cb 0.28 -0.09 -0.13 0.00 0.08 0.00 0.00 29.97 30.11 1wf8 h ARG 55 CO 0.06 0.26 -0.12 0.22 -1.07 0.00 0.00 179.97 179.32 1wf8 h ASP 56 N 0.41 -0.57 0.00 7.04 1.82 -1.27 -3.45 116.42 120.40 1wf8 h ASP 56 Ca 0.45 0.21 0.00 0.00 -0.39 0.00 0.00 57.03 57.29 1wf8 h ASP 56 Cb 0.74 0.41 0.00 0.00 0.68 0.00 0.00 39.33 41.16 1wf8 h ASP 56 CO -0.45 -0.22 0.00 0.61 -1.61 0.00 0.00 179.24 177.57 1wf8 n GLY 57 N -1.46 1.57 0.03 -0.78 0.00 0.20 -4.89 105.19 99.85 1wf8 n GLY 57 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 1wf8 n GLY 57 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1wf8 h ARG 58 N 2.97 0.00 -6.55 1.61 2.47 -1.83 -3.45 114.38 109.60 1wf8 h ARG 58 Ca 0.00 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.19 1wf8 h ARG 58 Cb 0.00 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 28.35 1wf8 h ARG 58 CO 0.00 0.00 0.74 0.42 0.56 0.00 0.00 179.97 181.69 1wf8 s ILE 59 N -1.33 3.24 0.51 2.04 1.01 -1.26 -5.01 121.20 120.40 1wf8 s ILE 59 Ca -0.02 0.89 0.03 0.00 0.00 0.00 0.00 60.65 61.55 1wf8 s ILE 59 Cb 0.00 -3.57 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 1wf8 s ILE 59 CO 0.03 0.07 0.14 -1.10 0.00 0.00 0.00 174.94 174.07 1wf8 s GLN 60 N 1.13 2.21 0.30 2.79 -1.52 -1.26 -4.66 119.66 118.65 1wf8 s GLN 60 Ca 0.65 -2.23 -0.21 0.00 -1.95 0.00 0.00 55.36 51.62 1wf8 s GLN 60 Cb -0.37 -1.74 -0.09 0.00 -0.22 0.00 0.00 33.01 30.58 1wf8 s GLN 60 CO 0.30 -0.41 0.83 0.08 -0.25 0.00 0.00 175.29 175.85 1wf8 s VAL 61 N -2.82 4.44 -0.04 1.09 1.01 -1.26 -3.39 120.40 119.44 1wf8 s VAL 61 Ca 0.18 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.59 1wf8 s VAL 61 Cb 0.01 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1wf8 s VAL 61 CO 0.10 0.04 0.00 0.59 0.00 0.00 0.00 175.10 175.84 1wf8 n ASN 62 N 0.28 -3.33 -4.13 3.32 3.02 0.37 -4.95 115.26 109.84 1wf8 n ASN 62 Ca 0.01 0.01 -0.30 0.00 -0.03 0.00 0.00 54.58 54.28 1wf8 n ASN 62 Cb 0.52 -0.86 0.20 0.00 -0.61 0.00 0.00 39.78 39.02 1wf8 n ASN 62 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 1wf8 s ASP 63 N -2.15 2.07 -0.15 6.41 -4.77 -1.22 -4.62 116.67 112.25 1wf8 s ASP 63 Ca 0.00 0.63 -0.01 0.00 -3.30 0.00 0.00 52.55 49.87 1wf8 s ASP 63 Cb 0.00 -0.91 0.04 0.00 -1.09 0.00 0.00 42.92 40.96 1wf8 s ASP 63 CO 0.00 -3.41 -0.03 -1.58 0.70 0.00 0.00 175.17 170.84 1wf8 s GLN 64 N -5.48 1.17 -0.97 2.11 0.74 -1.26 -0.62 119.66 115.35 1wf8 s GLN 64 Ca 0.70 -0.35 -0.21 0.00 0.05 0.00 0.00 55.36 55.55 1wf8 s GLN 64 Cb -0.10 -1.78 0.10 0.00 1.10 0.00 0.00 33.01 32.33 1wf8 s GLN 64 CO 0.55 -0.42 1.27 0.42 -0.55 0.00 0.00 175.29 176.56 1wf8 s ILE 65 N 1.74 4.38 0.22 -2.34 1.01 0.38 -2.18 121.20 124.40 1wf8 s ILE 65 Ca 0.02 -1.23 -0.03 0.00 0.00 0.00 0.00 60.65 59.41 1wf8 s ILE 65 Cb -0.15 -4.90 0.03 0.00 0.01 0.00 0.00 42.46 37.45 