#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 4.23 -0.64 1.61 0.01 -1.26 -5.07 113.70 112.58 1wf8 s SER 2 Ca 0.00 -0.65 -0.27 0.00 1.31 0.00 0.00 55.95 56.34 1wf8 s SER 2 Cb 0.00 -0.69 0.02 0.00 0.21 0.00 0.00 66.02 65.55 1wf8 s SER 2 CO 0.00 0.07 1.40 -0.55 0.41 0.00 0.00 173.24 174.57 1wf8 s SER 3 N -3.09 6.06 0.00 2.44 0.15 -1.26 -4.88 113.70 113.12 1wf8 s SER 3 Ca 0.27 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1wf8 s SER 3 Cb -0.08 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 1wf8 s SER 3 CO 0.16 -1.83 0.00 0.61 1.20 0.00 0.00 173.24 173.38 1wf8 n GLY 4 N 5.35 5.58 1.28 9.45 0.00 -1.26 -5.14 105.19 120.44 1wf8 n GLY 4 Ca 0.09 -1.03 0.05 0.00 0.00 0.00 0.00 46.02 45.14 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 0.00 -6.89 -4.23 1.61 7.64 -1.26 -4.78 113.62 105.71 1wf8 n SER 5 Ca 0.00 1.45 -0.46 0.00 1.01 0.00 0.00 58.87 60.87 1wf8 n SER 5 Cb 0.00 -4.11 -0.03 0.00 -1.01 0.00 0.00 64.21 59.06 1wf8 n SER 5 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1wf8 n SER 6 N -2.96 -1.22 -3.49 6.43 3.41 -1.26 -4.92 113.62 109.61 1wf8 n SER 6 Ca -0.03 1.08 -0.27 0.00 -0.26 0.00 0.00 58.87 59.40 1wf8 n SER 6 Cb 0.46 -0.91 -0.09 0.00 -0.26 0.00 0.00 64.21 63.41 1wf8 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wf8 n GLY 7 N 1.93 3.69 3.31 5.00 0.00 -1.26 -5.08 105.19 112.77 1wf8 n GLY 7 Ca 0.17 -2.19 -0.21 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.47 2.43 -0.70 0.99 2.01 -1.26 -4.15 118.68 116.52 1wf8 s LEU 8 Ca 0.34 -0.85 -0.21 0.00 0.01 0.00 0.00 54.13 53.42 1wf8 s LEU 8 Cb 0.09 -0.76 0.09 0.00 0.01 0.00 0.00 46.19 45.62 1wf8 s LEU 8 CO -0.11 -0.06 0.93 -0.70 1.01 0.00 0.00 176.35 177.42 1wf8 s GLU 9 N -2.76 3.20 -0.41 1.70 2.12 0.49 -4.87 118.70 118.17 1wf8 s GLU 9 Ca 0.14 -1.18 -0.18 0.00 0.36 0.00 0.00 54.97 54.10 1wf8 s GLU 9 Cb -0.06 -4.39 0.02 0.00 0.26 0.00 0.00 34.13 29.97 1wf8 s GLU 9 CO 0.06 -1.73 0.50 -0.51 -0.54 0.00 0.00 175.26 173.04 1wf8 s LEU 10 N 3.36 4.68 -0.03 2.70 2.01 -1.25 -1.27 118.68 128.87 1wf8 s LEU 10 Ca 0.22 -0.48 0.03 0.00 0.01 0.00 0.00 54.13 53.90 1wf8 s LEU 10 Cb -0.16 -2.51 0.00 0.00 0.01 0.00 0.00 46.19 43.53 1wf8 s LEU 10 CO 0.05 -0.61 -0.10 0.72 1.01 0.00 0.00 176.35 177.41 1wf8 s PHE 11 N 2.36 1.05 0.16 0.29 -0.71 -0.75 -4.96 117.98 115.42 1wf8 s PHE 11 Ca 0.16 -0.26 -0.30 0.00 -1.04 0.00 0.00 56.93 55.48 1wf8 s PHE 11 Cb -0.16 -0.74 -0.07 0.00 -1.21 0.00 0.00 43.02 40.84 1wf8 s PHE 11 CO 0.15 -0.10 1.12 -1.25 -1.34 0.00 0.00 175.22 173.80 1wf8 s PRO 12 N 0.13 4.56 -0.11 1.99 0.04 -1.26 -1.81 135.00 138.54 1wf8 s PRO 12 Ca -0.03 1.74 0.01 0.00 0.04 0.00 0.00 61.00 62.76 1wf8 s PRO 12 Cb -0.09 -3.28 0.02 0.00 0.04 0.00 0.00 34.50 31.19 1wf8 s PRO 12 CO 0.01 0.01 -0.11 0.08 0.04 0.00 0.00 177.00 177.02 1wf8 s VAL 13 N -0.05 1.25 0.09 -0.36 1.01 0.48 -4.89 120.40 117.93 1wf8 s VAL 13 Ca 0.51 -0.46 -0.26 0.00 0.00 0.00 0.00 61.98 61.77 1wf8 s VAL 13 Cb -0.30 -1.20 -0.06 0.00 0.00 0.00 0.00 36.38 34.82 1wf8 s VAL 13 CO 0.34 0.40 0.79 -1.61 0.00 0.00 0.00 175.10 175.03 1wf8 s GLU 14 N 1.37 4.54 -0.06 2.72 2.02 -1.26 0.16 118.70 128.19 1wf8 s GLU 14 Ca -0.00 1.14 -0.03 0.00 0.02 0.00 0.00 54.97 56.10 1wf8 s GLU 14 Cb -0.13 -3.34 0.04 0.00 0.10 0.00 0.00 34.13 30.80 1wf8 s GLU 14 CO -0.06 0.36 0.13 -0.51 0.02 0.00 0.00 175.26 175.20 1wf8 s LEU 15 N -0.36 0.64 -0.18 1.80 