#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 4.82 0.08 1.61 0.01 -1.26 -4.91 113.70 114.05 1wf8 s SER 2 Ca 0.00 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.24 1wf8 s SER 2 Cb 0.00 -1.42 0.00 0.00 0.21 0.00 0.00 66.02 64.81 1wf8 s SER 2 CO 0.00 0.31 0.00 -0.24 0.41 0.00 0.00 173.24 173.72 1wf8 n SER 3 N 2.58 -6.66 0.00 2.44 2.88 -1.26 -5.07 113.62 108.53 1wf8 n SER 3 Ca -0.18 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.39 1wf8 n SER 3 Cb 0.53 -3.66 0.00 0.00 -0.75 0.00 0.00 64.21 60.33 1wf8 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wf8 n GLY 4 N 1.20 0.08 1.45 0.46 0.00 -1.26 -5.14 105.19 101.98 1wf8 n GLY 4 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1wf8 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wf8 n SER 5 N -1.20 -7.81 -1.87 1.61 7.64 -1.26 -5.00 113.62 105.73 1wf8 n SER 5 Ca 0.00 1.72 0.00 0.00 1.01 0.00 0.00 58.87 61.60 1wf8 n SER 5 Cb 0.00 -4.63 0.00 0.00 -1.01 0.00 0.00 64.21 58.57 1wf8 n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wf8 n SER 6 N -2.62 -8.97 -3.15 6.43 2.88 -1.26 -5.00 113.62 101.93 1wf8 n SER 6 Ca -0.00 1.30 -0.19 0.00 -1.33 0.00 0.00 58.87 58.64 1wf8 n SER 6 Cb 0.46 -4.83 -0.05 0.00 -0.75 0.00 0.00 64.21 59.03 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 0.98 1.48 3.51 0.46 0.00 -1.26 -5.13 105.19 105.23 1wf8 n GLY 7 Ca 0.00 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.10 2.72 -0.32 0.99 2.01 -1.26 -3.25 118.68 119.47 1wf8 s LEU 8 Ca 0.33 -0.86 -0.07 0.00 0.01 0.00 0.00 54.13 53.54 1wf8 s LEU 8 Cb 0.08 -1.31 0.03 0.00 0.01 0.00 0.00 46.19 44.99 1wf8 s LEU 8 CO -0.15 0.06 0.10 -1.83 1.01 0.00 0.00 176.35 175.53 1wf8 s GLU 9 N -3.25 2.80 -0.41 1.70 -1.05 0.63 -4.88 118.70 114.24 1wf8 s GLU 9 Ca 0.27 -1.05 -0.15 0.00 -0.15 0.00 0.00 54.97 53.89 1wf8 s GLU 9 Cb -0.06 -3.43 0.02 0.00 -0.44 0.00 0.00 34.13 30.21 1wf8 s GLU 9 CO 0.15 -0.58 0.33 -0.51 0.95 0.00 0.00 175.26 175.60 1wf8 s LEU 10 N 1.44 5.00 -0.04 1.83 1.43 -1.25 -1.29 118.68 125.81 1wf8 s LEU 10 Ca 0.00 -0.81 0.04 0.00 -1.03 0.00 0.00 54.13 52.34 1wf8 s LEU 10 Cb -0.19 -2.22 -0.00 0.00 0.03 0.00 0.00 46.19 43.81 1wf8 s LEU 10 CO 0.03 -0.47 -0.17 0.72 0.23 0.00 0.00 176.35 176.69 1wf8 s PHE 11 N 1.80 1.68 -0.00 0.29 -0.71 -0.69 -4.95 117.98 115.40 1wf8 s PHE 11 Ca 0.07 -0.47 -0.30 0.00 -1.04 0.00 0.00 56.93 55.19 1wf8 s PHE 11 Cb -0.18 -1.13 -0.04 0.00 -1.21 0.00 0.00 43.02 40.45 1wf8 s PHE 11 CO 0.11 -0.16 1.19 -1.25 -1.34 0.00 0.00 175.22 173.78 1wf8 s PRO 12 N 0.02 4.40 -0.16 1.99 0.04 -1.26 -1.74 135.00 138.29 1wf8 s PRO 12 Ca -0.03 1.71 0.01 0.00 0.04 0.00 0.00 61.00 62.72 1wf8 s PRO 12 Cb -0.11 -3.47 0.01 0.00 0.04 0.00 0.00 34.50 30.97 1wf8 s PRO 12 CO 0.02 -0.35 -0.18 0.08 0.04 0.00 0.00 177.00 176.61 1wf8 s VAL 13 N 1.67 2.39 0.25 -0.36 1.01 0.47 -4.88 120.40 120.95 1wf8 s VAL 13 Ca 0.57 -0.86 -0.22 0.00 0.00 0.00 0.00 61.98 61.47 1wf8 s VAL 13 Cb -0.27 -2.00 -0.09 0.00 0.00 0.00 0.00 36.38 34.03 1wf8 s VAL 13 CO 0.25 0.53 0.80 -1.61 0.00 0.00 0.00 175.10 175.07 1wf8 s GLU 14 N 0.94 4.37 -0.09 2.72 2.02 -1.26 0.20 118.70 127.60 1wf8 s GLU 14 Ca -0.03 1.03 -0.08 0.00 0.02 0.00 0.00 54.97 55.91 1wf8 s GLU 14 Cb -0.15 -2.87 0.03 0.00 0.10 0.00 0.00 34.13 31.24 1wf8 s GLU 14 CO -0.03 0.36 0.24 -0.51 0.02 0.00 0.00 175.26 175.34 1wf8 s LEU 15 N -1.97 0.96 -0.30 1.80 1.43 0.28 -4.92 