1wf8 s ILE 65 CO -0.07 -1.70 1.63 0.58 0.00 0.00 0.00 174.94 175.38 1wf8 h VAL 66 N 6.25 1.27 -3.74 2.92 2.07 -1.46 -3.38 116.25 120.19 1wf8 h VAL 66 Ca 0.18 -1.38 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 1wf8 h VAL 66 Cb 1.02 1.29 -0.14 0.00 -1.52 0.00 0.00 31.29 31.93 1wf8 h VAL 66 CO 1.25 0.45 -0.35 -0.70 0.02 0.00 0.00 177.57 178.24 1wf8 s GLU 67 N -4.53 0.84 -0.11 1.57 2.12 -1.19 -1.30 118.70 116.09 1wf8 s GLU 67 Ca -0.09 -0.89 -0.04 0.00 0.36 0.00 0.00 54.97 54.32 1wf8 s GLU 67 Cb 0.13 0.34 0.06 0.00 0.26 0.00 0.00 34.13 34.92 1wf8 s GLU 67 CO 0.83 -0.27 0.18 0.08 -0.54 0.00 0.00 175.26 175.54 1wf8 s VAL 68 N -3.65 -0.28 -1.52 3.70 1.01 0.55 -0.98 120.40 119.23 1wf8 s VAL 68 Ca 0.03 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1wf8 s VAL 68 Cb 0.04 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 36.03 1wf8 s VAL 68 CO -0.10 0.07 0.00 0.47 0.00 0.00 0.00 175.10 175.54 1wf8 n ASP 69 N 5.33 -3.78 0.00 3.32 8.00 0.60 0.12 116.55 130.14 1wf8 n ASP 69 Ca -0.05 0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.80 1wf8 n ASP 69 Cb 0.50 -3.49 0.00 0.00 -0.02 0.00 0.00 41.12 38.10 1wf8 n ASP 69 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wf8 n GLY 70 N -0.28 1.98 3.77 0.44 0.00 -1.26 -4.92 105.19 104.92 1wf8 n GLY 70 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1wf8 n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wf8 s ILE 71 N -2.15 2.64 -0.22 -0.61 1.01 0.33 -4.98 121.20 117.22 1wf8 s ILE 71 Ca 0.00 0.63 -0.17 0.00 0.00 0.00 0.00 60.65 61.11 1wf8 s ILE 71 Cb 0.00 -3.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 1wf8 s ILE 71 CO 0.00 0.15 0.47 -0.55 0.00 0.00 0.00 174.94 175.01 1wf8 s SER 72 N -0.47 6.47 -0.45 3.58 0.15 -1.26 0.20 113.70 121.92 1wf8 s SER 72 Ca 0.50 0.56 0.04 0.00 0.70 0.00 0.00 55.95 57.75 1wf8 s SER 72 Cb -0.40 -2.26 0.52 0.00 -1.71 0.00 0.00 66.02 62.17 1wf8 s SER 72 CO 0.54 -0.17 1.71 0.18 1.20 0.00 0.00 173.24 176.69 1wf8 n LEU 73 N 4.91 6.00 -4.71 3.45 4.77 -0.42 -4.95 117.00 126.05 1wf8 n LEU 73 Ca -0.06 -4.05 -0.35 0.00 -0.03 0.00 0.00 56.01 51.52 1wf8 n LEU 73 Cb 0.50 -0.74 -0.09 0.00 -2.33 0.00 0.00 43.42 40.76 1wf8 n LEU 73 CO 0.40 1.41 -0.29 -0.69 -1.33 0.00 0.00 177.39 176.90 1wf8 s VAL 74 N -3.96 4.42 -1.45 4.08 1.01 -1.25 -3.85 120.40 119.39 1wf8 s VAL 74 Ca 0.55 -0.28 -0.08 0.00 0.00 0.00 0.00 61.98 62.17 1wf8 s VAL 74 Cb 0.46 -2.90 0.05 0.00 0.00 0.00 0.00 36.38 33.99 1wf8 s VAL 74 CO 0.03 0.55 0.81 0.61 0.00 0.00 0.00 175.10 177.09 1wf8 n GLY 75 N 1.91 -0.39 3.09 4.51 0.00 0.62 -4.90 105.19 110.03 1wf8 n GLY 75 Ca -0.18 0.16 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 1wf8 n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wf8 s VAL 76 N -3.51 0.75 0.41 1.61 -7.23 -1.21 -4.66 