1.43 0.22 -4.91 118.68 117.31 1wf8 s LEU 15 Ca 0.39 0.27 -0.15 0.00 -1.03 0.00 0.00 54.13 53.61 1wf8 s LEU 15 Cb -0.22 0.30 -0.04 0.00 0.03 0.00 0.00 46.19 46.26 1wf8 s LEU 15 CO 0.25 -0.16 0.34 -1.61 0.23 0.00 0.00 176.35 175.39 1wf8 s GLU 16 N 1.33 4.21 0.62 1.70 2.02 -1.25 0.20 118.70 127.54 1wf8 s GLU 16 Ca -0.07 0.13 -0.18 0.00 0.02 0.00 0.00 54.97 54.86 1wf8 s GLU 16 Cb -0.12 -3.48 -0.02 0.00 0.10 0.00 0.00 34.13 30.60 1wf8 s GLU 16 CO -0.06 0.10 1.25 0.15 0.02 0.00 0.00 175.26 176.72 1wf8 s LYS 17 N 0.90 2.77 0.46 1.61 1.02 0.58 -4.78 119.74 122.30 1wf8 s LYS 17 Ca 0.17 1.95 0.03 0.00 0.02 0.00 0.00 55.97 58.15 1wf8 s LYS 17 Cb -0.14 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.24 1wf8 s LYS 17 CO 0.06 -1.40 0.02 -0.51 -0.92 0.00 0.00 175.35 172.60 1wf8 s ASP 18 N -1.48 3.82 0.52 2.83 1.01 0.43 -4.89 116.67 118.90 1wf8 s ASP 18 Ca 0.80 -1.56 0.47 0.00 0.71 0.00 0.00 52.55 52.97 1wf8 s ASP 18 Cb -0.34 0.22 1.62 0.00 1.01 0.00 0.00 42.92 45.43 1wf8 s ASP 18 CO 0.36 -0.73 1.47 -1.84 0.21 0.00 0.00 175.17 174.64 1wf8 n GLU 19 N -1.11 -0.00 -2.61 8.23 0.28 -1.26 0.20 120.64 124.37 1wf8 n GLU 19 Ca -0.13 1.03 -0.28 0.00 -0.16 0.00 0.00 57.16 57.63 1wf8 n GLU 19 Cb 0.67 -2.35 -0.01 0.00 1.43 0.00 0.00 31.44 31.17 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 -3.86 4.76 0.00 -1.84 -0.08 -1.26 -5.08 116.55 109.20 1wf8 n ASP 20 Ca 0.42 -3.71 0.00 0.00 -1.51 0.00 0.00 54.79 49.98 1wf8 n ASP 20 Cb 1.88 -0.52 0.00 0.00 2.34 0.00 0.00 41.12 44.82 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 -0.40 1.20 0.24 0.27 0.00 0.54 -3.53 105.19 103.51 1wf8 n GLY 21 Ca 0.37 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.45 0.00 0.99 3.38 -1.86 1.26 115.31 118.62 1wf8 h LEU 22 Ca 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1wf8 h LEU 22 Cb 0.00 0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1wf8 h LEU 22 CO 0.00 -0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.08 1wf8 n GLY 23 N -0.19 1.20 3.20 0.83 0.00 -1.23 -0.14 105.19 108.85 1wf8 n GLY 23 Ca -0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.00 1.03 0.21 -0.61 -4.36 -1.26 -1.22 121.20 112.98 1wf8 s ILE 24 Ca 0.00 -1.76 0.09 0.00 -0.26 0.00 0.00 60.65 58.72 1wf8 s ILE 24 Cb 0.00 -1.50 -0.04 0.00 1.25 0.00 0.00 42.46 42.16 1wf8 s ILE 24 CO 0.00 -0.60 -0.06 -0.44 0.24 0.00 0.00 174.94 174.09 1wf8 s SER 25 N -2.63 4.39 0.38 4.36 0.01 0.23 -4.94 113.70 115.50 1wf8 s SER 25 Ca 0.09 -0.58 0.04 0.00 1.31 0.00 0.00 55.95 56.81 1wf8 s SER 25 Cb -0.02 -0.79 -0.06 0.00 0.21 0.00 0.00 66.02 65.37 1wf8 s SER 25 CO 0.00 0.07 0.05 0.27 0.41 0.00 0.00 173.24 174.04 1wf8 s ILE 26 N -1.90 1.36 -0.08 1.44 -4.36 -1.26 -2.00 121.20 114.41 1wf8 s ILE 26 Ca 0.27 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.54 1wf8 s ILE 26 Cb -0.08 -2.73 0.03 0.00 1.25 0.00 0.00 42.46 40.92 1wf8 s ILE 26 CO 0.17 0.00 0.30 -0.51 0.24 0.00 0.00 174.94 175.14 1wf8 s ILE 27 N -3.06 0.02 -0.40 8.37 2.07 0.18 -4.18 121.20 124.20 1wf8 s ILE 27 Ca 0.31 -0.18 -0.20 0.00 -1.41 0.00 0.00 60.65 59.17 1wf8 s ILE 27 Cb 0.08 -0.49 0.01 0.00 0.13 0.00 0.00 42.46 42.19 1wf8 s ILE 27 CO 0.15 -0.10 0.59 -0.83 -1.91 0.00 0.00 174.94 172.84 1wf8 s GLY 28 N -0.37 1.76 0.11 1.50 0.00 -1.26 -2.43 107.32 106.64 1wf8 s GLY 28 Ca -0.05 -1.12 0.03 0.00 0.00 0.00 0.00 44.72 43.58 1wf8 s GLY 28 CO 0.02 1.43 -0.09 1.06 