118.68 115.96 1wf8 s LEU 15 Ca 0.45 0.49 -0.08 0.00 -1.03 0.00 0.00 54.13 53.97 1wf8 s LEU 15 Cb -0.18 0.82 0.00 0.00 0.03 0.00 0.00 46.19 46.87 1wf8 s LEU 15 CO 0.22 -0.10 0.11 -1.61 0.23 0.00 0.00 176.35 175.20 1wf8 s GLU 16 N 0.32 3.16 0.45 1.70 2.02 -1.26 0.14 118.70 125.24 1wf8 s GLU 16 Ca -0.02 -0.82 -0.20 0.00 0.02 0.00 0.00 54.97 53.95 1wf8 s GLU 16 Cb -0.03 -3.44 -0.15 0.00 0.10 0.00 0.00 34.13 30.61 1wf8 s GLU 16 CO -0.01 -0.44 0.11 1.63 0.02 0.00 0.00 175.26 176.56 1wf8 n LYS 17 N 4.91 0.10 -4.37 1.61 5.02 0.50 -4.84 118.16 121.10 1wf8 n LYS 17 Ca -0.14 0.04 -0.29 0.00 -2.02 0.00 0.00 58.31 55.90 1wf8 n LYS 17 Cb 0.48 -1.11 -0.06 0.00 -0.02 0.00 0.00 35.03 34.32 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 -1.01 4.31 0.62 4.39 1.01 0.20 -4.85 116.67 121.35 1wf8 s ASP 18 Ca 0.60 -1.39 0.25 0.00 0.71 0.00 0.00 52.55 52.72 1wf8 s ASP 18 Cb -0.58 0.19 1.20 0.00 1.01 0.00 0.00 42.92 44.74 1wf8 s ASP 18 CO 0.63 -0.82 1.65 1.05 0.21 0.00 0.00 175.17 177.89 1wf8 h GLU 19 N 1.24 0.00 0.00 8.23 4.11 -1.99 1.27 114.58 127.44 1wf8 h GLU 19 Ca -0.42 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.96 1wf8 h GLU 19 Cb 1.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1wf8 h GLU 19 CO 0.69 0.00 -1.77 -3.47 0.07 0.00 0.00 179.01 174.53 1wf8 n ASP 20 N -3.26 1.43 0.00 3.06 -0.08 -1.26 -5.11 116.55 111.33 1wf8 n ASP 20 Ca 0.09 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.37 1wf8 n ASP 20 Cb 0.85 1.53 0.00 0.00 2.34 0.00 0.00 41.12 45.84 1wf8 n ASP 20 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wf8 n GLY 21 N 1.72 0.06 0.42 0.27 0.00 0.44 -4.75 105.19 103.35 1wf8 n GLY 21 Ca -0.07 -1.71 -0.18 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.93 -1.56 0.99 3.38 -1.91 0.58 115.31 115.87 1wf8 h LEU 22 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1wf8 h LEU 22 Cb 0.00 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1wf8 h LEU 22 CO 0.00 -0.62 0.00 0.61 0.09 0.00 0.00 178.44 178.52 1wf8 n GLY 23 N -1.53 0.51 3.39 0.83 0.00 -1.26 -1.99 105.19 105.13 1wf8 n GLY 23 Ca -0.14 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.51 0.06 0.15 -0.61 -4.36 -1.26 -2.93 121.20 109.74 1wf8 s ILE 24 Ca 0.00 -0.91 0.08 0.00 -0.26 0.00 0.00 60.65 59.56 1wf8 s ILE 24 Cb 0.00 -1.51 -0.04 0.00 1.25 0.00 0.00 42.46 42.16 1wf8 s ILE 24 CO 0.00 -0.26 -0.10 -0.44 0.24 0.00 0.00 174.94 174.38 1wf8 s SER 25 N -2.88 4.30 0.15 4.36 0.01 -0.43 -4.90 113.70 114.30 1wf8 s SER 25 Ca 0.09 -0.51 0.05 0.00 1.31 0.00 0.00 55.95 56.89 1wf8 s SER 25 Cb 0.01 -0.76 -0.04 0.00 0.21 0.00 0.00 66.02 65.44 1wf8 s SER 25 CO -0.05 0.13 -0.12 0.27 0.41 0.00 0.00 173.24 173.88 1wf8 s ILE 26 N -1.53 1.28 -0.01 1.44 -4.36 -1.26 -2.61 121.20 114.16 1wf8 s ILE 26 Ca 0.24 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.67 1wf8 s ILE 26 Cb -0.10 -1.75 0.01 0.00 1.25 0.00 0.00 42.46 41.86 1wf8 s ILE 26 CO 0.15 -0.62 -0.01 -0.51 0.24 0.00 0.00 174.94 174.19 1wf8 s ILE 27 N -2.89 0.10 -0.39 8.37 2.07 0.31 -4.48 121.20 124.30 1wf8 s ILE 27 Ca 0.15 -0.02 -0.18 0.00 -1.41 0.00 0.00 60.65 59.19 1wf8 s ILE 27 Cb -0.00 -0.12 0.01 0.00 0.13 0.00 0.00 42.46 42.47 1wf8 s ILE 27 CO 0.02 0.05 0.48 -0.83 -1.91 0.00 0.00 174.94 172.75 1wf8 s GLY 28 N 0.19 1.84 0.19 1.50 0.00 -1.26 -1.74 107.32 108.04 1wf8 s GLY 28 Ca -0.02 -1.24 0.04 0.00 0.00 0.00 0.00 44.72 43.51 1wf8 s GLY 