120.40 106.56 1wf8 s VAL 76 Ca 0.36 -1.00 -0.25 0.00 -1.81 0.00 0.00 61.98 59.27 1wf8 s VAL 76 Cb -0.18 -0.75 -0.08 0.00 0.56 0.00 0.00 36.38 35.93 1wf8 s VAL 76 CO 0.84 -0.21 1.23 0.28 -0.31 0.00 0.00 175.10 176.92 1wf8 s THR 77 N -1.10 2.90 0.28 5.32 -1.32 -1.26 -4.62 115.64 115.84 1wf8 s THR 77 Ca -0.05 0.78 0.00 0.00 -1.21 0.00 0.00 61.69 61.21 1wf8 s THR 77 Cb -0.09 -3.44 0.39 0.00 -1.51 0.00 0.00 72.50 67.85 1wf8 s THR 77 CO 0.01 0.09 1.43 1.67 -2.21 0.00 0.00 174.62 175.61 1wf8 n GLN 78 N 0.08 -0.07 -0.05 7.08 7.27 -1.26 -0.15 117.38 130.27 1wf8 n GLN 78 Ca 0.04 1.38 -0.06 0.00 0.07 0.00 0.00 57.00 58.43 1wf8 n GLN 78 Cb 0.45 -2.17 -0.04 0.00 2.41 0.00 0.00 30.24 30.89 1wf8 n GLN 78 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 1wf8 h ASN 79 N 0.00 -0.80 -0.87 1.69 4.21 -1.99 0.87 115.58 118.69 1wf8 h ASN 79 Ca 0.54 0.10 0.14 0.00 1.21 0.00 0.00 56.30 58.29 1wf8 h ASN 79 Cb 1.06 0.32 -0.15 0.00 -1.12 0.00 0.00 38.32 38.44 1wf8 h ASN 79 CO -0.88 -0.18 -0.32 0.33 -1.29 0.00 0.00 177.43 175.10 1wf8 n PHE 80 N -3.85 0.08 0.21 1.19 -0.00 0.79 0.27 117.46 116.15 1wf8 n PHE 80 Ca -0.02 1.07 -0.16 0.00 -0.00 0.00 0.00 57.45 58.34 1wf8 n PHE 80 Cb 0.15 -0.86 -0.09 0.00 -0.00 0.00 0.00 39.48 38.69 1wf8 n PHE 80 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1wf8 h ALA 81 N 1.31 -0.91 -0.95 3.13 0.00 -0.93 0.18 119.26 121.09 1wf8 h ALA 81 Ca 0.32 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 55.27 1wf8 h ALA 81 Cb 0.54 0.68 -0.17 0.00 0.00 0.00 0.00 17.79 18.85 1wf8 h ALA 81 CO -0.87 -1.07 -0.31 0.00 0.00 0.00 0.00 179.25 177.01 1wf8 h ALA 82 N -0.48 0.39 -0.04 0.00 0.00 0.22 0.63 119.26 119.97 1wf8 h ALA 82 Ca -0.02 0.32 0.03 0.00 0.00 0.00 0.00 54.91 55.23 1wf8 h ALA 82 Cb 0.76 0.85 -0.03 0.00 0.00 0.00 0.00 17.79 19.37 1wf8 h ALA 82 CO -0.14 -0.51 -0.12 1.15 0.00 0.00 0.00 179.25 179.63 1wf8 h THR 83 N -0.01 0.68 -0.10 0.00 2.02 -0.29 0.42 112.91 115.62 1wf8 h THR 83 Ca 0.40 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.62 1wf8 h THR 83 Cb 0.65 0.68 -0.06 0.00 -1.74 0.00 0.00 68.15 67.68 1wf8 h THR 83 CO -0.97 0.00 -0.32 0.58 0.37 0.00 0.00 175.52 175.19 1wf8 h VAL 84 N -0.19 0.30 0.00 3.16 2.07 0.21 1.70 116.25 123.49 1wf8 h VAL 84 Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1wf8 h VAL 84 Cb 0.27 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1wf8 h VAL 84 CO -0.15 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 177.35 1wf8 h LEU 85 N -0.41 0.00 0.00 2.57 3.38 0.09 0.14 115.31 121.09 1wf8 h LEU 85 Ca 0.09 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.87 1wf8 h LEU 85 Cb 0.54 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1wf8 h LEU 85 CO -0.33 0.01 -1.06 -0.09 0.09 0.00 0.00 178.44 177.06 1wf8 h ARG 86 N 0.00 0.00 -0.01 1.13 2.43 0.45 -3.33 114.38 115.05 1wf8 h ARG 86 Ca -0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1wf8 h ARG 86 Cb 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1wf8 h ARG 86 CO 0.00 0.64 -0.15 -0.91 -1.51 0.00 0.00 179.97 178.05 1wf8 h ASN 87 N 0.00 0.15 -1.65 -3.80 2.35 0.48 -3.46 115.58 109.65 1wf8 h ASN 87 Ca -0.08 -0.73 -0.49 0.00 -0.55 0.00 0.00 56.30 54.45 1wf8 h ASN 87 Cb 1.67 -0.05 0.16 0.00 0.05 0.00 0.00 38.32 40.16 1wf8 h ASN 87 CO 0.09 0.86 -1.07 0.35 -1.65 0.00 0.00 177.43 176.01 1wf8 n THR 88 N -4.60 0.00 -4.21 2.81 -2.24 0.03 -4.98 114.28 101.08 1wf8 n THR 88 Ca -0.09 -0.41 -0.09 0.00 -2.27 0.00 0.00 64.05 61.19 1wf8 n THR 88 Cb 0.44 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.65 1wf8 n THR 88 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1wf8 n LYS 89 N 1.40 1.51 0.00 -0.78 5.02 -1.26 -5.02 118.16 119.02 1wf8 n LYS 89 Ca 0.05 -1.06 0.00 0.00 -2.02 0.00 0.00 58.31 55.28 1wf8 n LYS 89 Cb 0.40 0.33 0.00 0.00 -0.02 0.00 0.00 35.03 35.74 1wf8 n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wf8 n GLY 90 N 2.94 0.00 3.74 0.72 0.00 -1.26 -3.85 105.19 107.48 1wf8 n GLY 90 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1wf8 n GLY 90 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wf8 s ASN 91 N 0.00 7.44 -0.02 1.61 3.84 -1.25 0.17 114.94 126.73 1wf8 s ASN 91 Ca 0.00 2.01 -0.00 0.00 0.21 0.00 0.00 52.86 55.08 1wf8 s ASN 91 Cb 0.00 -2.61 0.03 0.00 -0.55 0.00 0.00 41.25 38.12 1wf8 s ASN 91 CO 0.00 -0.05 0.04 -0.69 -2.79 0.00 0.00 177.10 173.61 1wf8 s VAL 92 N -0.63 -0.05 -0.42 -5.21 1.01 0.37 -4.92 120.40 110.55 1wf8 s VAL 92 Ca 0.45 0.19 -0.13 0.00 0.00 0.00 0.00 61.98 62.50 1wf8 s VAL 92 Cb -0.27 -0.09 0.05 0.00 0.00 0.00 0.00 36.38 36.07 1wf8 s VAL 92 CO 0.34 0.08 0.29 -0.60 0.00 0.00 0.00 175.10 175.21 1wf8 s ARG 93 N 0.96 2.85 -0.24 2.72 3.52 -1.25 0.43 118.95 127.94 1wf8 s ARG 93 Ca -0.08 -1.23 -0.10 0.00 -0.13 0.00 0.00 55.73 54.19 1wf8 s ARG 93 Cb -0.11 -3.91 -0.05 0.00 -1.56 0.00 0.00 34.95 29.32 1wf8 s ARG 93 CO -0.03 -0.86 0.14 -0.06 -0.81 0.00 0.00 175.30 173.68 1wf8 s PHE 94 N 1.58 3.25 -0.73 5.12 0.08 0.48 0.22 117.98 127.98 1wf8 s PHE 94 Ca 0.03 0.09 -0.15 0.00 0.12 0.00 0.00 56.93 57.03 1wf8 s PHE 94 Cb -0.22 -2.27 0.19 0.00 -0.57 0.00 0.00 43.02 40.15 1wf8 s PHE 94 CO 0.06 -0.04 0.68 0.08 -0.10 0.00 0.00 175.22 175.90 1wf8 s VAL 95 N 1.23 5.46 0.46 -0.44 1.01 -0.15 0.20 120.40 128.17 1wf8 s VAL 95 Ca 0.07 -2.16 -0.19 0.00 0.00 0.00 0.00 61.98 59.70 1wf8 s VAL 95 Cb -0.14 -4.42 -0.09 0.00 0.00 0.00 0.00 36.38 31.73 1wf8 s VAL 95 CO 0.06 -0.98 0.95 -0.63 0.00 0.00 0.00 175.10 174.50 1wf8 s ILE 96 N 0.62 4.48 -0.32 2.22 -1.09 -0.83 -1.27 121.20 125.01 1wf8 s ILE 96 Ca 0.13 1.32 0.01 0.00 -2.23 0.00 0.00 60.65 