0.00 0.00 0.00 173.10 175.52 1wf8 s MET 29 N 2.63 0.91 -0.31 2.90 -1.94 -1.13 -5.02 119.30 117.34 1wf8 s MET 29 Ca 0.21 -1.33 -0.06 0.00 -1.71 0.00 0.00 55.69 52.80 1wf8 s MET 29 Cb -0.15 -0.43 0.03 0.00 2.01 0.00 0.00 34.83 36.29 1wf8 s MET 29 CO 0.16 0.04 0.08 0.20 -0.01 0.00 0.00 175.02 175.50 1wf8 s GLY 30 N -2.93 1.81 -0.03 -0.03 0.00 -1.26 0.97 107.32 105.85 1wf8 s GLY 30 Ca 0.12 -1.61 -0.10 0.00 0.00 0.00 0.00 44.72 43.13 1wf8 s GLY 30 CO -0.02 0.71 0.28 0.14 0.00 0.00 0.00 173.10 174.21 1wf8 s VAL 31 N 1.44 5.26 -1.00 1.40 1.01 -0.74 -4.47 120.40 123.30 1wf8 s VAL 31 Ca 0.00 0.43 -0.28 0.00 0.00 0.00 0.00 61.98 62.13 1wf8 s VAL 31 Cb -0.18 -3.57 0.04 0.00 0.00 0.00 0.00 36.38 32.67 1wf8 s VAL 31 CO 0.02 0.51 0.56 0.61 0.00 0.00 0.00 175.10 176.81 1wf8 n GLY 32 N 1.62 -0.71 3.55 4.51 0.00 -1.26 -2.42 105.19 110.48 1wf8 n GLY 32 Ca -0.15 0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.72 2.53 -0.31 4.61 0.00 -1.26 -4.25 121.76 119.35 1wf8 s ALA 33 Ca 0.39 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 51.34 1wf8 s ALA 33 Cb -0.22 -4.26 0.05 0.00 0.00 0.00 0.00 23.12 18.69 1wf8 s ALA 33 CO 0.81 -3.48 2.64 -0.25 0.00 0.00 0.00 175.76 175.48 1wf8 n ASP 34 N 10.77 6.20 0.00 0.00 9.92 -1.07 -4.87 116.55 137.51 1wf8 n ASP 34 Ca 0.11 -2.99 0.00 0.00 -0.53 0.00 0.00 54.79 51.38 1wf8 n ASP 34 Cb 0.50 -1.21 0.00 0.00 -0.64 0.00 0.00 41.12 39.78 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 1.03 0.00 0.06 2.24 0.00 -1.26 -2.48 120.51 120.09 1wf8 n ALA 35 Ca 0.39 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.88 1wf8 n ALA 35 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.99 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 -0.42 2.70 0.00 0.00 -1.26 -4.66 105.19 101.56 1wf8 n GLY 36 Ca 0.00 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.79 7.07 -4.90 0.99 4.77 -1.04 -4.99 117.00 117.11 1wf8 n LEU 37 Ca -0.01 -5.38 -0.26 0.00 -0.03 0.00 0.00 56.01 50.33 1wf8 n LEU 37 Cb 0.26 -1.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.17 1wf8 n LEU 37 CO 0.22 2.02 -0.13 -1.83 -1.33 0.00 0.00 177.39 176.34 1wf8 s GLU 38 N -4.08 3.28 -0.34 3.23 -1.05 -1.26 -2.58 118.70 115.89 1wf8 s GLU 38 Ca 0.38 -0.70 0.01 0.00 -0.15 0.00 0.00 54.97 54.52 1wf8 s GLU 38 Cb 0.18 -2.86 0.10 0.00 -0.44 0.00 0.00 34.13 31.11 1wf8 s GLU 38 CO -0.10 0.50 0.10 0.15 0.95 0.00 0.00 175.26 176.86 1wf8 s LYS 39 N -3.29 1.08 -0.23 -4.83 -0.14 -1.01 -4.92 119.74 106.40 1wf8 s LYS 39 Ca 0.33 -1.50 -0.32 0.00 -1.36 0.00 0.00 55.97 53.13 1wf8 s LYS 39 Cb -0.10 -2.48 -0.09 0.00 -1.68 0.00 0.00 37.83 33.48 1wf8 s LYS 39 CO 0.27 -1.00 2.14 -0.11 -0.76 0.00 0.00 175.35 175.89 1wf8 n LEU 40 N 4.44 2.94 -4.56 3.17 7.94 -1.26 -1.79 117.00 127.88 1wf8 n LEU 40 Ca 0.01 0.45 -0.42 0.00 -1.11 0.00 0.00 56.01 54.95 1wf8 n LEU 40 Cb 0.41 -1.42 -0.07 0.00 0.53 0.00 0.00 43.42 42.87 1wf8 n LEU 40 CO 0.17 -0.55 0.32 -0.83 -1.11 0.00 0.00 177.39 175.39 1wf8 s GLY 41 N 7.00 1.78 -0.71 -3.96 0.00 0.27 0.17 107.32 111.87 1wf8 s GLY 41 Ca 1.02 -0.94 -0.25 0.00 0.00 0.00 0.00 44.72 44.55 1wf8 s GLY 41 CO 0.44 1.40 1.15 -0.42 0.00 0.00 0.00 173.10 175.67 1wf8 s ILE 42 N 2.58 3.97 0.33 0.90 -1.09 -1.26 -2.86 121.20 123.77 1wf8 s ILE 42 Ca 0.22 0.08 0.05 0.00 -2.23 0.00 0.00 60.65 58.77 1wf8 s ILE 42 Cb -0.15 -4.83 -0.01 0.00 -1.58 0.00 0.00 42.46 35.89 1wf8 s ILE 42 CO 0.14 -1.70 0.48 -0.36 -1.23 0.00 0.00 174.94 172.27 1wf8 s PHE 43 N 5.05 3.24 -0.44 3.97 0.40 -1.02 -0.59 117.98 128.59 1wf8 s PHE 43 Ca 0.30 -0.07 -0.24 0.00 -0.60 0.00 0.00 56.93 56.32 1wf8 s PHE 43 Cb -0.11 -1.93 0.02 0.00 0.51 0.00 0.00 43.02 41.51 1wf8 s PHE 43 CO 0.13 0.06 0.81 0.08 0.70 0.00 0.00 175.22 177.00 1wf8 s VAL 44 N -2.19 4.62 0.19 -0.44 1.01 0.15 0.48 120.40 124.22 1wf8 s VAL 44 Ca 0.42 0.54 -0.11 0.00 0.00 0.00 0.00 61.98 62.83 1wf8 s VAL 44 Cb -0.09 -4.34 0.11 0.00 0.00 0.00 0.00 36.38 32.06 1wf8 s VAL 44 CO 0.32 -0.72 1.80 0.50 0.00 0.00 0.00 175.10 177.00 1wf8 h LYS 45 N 8.96 0.94 -2.10 2.72 1.63 -1.56 0.19 116.57 127.35 1wf8 h LYS 45 Ca -0.25 -0.12 0.23 0.00 -0.85 0.00 0.00 60.65 59.67 1wf8 h LYS 45 Cb 1.08 -0.18 -0.08 0.00 -0.60 0.00 0.00 32.23 32.45 1wf8 h LYS 45 CO 0.97 0.72 0.64 -0.08 -3.45 0.00 0.00 179.45 178.25 1wf8 s THR 46 N -5.80 0.00 -0.10 1.00 -1.32 -1.25 -4.66 115.64 103.51 1wf8 s THR 46 Ca -0.13 -0.48 0.01 0.00 -1.21 0.00 0.00 61.69 59.88 1wf8 s THR 46 Cb 0.14 -2.27 0.02 0.00 -1.51 0.00 0.00 72.50 68.88 1wf8 s THR 46 CO 0.79 0.00 -0.13 -0.69 -2.21 0.00 0.00 174.62 172.38 1wf8 s VAL 47 N -2.69 1.29 0.28 5.08 1.01 -1.26 -0.60 120.40 123.50 1wf8 s VAL 47 Ca 0.16 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 1wf8 s VAL 47 Cb 0.00 -1.20 -0.14 0.00 0.00 0.00 0.00 36.38 35.04 1wf8 s VAL 47 CO 0.01 0.40 1.11 0.41 0.00 0.00 0.00 175.10 177.03 1wf8 n THR 48 N 4.27 1.74 -2.12 3.92 -1.04 -0.36 -4.81 114.28 115.88 1wf8 n THR 48 Ca -0.19 -0.43 -0.39 0.00 -2.04 0.00 0.00 64.05 61.00 1wf8 n THR 48 Cb 0.51 -1.11 -0.03 0.00 -1.82 0.00 0.00 70.33 67.88 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 -1.33 2.71 0.00 -2.82 2.12 -1.26 -1.98 118.70 116.14 1wf8 s GLU 49 Ca 0.61 0.46 0.00 0.00 0.36 0.00 0.00 54.97 56.40 1wf8 s GLU 49 Cb -0.70 -4.37 0.00 0.00 0.26 0.00 0.00 34.13 29.32 1wf8 s GLU 49 CO 0.58 -2.66 0.00 0.41 -0.54 0.00 0.00 175.26 173.05 1wf8 n GLY 50 N 5.68 1.53 0.00 -1.50 0.00 -1.26 -5.10 105.19 104.53 1wf8 n GLY 50 Ca 0.18 -0.19 0.00 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 -1.22 0.44 0.22 -0.02 0.00 -0.84 -4.79 105.19 98.98 1wf8 n GLY 51 Ca 0.00 -1.89 -0.08 0.00 0.00 0.00 0.00 46.02 44.04 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 -0.86 -0.49 0.00 4.61 0.00 -0.78 -0.00 119.26 121.74 1wf8 h ALA 52 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1wf8 h ALA 52 Cb 0.00 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1wf8 h ALA 52 CO 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 179.25 178.75 1wf8 h ALA 53 N -1.03 1.43 0.18 0.00 0.00 -1.83 -1.20 119.26 116.81 1wf8 h ALA 53 Ca -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1wf8 h ALA 53 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1wf8 h ALA 53 CO 0.08 0.04 -0.08 0.37 0.00 0.00 0.00 179.25 179.66 1wf8 h GLN 54 N 0.00 -0.23 -0.73 0.00 -0.00 -1.79 -2.79 115.11 109.58 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 0.09 0.05 -0.12 0.00 0.00 0.00 0.00 27.48 27.50 1wf8 h GLN 54 CO 0.00 -0.15 0.05 0.00 0.00 0.00 0.00 178.83 178.73 1wf8 h ARG 55 N -0.51 0.14 -0.29 1.69 3.08 -0.83 0.16 114.38 117.82 1wf8 h ARG 55 Ca -0.02 -0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.08 1wf8 h ARG 55 Cb 0.18 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.12 1wf8 h ARG 55 CO 0.04 0.09 -0.37 0.22 -1.07 0.00 0.00 179.97 