28 CO -0.01 1.23 -0.06 1.06 0.00 0.00 0.00 173.10 175.33 1wf8 s MET 29 N 2.31 1.21 -0.30 2.90 1.00 -1.09 -4.97 119.30 120.35 1wf8 s MET 29 Ca 0.16 -1.56 -0.10 0.00 0.00 0.00 0.00 55.69 54.19 1wf8 s MET 29 Cb -0.16 -0.64 -0.01 0.00 0.00 0.00 0.00 34.83 34.01 1wf8 s MET 29 CO 0.14 -0.00 0.15 0.20 0.00 0.00 0.00 175.02 175.51 1wf8 s GLY 30 N -3.24 1.87 -0.09 -0.03 0.00 -1.26 0.87 107.32 105.44 1wf8 s GLY 30 Ca 0.23 -1.32 -0.09 0.00 0.00 0.00 0.00 44.72 43.54 1wf8 s GLY 30 CO 0.05 0.67 0.20 0.14 0.00 0.00 0.00 173.10 174.17 1wf8 s VAL 31 N 1.64 5.40 -0.52 1.40 1.01 -0.83 -4.61 120.40 123.88 1wf8 s VAL 31 Ca 0.05 0.34 -0.14 0.00 0.00 0.00 0.00 61.98 62.22 1wf8 s VAL 31 Cb -0.17 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1wf8 s VAL 31 CO 0.07 0.59 0.50 0.61 0.00 0.00 0.00 175.10 176.87 1wf8 n GLY 32 N 1.88 -0.49 3.49 4.51 0.00 -1.26 -2.24 105.19 111.08 1wf8 n GLY 32 Ca -0.18 0.68 -0.42 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.03 3.48 -0.58 4.61 0.00 -1.26 -4.07 121.76 121.90 1wf8 s ALA 33 Ca 0.14 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.56 1wf8 s ALA 33 Cb -0.01 -2.87 0.45 0.00 0.00 0.00 0.00 23.12 20.68 1wf8 s ALA 33 CO 0.70 -1.34 1.81 -0.25 0.00 0.00 0.00 175.76 176.68 1wf8 n ASP 34 N 5.28 6.97 -3.80 0.00 8.00 -1.24 -4.89 116.55 126.87 1wf8 n ASP 34 Ca -0.10 -3.78 -0.34 0.00 0.71 0.00 0.00 54.79 51.27 1wf8 n ASP 34 Cb 0.48 -0.82 0.03 0.00 -0.02 0.00 0.00 41.12 40.79 1wf8 n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wf8 n ALA 35 N -0.84 -2.52 0.00 2.24 0.00 -1.26 -4.01 120.51 114.13 1wf8 n ALA 35 Ca 0.57 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1wf8 n ALA 35 Cb 0.71 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.59 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 -1.81 2.93 2.70 0.00 0.00 -1.26 -4.99 105.19 102.75 1wf8 n GLY 36 Ca -0.12 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 7.07 -4.87 0.99 4.77 -1.26 -4.99 117.00 118.72 1wf8 n LEU 37 Ca 0.00 -5.39 -0.35 0.00 -0.03 0.00 0.00 56.01 50.24 1wf8 n LEU 37 Cb 0.00 -1.14 -0.06 0.00 -2.33 0.00 0.00 43.42 39.89 1wf8 n LEU 37 CO 0.00 2.03 -0.18 -1.83 -1.33 0.00 0.00 177.39 176.07 1wf8 s GLU 38 N -4.10 3.37 -0.35 3.23 -1.05 -1.26 -3.65 118.70 114.89 1wf8 s GLU 38 Ca 0.39 -0.25 0.01 0.00 -0.15 0.00 0.00 54.97 54.97 1wf8 s GLU 38 Cb 0.18 -3.10 0.11 0.00 -0.44 0.00 0.00 34.13 30.88 1wf8 s GLU 38 CO -0.10 0.72 0.12 0.15 0.95 0.00 0.00 175.26 177.10 1wf8 s LYS 39 N -1.41 1.09 0.00 -4.83 -0.14 -0.95 -4.90 119.74 108.59 1wf8 s LYS 39 Ca 0.20 -1.54 -0.35 0.00 -1.36 0.00 0.00 55.97 52.92 1wf8 s LYS 39 Cb -0.12 -2.44 -0.13 0.00 -1.68 0.00 0.00 37.83 33.46 1wf8 s LYS 39 CO 0.10 -1.02 1.73 -0.11 -0.76 0.00 0.00 175.35 175.29 1wf8 n LEU 40 N 4.35 3.14 -4.53 3.17 7.94 -1.26 -1.96 117.00 127.85 1wf8 n LEU 40 Ca 0.02 1.03 -0.37 0.00 -1.11 0.00 0.00 56.01 55.58 1wf8 n LEU 40 Cb 0.40 -1.37 -0.11 0.00 0.53 0.00 0.00 43.42 42.87 1wf8 n LEU 40 CO 0.18 -0.22 -0.23 -0.83 -1.11 0.00 0.00 177.39 175.17 1wf8 s GLY 41 N 2.66 1.85 -0.69 -3.96 0.00 0.25 -0.71 107.32 106.71 1wf8 s GLY 41 Ca 0.87 -1.04 -0.25 0.00 0.00 0.00 0.00 44.72 44.30 1wf8 s GLY 41 CO 0.47 0.49 1.12 -0.42 0.00 0.00 0.00 173.10 174.76 1wf8 s ILE 42 N 1.44 4.03 0.30 0.90 -1.09 -1.25 -2.69 121.20 122.85 1wf8 s ILE 42 Ca 0.06 0.05 0.06 0.00 -2.23 0.00 0.00 60.65 58.59 1wf8 s ILE 42 Cb -0.15 -4.79 -0.02 