59.88 1wf8 s ILE 96 Cb -0.17 -3.66 0.07 0.00 -1.58 0.00 0.00 42.46 37.13 1wf8 s ILE 96 CO -0.05 -0.48 0.02 -0.83 -1.23 0.00 0.00 174.94 172.37 1wf8 s GLY 97 N -2.60 1.82 0.01 6.18 0.00 -0.93 -1.85 107.32 109.95 1wf8 s GLY 97 Ca 0.60 -2.08 -0.03 0.00 0.00 0.00 0.00 44.72 43.21 1wf8 s GLY 97 CO 0.22 0.79 0.20 -1.60 0.00 0.00 0.00 173.10 172.71 1wf8 s ARG 98 N 1.11 3.46 -0.21 2.90 6.06 0.12 -4.57 118.95 127.83 1wf8 s ARG 98 Ca 0.00 -0.29 -0.29 0.00 -2.50 0.00 0.00 55.73 52.65 1wf8 s ARG 98 Cb -0.20 -3.08 -0.02 0.00 0.06 0.00 0.00 34.95 31.71 1wf8 s ARG 98 CO -0.04 0.66 1.51 -1.21 -2.50 0.00 0.00 175.30 173.71 1wf8 s GLU 99 N -2.01 3.92 0.68 5.12 2.02 -1.26 0.19 118.70 127.37 1wf8 s GLU 99 Ca 0.29 1.64 -0.12 0.00 0.02 0.00 0.00 54.97 56.79 1wf8 s GLU 99 Cb -0.13 -3.96 0.01 0.00 0.10 0.00 0.00 34.13 30.15 1wf8 s GLU 99 CO 0.20 -1.13 1.07 0.15 0.02 0.00 0.00 175.26 175.57 1wf8 s LYS 100 N 4.34 2.88 0.01 1.61 1.02 -1.26 -4.89 119.74 123.46 1wf8 s LYS 100 Ca 0.66 1.09 -0.30 0.00 0.02 0.00 0.00 55.97 57.44 1wf8 s LYS 100 Cb -0.24 -1.98 -0.05 0.00 -0.52 0.00 0.00 37.83 35.05 1wf8 s LYS 100 CO 0.26 -1.15 1.19 -1.25 -0.92 0.00 0.00 175.35 173.47 1wf8 s PRO 101 N -4.70 4.41 -0.42 -1.68 0.04 -1.26 -4.98 135.00 126.41 1wf8 s PRO 101 Ca 0.61 1.71 0.05 0.00 0.04 0.00 0.00 61.00 63.41 1wf8 s PRO 101 Cb -0.16 -3.44 0.20 0.00 0.04 0.00 0.00 34.50 31.14 1wf8 s PRO 101 CO 0.50 -0.32 0.45 0.45 0.04 0.00 0.00 177.00 178.12 1wf8 n SER 102 N 4.42 -0.75 0.00 6.66 2.88 -1.26 -5.10 113.62 120.47 1wf8 n SER 102 Ca 0.10 -2.55 0.00 0.00 -1.33 0.00 0.00 58.87 55.08 1wf8 n SER 102 Cb 0.47 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 1wf8 n SER 102 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wf8 n GLY 103 N 2.42 3.99 2.34 0.46 0.00 -1.26 -4.96 105.19 108.18 1wf8 n GLY 103 Ca 0.25 -1.25 -0.21 0.00 0.00 0.00 0.00 46.02 44.82 1wf8 n GLY 103 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wf8 n PRO 104 N -1.63 2.26 -1.67 1.61 -0.04 -1.26 -4.78 135.00 129.49 1wf8 n PRO 104 Ca 0.00 -1.36 0.00 0.00 -0.04 0.00 0.00 63.50 62.10 1wf8 n PRO 104 Cb 0.00 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.15 1wf8 n PRO 104 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wf8 n SER 105 N 3.40 -8.75 -4.12 3.54 2.88 -1.26 -4.89 113.62 104.42 1wf8 n SER 105 Ca 0.48 1.23 -0.37 0.00 -1.33 0.00 0.00 58.87 58.89 1wf8 n SER 105 Cb 0.38 -4.59 -0.11 0.00 -0.75 0.00 0.00 64.21 59.14 1wf8 n SER 105 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wf8 s SER 106 N -2.33 5.29 0.00 -3.46 0.01 -1.26 -5.19 113.70 106.76 1wf8 s SER 106 Ca 0.00 -2.34 0.28 0.00 1.31 0.00 0.00 55.95 55.20 1wf8 s SER 106 Cb 0.00 -1.85 1.00 0.00 0.21 0.00 0.00 66.02 65.37 1wf8 s SER 106 CO 0.00 -0.49 1.71 0.61 0.41 0.00 0.00 173.24 175.48