178.88 1wf8 h ASP 56 N 0.14 -1.20 0.00 7.04 3.58 -1.32 -3.45 116.42 121.20 1wf8 h ASP 56 Ca 0.40 0.18 0.00 0.00 0.42 0.00 0.00 57.03 58.03 1wf8 h ASP 56 Cb 0.69 0.53 0.00 0.00 1.72 0.00 0.00 39.33 42.27 1wf8 h ASP 56 CO -0.60 -0.36 0.00 0.61 -2.88 0.00 0.00 179.24 176.00 1wf8 n GLY 57 N -1.42 2.89 0.00 -0.78 0.00 0.04 -4.91 105.19 101.01 1wf8 n GLY 57 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1wf8 n GLY 57 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wf8 n ARG 58 N 0.00 0.00 -2.04 1.61 0.00 -1.26 -4.42 116.66 110.55 1wf8 n ARG 58 Ca 0.00 0.73 -0.42 0.00 -0.00 0.00 0.00 57.85 58.16 1wf8 n ARG 58 Cb 0.00 -1.47 -0.03 0.00 0.00 0.00 0.00 32.46 30.96 1wf8 n ARG 58 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1wf8 s ILE 59 N -2.87 2.95 0.32 5.15 1.01 -1.26 -5.00 121.20 121.50 1wf8 s ILE 59 Ca 0.00 0.67 0.06 0.00 0.00 0.00 0.00 60.65 61.37 1wf8 s ILE 59 Cb 0.00 -3.43 -0.06 0.00 0.01 0.00 0.00 42.46 38.98 1wf8 s ILE 59 CO 0.00 0.05 0.00 -1.10 0.00 0.00 0.00 174.94 173.89 1wf8 s GLN 60 N 1.23 1.67 0.59 2.79 -0.21 -1.26 -4.68 119.66 119.79 1wf8 s GLN 60 Ca 0.68 -1.90 -0.18 0.00 0.02 0.00 0.00 55.36 53.97 1wf8 s GLN 60 Cb -0.40 -1.13 -0.04 0.00 1.00 0.00 0.00 33.01 32.43 1wf8 s GLN 60 CO 0.31 -0.07 1.15 0.08 -2.12 0.00 0.00 175.29 174.64 1wf8 s VAL 61 N -3.07 2.99 0.00 1.09 1.01 -1.26 -2.40 120.40 118.76 1wf8 s VAL 61 Ca 0.33 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.90 1wf8 s VAL 61 Cb 0.07 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1wf8 s VAL 61 CO 0.15 -0.17 0.00 0.59 0.00 0.00 0.00 175.10 175.67 1wf8 n ASN 62 N -1.64 0.00 -4.53 3.32 3.02 0.67 -4.95 115.26 111.16 1wf8 n ASN 62 Ca 0.12 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.39 1wf8 n ASN 62 Cb 0.51 -0.11 0.22 0.00 -0.61 0.00 0.00 39.78 39.78 1wf8 n ASN 62 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1wf8 s ASP 63 N -3.05 1.70 -0.10 6.41 1.11 -1.01 -4.62 116.67 117.11 1wf8 s ASP 63 Ca 0.00 1.24 0.01 0.00 0.18 0.00 0.00 52.55 53.97 1wf8 s ASP 63 Cb 0.00 -1.93 0.02 0.00 1.07 0.00 0.00 42.92 42.08 1wf8 s ASP 63 CO 0.00 -3.72 -0.09 -1.58 1.18 0.00 0.00 175.17 170.96 1wf8 s GLN 64 N -4.80 1.58 -0.78 8.23 0.74 -1.26 -0.67 119.66 122.71 1wf8 s GLN 64 Ca 0.67 -0.31 -0.19 0.00 0.05 0.00 0.00 55.36 55.58 1wf8 s GLN 64 Cb -0.21 -1.52 0.12 0.00 1.10 0.00 0.00 33.01 32.51 1wf8 s GLN 64 CO 0.60 -0.16 0.95 0.42 -0.55 0.00 0.00 175.29 176.55 1wf8 s ILE 65 N 1.33 4.76 0.09 -2.34 1.01 0.24 -2.24 121.20 124.06 1wf8 s ILE 65 Ca -0.02 -1.27 -0.14 0.00 0.00 0.00 0.00 60.65 59.22 1wf8 s ILE 65 Cb -0.14 -4.65 -0.20 0.00 0.01 0.00 0.00 42.46 37.48 1wf8 s ILE 65 CO -0.04 -1.35 1.23 0.58 0.00 0.00 0.00 174.94 175.37 1wf8 h VAL 66 N 5.77 1.28 -3.34 2.92 2.07 -1.61 -3.26 116.25 120.07 1wf8 h VAL 66 Ca -0.06 -2.13 -0.14 0.00 0.82 0.00 0.00 66.70 65.19 1wf8 h VAL 66 Cb 1.05 2.22 -0.21 0.00 -1.52 0.00 0.00 31.29 32.83 1wf8 h VAL 66 CO 1.08 0.67 -0.43 -0.70 0.02 0.00 0.00 177.57 178.21 1wf8 s GLU 67 N -3.49 0.49 -0.22 1.57 2.12 -1.21 -1.43 118.70 116.53 1wf8 s GLU 67 Ca -0.10 -0.23 -0.02 0.00 0.36 0.00 0.00 54.97 54.98 1wf8 s GLU 67 Cb 0.08 0.21 0.07 0.00 0.26 0.00 0.00 34.13 34.74 1wf8 s GLU 67 CO 0.92 -0.12 0.03 0.08 -0.54 0.00 0.00 175.26 175.63 1wf8 s VAL 68 N -1.12 0.72 -0.32 3.70 1.01 0.58 -0.13 120.40 124.84 1wf8 s VAL 68 Ca -0.12 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1wf8 