0.00 -1.58 0.00 0.00 42.46 35.92 1wf8 s ILE 42 CO 0.06 -1.63 0.38 -0.36 -1.23 0.00 0.00 174.94 172.15 1wf8 s PHE 43 N 4.87 3.15 -0.39 3.97 0.08 -0.71 -1.47 117.98 127.49 1wf8 s PHE 43 Ca 0.29 -0.18 -0.19 0.00 0.12 0.00 0.00 56.93 56.98 1wf8 s PHE 43 Cb -0.12 -1.79 0.01 0.00 -0.57 0.00 0.00 43.02 40.54 1wf8 s PHE 43 CO 0.13 0.19 0.54 0.08 -0.10 0.00 0.00 175.22 176.05 1wf8 s VAL 44 N -2.15 4.97 0.20 -0.44 1.01 0.33 0.11 120.40 124.43 1wf8 s VAL 44 Ca 0.40 0.12 -0.09 0.00 0.00 0.00 0.00 61.98 62.41 1wf8 s VAL 44 Cb -0.08 -4.05 0.13 0.00 0.00 0.00 0.00 36.38 32.37 1wf8 s VAL 44 CO 0.29 -0.38 1.75 0.50 0.00 0.00 0.00 175.10 177.27 1wf8 h LYS 45 N 8.65 1.10 -2.47 2.72 1.63 -1.72 1.64 116.57 128.11 1wf8 h LYS 45 Ca -0.27 -0.21 0.21 0.00 -0.85 0.00 0.00 60.65 59.53 1wf8 h LYS 45 Cb 1.11 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 32.53 1wf8 h LYS 45 CO 0.81 0.91 0.67 -0.08 -3.45 0.00 0.00 179.45 178.32 1wf8 s THR 46 N -5.52 0.00 -0.06 1.00 -1.32 -1.26 -4.58 115.64 103.91 1wf8 s THR 46 Ca -0.12 -0.48 0.03 0.00 -1.21 0.00 0.00 61.69 59.91 1wf8 s THR 46 Cb 0.15 -2.99 0.01 0.00 -1.51 0.00 0.00 72.50 68.16 1wf8 s THR 46 CO 0.83 0.00 -0.14 -0.69 -2.21 0.00 0.00 174.62 172.41 1wf8 s VAL 47 N -2.05 1.23 0.32 5.08 1.01 -1.26 -1.32 120.40 123.41 1wf8 s VAL 47 Ca 0.25 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 1wf8 s VAL 47 Cb -0.02 -1.10 -0.11 0.00 0.00 0.00 0.00 36.38 35.15 1wf8 s VAL 47 CO 0.04 0.37 1.43 -0.89 0.00 0.00 0.00 175.10 176.05 1wf8 s THR 48 N 0.46 2.42 -0.63 3.92 2.01 -1.15 -4.91 115.64 117.76 1wf8 s THR 48 Ca -0.11 0.40 -0.27 0.00 0.31 0.00 0.00 61.69 62.01 1wf8 s THR 48 Cb -0.14 -3.25 0.01 0.00 0.01 0.00 0.00 72.50 69.12 1wf8 s THR 48 CO 0.03 0.08 1.47 -0.70 -0.69 0.00 0.00 174.62 174.82 1wf8 s GLU 49 N -1.39 3.12 0.00 4.92 2.12 -1.26 -2.66 118.70 123.55 1wf8 s GLU 49 Ca 0.54 0.27 0.00 0.00 0.36 0.00 0.00 54.97 56.14 1wf8 s GLU 49 Cb -0.43 -4.20 0.00 0.00 0.26 0.00 0.00 34.13 29.76 1wf8 s GLU 49 CO 0.53 -2.17 0.00 0.41 -0.54 0.00 0.00 175.26 173.49 1wf8 n GLY 50 N 5.39 1.87 0.00 -1.50 0.00 -1.26 -5.10 105.19 104.60 1wf8 n GLY 50 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.85 1.74 0.11 -0.02 0.00 -1.09 -4.88 105.19 100.21 1wf8 n GLY 51 Ca 0.00 -1.98 -0.21 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.07 0.27 -0.19 4.61 0.00 -1.59 -2.63 119.26 118.65 1wf8 h ALA 52 Ca 0.00 -1.20 -0.07 0.00 0.00 0.00 0.00 54.91 53.64 1wf8 h ALA 52 Cb 0.00 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1wf8 h ALA 52 CO 0.00 0.75 -0.20 0.00 0.00 0.00 0.00 179.25 179.80 1wf8 h ALA 53 N -0.37 1.31 0.16 0.00 0.00 -1.76 -1.98 119.26 116.62 1wf8 h ALA 53 Ca -0.34 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1wf8 h ALA 53 Cb 1.41 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1wf8 h ALA 53 CO -0.15 0.46 -0.08 0.37 0.00 0.00 0.00 179.25 179.86 1wf8 h GLN 54 N 0.30 -0.21 -0.97 0.00 -0.00 -1.79 -2.67 115.11 109.77 1wf8 h GLN 54 Ca 0.05 0.01 0.21 0.00 -0.00 0.00 0.00 58.65 58.93 1wf8 h GLN 54 Cb 0.53 0.05 -0.18 0.00 0.00 0.00 0.00 27.48 27.88 1wf8 h GLN 54 CO 0.04 -0.14 -0.18 0.00 0.00 0.00 0.00 178.83 178.54 1wf8 h ARG 55 N -0.51 0.00 0.05 1.69 3.08 -1.50 0.50 114.38 117.68 1wf8 h ARG 55 Ca -0.02 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.05 1wf8 h ARG 55 Cb 0.17 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.17 