s VAL 68 Cb -0.06 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.09 1wf8 s VAL 68 CO 0.02 -0.26 0.00 0.47 0.00 0.00 0.00 175.10 175.33 1wf8 n ASP 69 N 4.97 -5.39 0.00 3.32 8.00 0.66 -0.28 116.55 127.82 1wf8 n ASP 69 Ca -0.09 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1wf8 n ASP 69 Cb 0.46 -3.16 0.00 0.00 -0.02 0.00 0.00 41.12 38.40 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 0.08 1.42 3.71 0.44 0.00 -1.26 -4.93 105.19 104.66 1wf8 n GLY 70 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.09 5.03 -0.10 -0.61 1.01 0.62 -5.01 121.20 120.05 1wf8 s ILE 71 Ca 0.00 1.50 -0.30 0.00 0.00 0.00 0.00 60.65 61.86 1wf8 s ILE 71 Cb 0.00 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 1wf8 s ILE 71 CO 0.00 0.24 1.26 -0.94 0.00 0.00 0.00 174.94 175.50 1wf8 s SER 72 N 0.83 6.97 0.00 3.58 1.04 -1.26 0.22 113.70 125.07 1wf8 s SER 72 Ca 0.39 1.80 0.17 0.00 0.48 0.00 0.00 55.95 58.79 1wf8 s SER 72 Cb -0.18 -2.55 -0.07 0.00 0.10 0.00 0.00 66.02 63.32 1wf8 s SER 72 CO 0.19 -0.69 0.83 0.18 0.98 0.00 0.00 173.24 174.73 1wf8 n LEU 73 N 5.90 1.37 -4.85 2.42 4.77 -0.52 -4.89 117.00 121.20 1wf8 n LEU 73 Ca 0.13 -0.67 -0.35 0.00 -0.03 0.00 0.00 56.01 55.08 1wf8 n LEU 73 Cb 0.45 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 1wf8 n LEU 73 CO 0.56 0.28 0.13 0.54 -1.33 0.00 0.00 177.39 177.56 1wf8 s VAL 74 N -2.21 5.01 -0.95 4.08 0.11 -1.19 -4.03 120.40 121.22 1wf8 s VAL 74 Ca 0.11 0.63 -0.01 0.00 -2.93 0.00 0.00 61.98 59.79 1wf8 s VAL 74 Cb 0.13 -3.68 0.00 0.00 -1.53 0.00 0.00 36.38 31.30 1wf8 s VAL 74 CO 0.52 0.33 0.08 0.61 -3.33 0.00 0.00 175.10 173.32 1wf8 n GLY 75 N 1.04 -0.07 3.14 6.54 0.00 0.45 -4.86 105.19 111.43 1wf8 n GLY 75 Ca -0.08 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.65 0.70 0.30 1.61 -7.23 -1.20 -4.58 120.40 107.34 1wf8 s VAL 76 Ca 0.04 -1.63 -0.29 0.00 -1.81 0.00 0.00 61.98 58.29 1wf8 s VAL 76 Cb -0.02 -1.31 -0.10 0.00 0.56 0.00 0.00 36.38 35.51 1wf8 s VAL 76 CO 0.05 -0.67 1.28 0.28 -0.31 0.00 0.00 175.10 175.73 1wf8 s THR 77 N -2.76 2.91 0.49 5.32 -1.32 -1.26 -4.62 115.64 114.40 1wf8 s THR 77 Ca 0.04 0.87 0.39 0.00 -1.21 0.00 0.00 61.69 61.79 1wf8 s THR 77 Cb -0.01 -3.56 0.60 0.00 -1.51 0.00 0.00 72.50 68.02 1wf8 s THR 77 CO -0.02 0.19 1.60 -0.61 -2.21 0.00 0.00 174.62 173.57 1wf8 h GLN 78 N 3.88 0.03 0.22 7.08 4.15 -1.95 1.18 115.11 129.70 1wf8 h GLN 78 Ca -0.48 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 58.93 1wf8 h GLN 78 Cb 1.22 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1wf8 h GLN 78 CO 0.68 0.02 -0.10 -0.97 -1.93 0.00 0.00 178.83 176.53 1wf8 h ASN 79 N 0.03 -0.25 -0.11 -0.69 -0.73 -1.98 0.87 115.58 112.72 1wf8 h ASN 79 Ca 0.87 -0.02 0.04 0.00 1.87 0.00 0.00 56.30 59.06 1wf8 h ASN 79 Cb 3.09 0.06 -0.06 0.00 0.27 0.00 0.00 38.32 41.69 1wf8 h ASN 79 CO -0.25 -0.14 -0.30 0.15 -0.37 0.00 0.00 177.43 176.51 1wf8 h PHE 80 N -0.33 -0.84 -0.94 0.67 3.04 0.11 0.47 116.94 119.12 1wf8 h PHE 80 Ca -0.03 0.04 0.09 0.00 3.98 0.00 0.00 57.97 62.05 1wf8 h PHE 80 Cb 0.26 0.38 -0.07 0.00 2.56 0.00 0.00 35.95 39.08 1wf8 h PHE 80 CO -0.05 -0.39 0.58 0.00 -2.02 0.00 0.00 178.31 176.44 1wf8 h ALA 81 N 0.44 1.35 -0.65 2.41 0.00 -1.33 0.30 119.26 121.78 1wf8 h ALA 81 Ca 0.09 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1wf8 h ALA 81 Cb 0.53 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1wf8 h ALA 81 CO -0.33 0.26 0.25 0.00 0.00 0.00 0.00 179.25 179.43 1wf8 h ALA 82 N 1.48 1.22 -0.24 0.00 0.00 0.80 0.52 119.26 123.03 1wf8 h ALA 82 Ca 0.44 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 1wf8 h ALA 82 Cb 0.33 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1wf8 h ALA 82 CO -0.22 0.57 -0.10 1.15 0.00 0.00 0.00 179.25 180.65 1wf8 h THR 83 N 0.94 1.30 0.57 0.00 2.02 0.24 -2.02 112.91 115.96 1wf8 h THR 83 Ca 0.22 -1.15 -0.03 0.00 0.77 0.00 0.00 66.41 66.22 1wf8 h THR 83 Cb 0.19 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 1wf8 h THR 83 CO -0.02 0.36 -0.30 0.58 0.37 0.00 0.00 175.52 176.51 1wf8 h VAL 84 N 0.21 0.38 -0.15 3.16 2.07 -0.16 0.57 116.25 122.33 1wf8 h VAL 84 Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.62 1wf8 h VAL 84 Cb 0.59 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1wf8 h VAL 84 CO 0.03 0.00 0.33 -0.07 0.02 0.00 0.00 177.57 177.88 1wf8 h LEU 85 N -0.80 0.00 0.00 2.57 3.38 -0.93 1.69 115.31 121.22 1wf8 h LEU 85 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1wf8 h LEU 85 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1wf8 h LEU 85 CO 0.11 0.00 -0.55 0.03 0.09 0.00 0.00 178.44 178.11 1wf8 h ARG 86 N 0.00 0.00 0.10 1.13 3.08 -0.32 -3.32 114.38 115.05 1wf8 h ARG 86 Ca 0.07 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.76 1wf8 h ARG 86 Cb 0.72 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.75 1wf8 h ARG 86 CO -0.00 0.00 -2.00 0.09 -1.07 0.00 0.00 179.97 176.99 1wf8 n ASN 87 N -2.24 1.91 -3.87 7.04 3.02 0.55 -4.96 115.26 116.72 1wf8 n ASN 87 Ca 0.03 0.21 -0.35 0.00 -0.03 0.00 0.00 54.58 54.44 1wf8 n ASN 87 Cb 0.45 -0.69 0.04 0.00 -0.61 0.00 0.00 39.78 38.97 1wf8 n ASN 87 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1wf8 n THR 88 N -3.39 0.00 -4.54 3.41 -2.24 0.49 -5.00 114.28 103.00 1wf8 n THR 88 Ca -0.31 -0.48 -0.26 0.00 -2.27 0.00 0.00 64.05 60.72 1wf8 n THR 88 Cb 1.05 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 69.20 1wf8 n THR 88 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1wf8 s LYS 89 N -1.91 1.96 0.00 -0.78 3.01 -1.26 -5.04 119.74 115.73 1wf8 s LYS 89 Ca 0.39 -2.20 0.00 0.00 -1.01 0.00 0.00 55.97 53.15 1wf8 s LYS 89 Cb -0.18 -0.70 0.00 0.00 -1.01 0.00 0.00 37.83 35.94 1wf8 s LYS 89 CO 0.80 -0.47 0.00 0.41 0.51 0.00 0.00 175.35 176.60 1wf8 n GLY 90 N -0.95 0.00 3.69 -3.33 0.00 -1.26 -3.55 105.19 99.80 1wf8 n GLY 90 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 7.22 -0.05 1.61 3.04 -1.25 0.22 114.94 125.72 1wf8 s ASN 91 Ca 0.00 1.63 0.03 0.00 0.04 0.00 0.00 52.86 54.57 1wf8 s ASN 91 Cb 0.00 -2.56 0.00 0.00 -1.54 0.00 0.00 41.25 37.15 1wf8 s ASN 91 CO 0.00 -0.45 -0.15 -0.69 -3.04 0.00 0.00 177.10 172.77 1wf8 s VAL 92 N 1.86 1.28 -0.49 -5.21 1.01 0.54 -4.90 120.40 114.50 1wf8 s VAL 92 Ca 0.51 -0.60 -0.16 0.00 0.00 0.00 0.00 61.98 61.72 1wf8 s VAL 92 Cb -0.21 -1.13 0.08 0.00 0.00 0.00 0.00 36.38 35.13 1wf8 s VAL 92 CO 0.21 0.38 0.45 -0.60 0.00 0.00 0.00 175.10 175.54 1wf8 s ARG 93 N 0.32 3.00 -0.26 2.72 3.52 -1.25 0.72 118.95 127.71 1wf8 s ARG 93 Ca -0.09 -1.38 -0.11 0.00 -0.13 0.00 0.00 55.73 54.03 1wf8 s ARG 93 Cb -0.13 -4.17 -0.05 0.00 -1.56 0.00 0.00 34.95 29.04 1wf8 s ARG 93 CO 0.03 -1.12 0.19 -0.06 -0.81 0.00 0.00 175.30 173.52 1wf8 s PHE 94 N 1.76 3.27 -0.73 5.12 0.08 0.42 0.24 117.98 128.14 1wf8 s PHE 94 Ca 0.05 