1wf8 h ARG 55 CO 0.04 0.00 -0.31 0.22 -1.07 0.00 0.00 179.97 178.85 1wf8 h ASP 56 N 0.00 -0.92 0.00 7.04 1.82 -1.45 -3.46 116.42 119.45 1wf8 h ASP 56 Ca 0.49 0.12 0.00 0.00 -0.39 0.00 0.00 57.03 57.25 1wf8 h ASP 56 Cb 0.81 0.36 0.00 0.00 0.68 0.00 0.00 39.33 41.19 1wf8 h ASP 56 CO -0.98 -0.39 0.00 0.61 -1.61 0.00 0.00 179.24 176.88 1wf8 n GLY 57 N -1.41 0.71 0.02 -0.78 0.00 0.18 -4.96 105.19 98.94 1wf8 n GLY 57 Ca -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 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 4.21 -0.04 -6.70 1.61 2.47 -1.82 -3.45 114.38 110.67 1wf8 h ARG 58 Ca 0.00 0.00 -0.52 0.00 -1.26 0.00 0.00 59.98 58.20 1wf8 h ARG 58 Cb 0.00 0.01 0.04 0.00 -1.65 0.00 0.00 29.97 28.37 1wf8 h ARG 58 CO 0.00 -0.03 0.66 0.42 0.56 0.00 0.00 179.97 181.58 1wf8 s ILE 59 N -1.55 3.13 0.48 2.04 1.01 -1.26 -5.02 121.20 120.03 1wf8 s ILE 59 Ca -0.01 0.94 0.04 0.00 0.00 0.00 0.00 60.65 61.62 1wf8 s ILE 59 Cb 0.00 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 1wf8 s ILE 59 CO 0.02 0.15 0.06 -1.10 0.00 0.00 0.00 174.94 174.06 1wf8 s GLN 60 N -0.24 2.14 0.50 2.79 -1.52 -1.26 -4.68 119.66 117.39 1wf8 s GLN 60 Ca 0.56 -2.24 -0.21 0.00 -1.95 0.00 0.00 55.36 51.52 1wf8 s GLN 60 Cb -0.37 -1.65 -0.07 0.00 -0.22 0.00 0.00 33.01 30.70 1wf8 s GLN 60 CO 0.39 -0.28 1.13 0.08 -0.25 0.00 0.00 175.29 176.36 1wf8 s VAL 61 N -2.80 3.25 0.00 1.09 1.01 -1.26 -2.47 120.40 119.21 1wf8 s VAL 61 Ca 0.19 0.83 0.00 0.00 0.00 0.00 0.00 61.98 63.00 1wf8 s VAL 61 Cb 0.04 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1wf8 s VAL 61 CO 0.10 -0.11 0.00 0.59 0.00 0.00 0.00 175.10 175.68 1wf8 n ASN 62 N -0.94 -1.11 -4.77 3.32 3.02 0.56 -4.92 115.26 110.42 1wf8 n ASN 62 Ca 0.10 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.25 1wf8 n ASN 62 Cb 0.50 -0.50 0.01 0.00 -0.61 0.00 0.00 39.78 39.18 1wf8 n ASN 62 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1wf8 s ASP 63 N -2.59 6.02 -0.44 6.41 2.15 -1.03 -4.29 116.67 122.90 1wf8 s ASP 63 Ca 0.00 2.87 -0.09 0.00 0.43 0.00 0.00 52.55 55.76 1wf8 s ASP 63 Cb 0.00 -2.65 0.09 0.00 -0.30 0.00 0.00 42.92 40.06 1wf8 s ASP 63 CO 0.00 -1.07 0.29 -1.58 -0.17 0.00 0.00 175.17 172.64 1wf8 s GLN 64 N -2.36 2.57 -1.10 4.34 0.74 -1.26 0.12 119.66 122.70 1wf8 s GLN 64 Ca 0.59 -1.57 -0.22 0.00 0.05 0.00 0.00 55.36 54.21 1wf8 s GLN 64 Cb -0.43 -3.84 -0.03 0.00 1.10 0.00 0.00 33.01 29.82 1wf8 s GLN 64 CO 0.55 -1.04 1.83 0.42 -0.55 0.00 0.00 175.29 176.50 1wf8 s ILE 65 N 1.41 3.68 0.29 -2.34 1.01 -0.54 -2.69 121.20 122.02 1wf8 s ILE 65 Ca 0.04 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.74 1wf8 s ILE 65 Cb -0.24 -4.61 0.19 0.00 0.01 0.00 0.00 42.46 37.81 1wf8 s ILE 65 CO 0.01 -1.32 1.87 0.58 0.00 0.00 0.00 174.94 176.08 1wf8 h VAL 66 N 6.45 1.22 -3.73 2.92 2.07 -1.63 -3.37 116.25 120.17 1wf8 h VAL 66 Ca 0.23 -0.68 -0.10 0.00 0.82 0.00 0.00 66.70 66.96 1wf8 h VAL 66 Cb 0.95 0.51 -0.16 0.00 -1.52 0.00 0.00 31.29 31.07 1wf8 h VAL 66 CO 1.30 0.27 -0.41 -0.70 0.02 0.00 0.00 177.57 178.04 1wf8 s GLU 67 N -5.39 0.74 -0.10 1.57 2.12 -1.22 -1.24 118.70 115.17 1wf8 s GLU 67 Ca -0.10 -0.81 -0.03 0.00 0.36 0.00 0.00 54.97 54.38 1wf8 s GLU 67 Cb 0.16 0.30 0.05 0.00 0.26 0.00 0.00 34.13 34.90 1wf8 s GLU 67 CO 0.80 -0.22 0.16 0.08 -0.54 0.00 0.00 175.26 175.54 1wf8 s VAL 68 N -3.18 -0.25 -1.41 3.70 1.01 0.55 -1.08 120.40 119.74 1wf8 s VAL 68 Ca -0.00 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1wf8 s VAL 68 Cb 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 36.05 1wf8 s VAL 68 CO -0.07 0.09 0.00 0.47 0.00 0.00 0.00 175.10 175.58 1wf8 n ASP 69 N 5.32 -3.61 0.00 3.32 8.00 0.61 0.15 116.55 130.34 1wf8 n ASP 69 Ca -0.05 0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.77 1wf8 n ASP 69 Cb 0.50 -3.34 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 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 -0.30 2.15 3.75 0.44 0.00 -1.26 -4.95 105.19 105.03 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 -2.26 2.77 -0.22 -0.61 1.01 0.39 -4.98 121.20 117.29 1wf8 s ILE 71 Ca 0.00 0.67 -0.18 0.00 0.00 0.00 0.00 60.65 61.14 1wf8 s ILE 71 Cb 0.00 -3.43 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 1wf8 s ILE 71 CO 0.00 0.12 0.51 -0.94 0.00 0.00 0.00 174.94 174.63 1wf8 s SER 72 N 0.16 6.51 -0.57 3.58 1.04 -1.26 0.21 113.70 123.37 1wf8 s SER 72 Ca 0.56 0.61 0.01 0.00 0.48 0.00 0.00 55.95 57.61 1wf8 s SER 72 Cb -0.40 -2.29 0.44 0.00 0.10 0.00 0.00 66.02 63.87 1wf8 s SER 72 CO 0.45 -0.22 1.74 0.18 0.98 0.00 0.00 173.24 176.37 1wf8 n LEU 73 N 5.08 6.73 -4.61 2.42 4.77 -0.37 -4.95 117.00 126.06 1wf8 n LEU 73 Ca -0.05 -4.53 -0.34 0.00 -0.03 0.00 0.00 56.01 51.06 1wf8 n LEU 73 Cb 0.50 -0.78 -0.11 0.00 -2.33 0.00 0.00 43.42 40.71 1wf8 n LEU 73 CO 0.41 1.73 -0.36 -0.69 -1.33 0.00 0.00 177.39 177.15 1wf8 s VAL 74 N -4.83 3.88 -1.49 4.08 1.01 -1.26 -3.91 120.40 117.90 1wf8 s VAL 74 Ca 0.59 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 1wf8 s VAL 74 Cb 0.47 -2.60 0.07 0.00 0.00 0.00 0.00 36.38 34.31 1wf8 s VAL 74 CO -0.05 0.60 0.91 0.61 0.00 0.00 0.00 175.10 177.17 1wf8 n GLY 75 N 2.22 -0.45 3.16 4.51 0.00 0.11 -4.89 105.19 109.86 1wf8 n GLY 75 Ca -0.18 0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.40 1.04 0.32 1.61 -7.23 -1.21 -4.62 120.40 106.91 1wf8 s VAL 76 Ca 0.51 -1.28 -0.29 0.00 -1.81 0.00 0.00 61.98 59.11 1wf8 s VAL 76 Cb -0.26 -1.02 -0.10 0.00 0.56 0.00 0.00 36.38 35.57 1wf8 s VAL 76 CO 0.83 -0.25 1.27 0.28 -0.31 0.00 0.00 175.10 176.92 1wf8 s THR 77 N -1.29 2.85 0.32 5.32 -1.32 -1.26 -4.63 115.64 115.63 1wf8 s THR 77 Ca -0.03 0.86 0.16 0.00 -1.21 0.00 0.00 61.69 61.47 1wf8 s THR 77 Cb -0.10 -3.55 0.32 0.00 -1.51 0.00 0.00 72.50 67.66 1wf8 s THR 77 CO 0.02 0.21 1.38 1.67 -2.21 0.00 0.00 174.62 175.69 1wf8 n GLN 78 N 0.87 -0.06 0.09 7.08 0.00 -1.26 0.62 117.38 124.72 1wf8 n GLN 78 Ca -0.00 1.22 -0.13 0.00 -0.00 0.00 0.00 57.00 58.09 1wf8 n GLN 78 Cb 0.42 -2.16 -0.08 0.00 0.00 0.00 0.00 30.24 28.43 1wf8 n GLN 78 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.06 176.09 1wf8 h ASN 79 N 0.00 -1.24 -0.99 1.69 -0.73 -1.98 0.35 115.58 112.68 1wf8 h ASN 79 Ca 0.71 0.13 0.12 0.00 1.87 0.00 0.00 56.30 59.13 1wf8 h ASN 79 Cb 1.83 0.46 -0.14 0.00 0.27 0.00 0.00 38.32 40.73 1wf8 h ASN 79 CO -0.70 -0.44 -0.48 0.15 -0.37 0.00 0.00 177.43 175.59 1wf8 h PHE 80 N -0.59 -1.46 -0.09 0.67 3.04 -0.17 0.70 116.94 119.04 1wf8 h PHE 80 Ca -0.01 0.12 0.03 0.00 3.98 0.00 0.00 57.97 62.09 1wf8 h PHE 80 Cb 0.59 0.78 -0.04 0.00 2.56 0.00 0.00 35.95 39.84 1wf8 h PHE 80 CO -0.42 -0.39 -0.12 0.00 -2.02 0.00 0.00 178.31 175.36 1wf8 h ALA 81 N 0.97 -0.06 -0.68 2.41 0.00 -1.24 0.18 119.26 120.83 1wf8 h ALA 81 Ca 0.26 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.35 1wf8 h