0.19 -0.16 0.00 0.12 0.00 0.00 56.93 57.13 1wf8 s PHE 94 Cb -0.25 -2.34 0.17 0.00 -0.57 0.00 0.00 43.02 40.03 1wf8 s PHE 94 CO 0.06 -0.06 0.73 0.08 -0.10 0.00 0.00 175.22 175.94 1wf8 s VAL 95 N 1.44 5.30 0.46 -0.44 1.01 0.81 0.18 120.40 129.16 1wf8 s VAL 95 Ca 0.08 -1.91 -0.20 0.00 0.00 0.00 0.00 61.98 59.95 1wf8 s VAL 95 Cb -0.15 -4.48 -0.10 0.00 0.00 0.00 0.00 36.38 31.66 1wf8 s VAL 95 CO 0.08 -1.06 0.97 -0.63 0.00 0.00 0.00 175.10 174.46 1wf8 s ILE 96 N 1.18 4.38 -0.32 2.22 -1.09 -0.75 -1.67 121.20 125.14 1wf8 s ILE 96 Ca 0.15 1.40 0.04 0.00 -2.23 0.00 0.00 60.65 60.00 1wf8 s ILE 96 Cb -0.17 -3.61 0.09 0.00 -1.58 0.00 0.00 42.46 37.19 1wf8 s ILE 96 CO -0.04 -0.40 0.01 -0.83 -1.23 0.00 0.00 174.94 172.45 1wf8 s GLY 97 N -2.38 1.87 0.04 6.18 0.00 -0.95 -1.81 107.32 110.27 1wf8 s GLY 97 Ca 0.62 -2.34 0.01 0.00 0.00 0.00 0.00 44.72 43.00 1wf8 s GLY 97 CO 0.18 0.86 0.11 -1.60 0.00 0.00 0.00 173.10 172.65 1wf8 s ARG 98 N 0.95 3.08 0.02 2.90 6.06 -0.40 -4.52 118.95 127.04 1wf8 s ARG 98 Ca 0.06 -0.55 -0.30 0.00 -2.50 0.00 0.00 55.73 52.43 1wf8 s ARG 98 Cb -0.19 -2.85 -0.06 0.00 0.06 0.00 0.00 34.95 31.90 1wf8 s ARG 98 CO -0.07 0.61 1.47 -1.21 -2.50 0.00 0.00 175.30 173.60 1wf8 s GLU 99 N -2.16 4.26 0.54 5.12 2.02 -1.26 0.18 118.70 127.40 1wf8 s GLU 99 Ca 0.28 2.07 -0.12 0.00 0.02 0.00 0.00 54.97 57.22 1wf8 s GLU 99 Cb -0.12 -3.57 -0.05 0.00 0.10 0.00 0.00 34.13 30.48 1wf8 s GLU 99 CO 0.20 -0.62 0.94 0.15 0.02 0.00 0.00 175.26 175.95 1wf8 s LYS 100 N 2.45 3.72 0.01 1.61 1.02 -1.26 -4.86 119.74 122.44 1wf8 s LYS 100 Ca 0.67 0.69 -0.30 0.00 0.02 0.00 0.00 55.97 57.04 1wf8 s LYS 100 Cb -0.34 -2.19 -0.05 0.00 -0.52 0.00 0.00 37.83 34.74 1wf8 s LYS 100 CO 0.28 -0.35 1.19 -1.25 -0.92 0.00 0.00 175.35 174.30 1wf8 s PRO 101 N -4.58 4.41 -0.55 -1.68 0.04 -1.26 -4.98 135.00 126.40 1wf8 s PRO 101 Ca 0.54 1.71 0.06 0.00 0.04 0.00 0.00 61.00 63.35 1wf8 s PRO 101 Cb -0.10 -3.44 0.21 0.00 0.04 0.00 0.00 34.50 31.20 1wf8 s PRO 101 CO 0.42 -0.32 0.53 0.43 0.04 0.00 0.00 177.00 178.10 1wf8 n SER 102 N 4.44 1.70 0.00 6.66 7.64 -1.26 -5.06 113.62 127.74 1wf8 n SER 102 Ca 0.10 -2.95 0.00 0.00 1.01 0.00 0.00 58.87 57.03 1wf8 n SER 102 Cb 0.47 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 1wf8 n SER 102 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wf8 n GLY 103 N 1.77 3.18 3.80 0.23 0.00 -1.26 -5.09 105.19 107.82 1wf8 n GLY 103 Ca 0.25 -1.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.05 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 -3.21 1.84 -0.26 1.61 0.04 -1.26 -5.09 135.00 128.67 1wf8 s PRO 104 Ca 0.00 0.55 -0.16 0.00 0.04 0.00 0.00 61.00 61.43 1wf8 s PRO 104 Cb 0.00 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.72 1wf8 s PRO 104 CO 0.00 -1.77 0.65 0.45 0.04 0.00 0.00 177.00 176.38 1wf8 s SER 105 N -3.94 -0.88 -0.19 6.66 0.15 -1.26 -5.15 113.70 109.09 1wf8 s SER 105 Ca 0.62 1.43 -0.04 0.00 0.70 0.00 0.00 55.95 58.66 1wf8 s SER 105 Cb -0.14 1.31 -0.02 0.00 -1.71 0.00 0.00 66.02 65.46 1wf8 s SER 105 CO 0.54 -0.23 -0.04 -0.55 1.20 0.00 0.00 173.24 174.15 1wf8 s SER 106 N 1.53 4.44 0.00 5.45 0.15 -1.26 -5.28 113.70 118.73 1wf8 s SER 106 Ca -0.09 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.25 1wf8 s SER 106 Cb -0.05 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 1wf8 s SER 106 CO -0.18 0.05 0.00 0.61 1.20 0.00 0.00 173.24 174.92