ALA 81 Cb 0.51 0.24 -0.10 0.00 0.00 0.00 0.00 17.79 18.44 1wf8 h ALA 81 CO -0.96 -0.59 0.13 0.00 0.00 0.00 0.00 179.25 177.84 1wf8 h ALA 82 N 0.88 0.83 0.04 0.00 0.00 0.38 0.42 119.26 121.80 1wf8 h ALA 82 Ca 0.07 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1wf8 h ALA 82 Cb 0.27 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1wf8 h ALA 82 CO -0.19 -0.33 -0.02 1.15 0.00 0.00 0.00 179.25 179.86 1wf8 h THR 83 N 0.24 1.00 0.16 0.00 2.02 0.13 -0.91 112.91 115.55 1wf8 h THR 83 Ca 0.37 -0.11 0.02 0.00 0.77 0.00 0.00 66.41 67.46 1wf8 h THR 83 Cb 0.61 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 1wf8 h THR 83 CO -0.48 0.03 -0.35 0.58 0.37 0.00 0.00 175.52 175.66 1wf8 h VAL 84 N -0.10 0.26 -0.38 3.16 2.07 0.99 0.84 116.25 123.09 1wf8 h VAL 84 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1wf8 h VAL 84 Cb 0.08 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1wf8 h VAL 84 CO 0.01 0.00 0.43 -0.07 0.02 0.00 0.00 177.57 177.96 1wf8 h LEU 85 N -0.61 0.00 0.00 2.57 3.38 -0.12 1.16 115.31 121.68 1wf8 h LEU 85 Ca 0.02 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1wf8 h LEU 85 Cb 0.62 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1wf8 h LEU 85 CO -0.18 0.00 -1.01 0.03 0.09 0.00 0.00 178.44 177.37 1wf8 h ARG 86 N 0.00 0.00 0.05 1.13 3.08 0.92 -3.31 114.38 116.25 1wf8 h ARG 86 Ca 0.18 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.97 1wf8 h ARG 86 Cb 1.03 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.10 1wf8 h ARG 86 CO -0.00 0.29 -1.08 -0.91 -1.07 0.00 0.00 179.97 177.19 1wf8 h ASN 87 N 0.00 0.71 -1.84 7.04 2.35 0.78 -3.46 115.58 121.16 1wf8 h ASN 87 Ca -0.08 -0.61 -0.53 0.00 -0.55 0.00 0.00 56.30 54.53 1wf8 h ASN 87 Cb 1.40 -0.22 0.24 0.00 0.05 0.00 0.00 38.32 39.80 1wf8 h ASN 87 CO 0.04 1.42 -1.99 0.35 -1.65 0.00 0.00 177.43 175.60 1wf8 n THR 88 N -3.76 0.00 -4.09 2.81 -2.24 0.44 -5.01 114.28 102.43 1wf8 n THR 88 Ca -0.10 -0.32 -0.05 0.00 -2.27 0.00 0.00 64.05 61.31 1wf8 n THR 88 Cb 0.91 -0.08 -0.02 0.00 -2.10 0.00 0.00 70.33 69.04 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 1.96 0.51 0.00 -0.78 4.76 -1.26 -5.04 118.16 118.30 1wf8 n LYS 89 Ca -0.01 -0.72 0.00 0.00 -2.87 0.00 0.00 58.31 54.71 1wf8 n LYS 89 Cb 0.62 0.48 0.00 0.00 -1.84 0.00 0.00 35.03 34.29 1wf8 n LYS 89 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wf8 n GLY 90 N 0.86 0.00 3.75 0.72 0.00 -1.26 -3.86 105.19 105.40 1wf8 n GLY 90 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 7.58 -0.05 1.61 3.84 -1.26 0.19 114.94 126.86 1wf8 s ASN 91 Ca 0.00 1.88 -0.02 0.00 0.21 0.00 0.00 52.86 54.93 1wf8 s ASN 91 Cb 0.00 -2.59 0.04 0.00 -0.55 0.00 0.00 41.25 38.14 1wf8 s ASN 91 CO 0.00 0.12 0.10 -0.69 -2.79 0.00 0.00 177.10 173.84 1wf8 s VAL 92 N -0.93 -0.06 -0.26 -5.21 1.01 0.38 -4.92 120.40 110.41 1wf8 s VAL 92 Ca 0.41 0.20 -0.09 0.00 0.00 0.00 0.00 61.98 62.51 1wf8 s VAL 92 Cb -0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 1wf8 s VAL 92 CO 0.31 0.08 0.13 -0.13 0.00 0.00 0.00 175.10 175.49 1wf8 s ARG 93 N 1.18 3.84 -0.20 2.72 3.00 -1.26 0.10 118.95 128.33 1wf8 s ARG 93 Ca -0.09 -0.38 -0.02 0.00 0.00 0.00 0.00 55.73 55.24 1wf8 s ARG 93 Cb -0.12 -3.48 -0.00 0.00 0.00 0.00 0.00 34.95 31.35 1wf8 s ARG 93 CO -0.05 -0.13 -0.09 -0.06 0.00 0.00 0.00 175.30 174.98 1wf8 s PHE 94 N 1.54 2.90 -0.76 -0.53 0.08 0.55 0.22 117.98 121.99 1wf8 s PHE 94 Ca 0.06 -1.01 -0.17 0.00 0.12 0.00 0.00 56.93 55.93 1wf8 s PHE 94 Cb -0.15 -2.03 0.14 0.00 -0.57 0.00 0.00 43.02 40.41 1wf8 s PHE 94 CO 0.07 -0.54 0.84 0.08 -0.10 0.00 0.00 175.22 175.57 1wf8 s VAL 95 N 1.25 5.02 0.37 -0.44 1.01 -0.24 0.18 120.40 127.55 1wf8 s VAL 95 Ca 0.03 -1.59 -0.24 0.00 0.00 0.00 0.00 61.98 60.18 1wf8 s VAL 95 Cb -0.14 -4.57 -0.10 0.00 0.00 0.00 0.00 36.38 31.57 1wf8 s VAL 95 CO -0.04 -1.21 0.95 -0.63 0.00 0.00 0.00 175.10 174.18 1wf8 s ILE 96 N 1.95 4.24 -0.34 2.22 -1.09 -0.71 -1.78 121.20 125.69 1wf8 s ILE 96 Ca 0.19 1.66 0.02 0.00 -2.23 0.00 0.00 60.65 60.29 1wf8 s ILE 96 Cb -0.15 -3.83 0.09 0.00 -1.58 0.00 0.00 42.46 36.99 1wf8 s ILE 96 CO -0.03 -0.04 0.06 -0.83 -1.23 0.00 0.00 174.94 172.88 1wf8 s GLY 97 N -1.82 1.90 0.18 6.18 0.00 -1.10 -1.71 107.32 110.95 1wf8 s GLY 97 Ca 0.55 -2.37 0.04 0.00 0.00 0.00 0.00 44.72 42.94 1wf8 s GLY 97 CO 0.20 0.89 0.27 -1.60 0.00 0.00 0.00 173.10 172.87 1wf8 s ARG 98 N 1.01 3.32 -0.15 2.90 6.06 -0.41 -4.55 118.95 127.13 1wf8 s ARG 98 Ca 0.06 -0.70 -0.12 0.00 -2.50 0.00 0.00 55.73 52.47 1wf8 s ARG 98 Cb -0.20 -2.87 -0.05 0.00 0.06 0.00 0.00 34.95 31.89 1wf8 s ARG 98 CO -0.06 0.49 0.24 -2.00 -2.50 0.00 0.00 175.30 171.47 1wf8 s GLU 99 N -3.41 4.11 0.24 5.12 2.12 -1.26 0.23 118.70 125.85 1wf8 s GLU 99 Ca 0.34 0.00 0.09 0.00 0.36 0.00 0.00 54.97 55.76 1wf8 s GLU 99 Cb -0.10 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 1wf8 s GLU 99 CO 0.28 0.35 -0.03 0.15 -0.54 0.00 0.00 175.26 175.47 1wf8 s LYS 100 N 0.15 2.23 0.90 4.30 1.02 -1.20 -4.95 119.74 122.19 1wf8 s LYS 100 Ca 0.14 -1.37 -0.12 0.00 0.02 0.00 0.00 55.97 54.65 1wf8 s LYS 100 Cb -0.13 -2.17 0.13 0.00 -0.52 0.00 0.00 37.83 35.15 1wf8 s LYS 100 CO 0.03 0.39 1.13 -1.25 -0.92 0.00 0.00 175.35 174.73 1wf8 s PRO 101 N -3.40 1.19 -0.71 -1.68 0.04 -1.26 -4.93 135.00 124.25 1wf8 s PRO 101 Ca 0.29 0.31 0.03 0.00 0.04 0.00 0.00 61.00 61.67 1wf8 s PRO 101 Cb -0.07 -1.84 0.17 0.00 0.04 0.00 0.00 34.50 32.80 1wf8 s PRO 101 CO 0.18 -2.17 0.52 -1.54 0.04 0.00 0.00 177.00 174.04 1wf8 s SER 102 N -4.02 5.05 0.00 6.66 1.04 -1.26 -5.02 113.70 116.14 1wf8 s SER 102 Ca 0.64 -3.62 0.00 0.00 0.48 0.00 0.00 55.95 53.45 1wf8 s SER 102 Cb -0.15 -1.72 0.00 0.00 0.10 0.00 0.00 66.02 64.25 1wf8 s SER 102 CO 0.53 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.21 1wf8 n GLY 103 N 2.35 0.82 3.76 7.32 0.00 -1.26 -5.10 105.19 113.07 1wf8 n GLY 103 Ca 0.17 -2.17 -0.30 0.00 0.00 0.00 0.00 46.02 43.72 1wf8 n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wf8 s PRO 104 N -0.94 -0.31 0.11 1.61 0.04 -1.26 -5.10 135.00 129.15 1wf8 s PRO 104 Ca 0.00 -0.25 -0.26 0.00 0.04 0.00 0.00 61.00 60.52 1wf8 s PRO 104 Cb 0.00 -1.72 0.08 0.00 0.04 0.00 0.00 34.50 32.90 1wf8 s PRO 104 CO 0.00 -3.07 1.05 -1.12 0.04 0.00 0.00 177.00 173.90 1wf8 s SER 105 N -4.41 -0.14 -0.36 6.66 0.01 -1.26 -5.13 113.70 109.07 1wf8 s SER 105 Ca 0.73 -0.34 -0.18 0.00 1.31 0.00 0.00 55.95 57.47 1wf8 s SER 105 Cb -0.06 0.40 -0.00 0.00 0.21 0.00 0.00 66.02 66.56 1wf8 s SER 105 CO 0.54 -0.74 0.50 -0.44 0.41 0.00 0.00 173.24 173.52 1wf8 s SER 106 N -2.97 6.29 0.00 2.44 0.01 -1.26 -5.30 113.70 112.92 1wf8 s SER 106 Ca 0.13 -0.12 0.19 0.00 1.31 0.00 0.00 55.95 57.46 1wf8 s SER 106 Cb 0.00 -2.26 0.15 0.00 0.21 0.00 0.00 66.02 64.12 1wf8 s SER 106 CO 0.01 -0.49 1.10 0.61 0.41 0.00 0.00 173.24 174.88