#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 6.02 0.11 1.61 0.01 -1.26 -5.10 113.70 115.10 1wf8 s SER 2 Ca 0.00 0.33 -0.16 0.00 1.31 0.00 0.00 55.95 57.43 1wf8 s SER 2 Cb 0.00 -1.86 0.04 0.00 0.21 0.00 0.00 66.02 64.41 1wf8 s SER 2 CO 0.00 0.36 0.41 -0.44 0.41 0.00 0.00 173.24 173.98 1wf8 s SER 3 N -1.24 -0.25 0.00 2.44 0.01 -1.26 -5.10 113.70 108.31 1wf8 s SER 3 Ca 0.18 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1wf8 s SER 3 Cb -0.12 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.58 1wf8 s SER 3 CO 0.07 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 173.51 1wf8 n GLY 4 N -0.12 -1.43 5.08 3.44 0.00 -1.26 -5.06 105.19 105.84 1wf8 n GLY 4 Ca -0.16 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.37 0.00 -4.51 1.61 7.64 -1.26 -4.66 113.62 111.07 1wf8 n SER 5 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.56 1wf8 n SER 5 Cb 0.00 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.05 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 2.37 0.14 -3.71 6.43 3.41 -1.26 -4.81 113.62 116.18 1wf8 n SER 6 Ca 0.00 -0.28 -0.30 0.00 -0.26 0.00 0.00 58.87 58.03 1wf8 n SER 6 Cb 0.00 -0.95 -0.14 0.00 -0.26 0.00 0.00 64.21 62.86 1wf8 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1wf8 s GLY 7 N 6.81 1.47 0.08 5.00 0.00 -1.26 -5.10 107.32 114.33 1wf8 s GLY 7 Ca 1.26 -2.30 0.00 0.00 0.00 0.00 0.00 44.72 43.69 1wf8 s GLY 7 CO 0.45 1.57 0.02 -0.10 0.00 0.00 0.00 173.10 175.04 1wf8 n LEU 8 N 3.96 0.00 -4.24 0.66 7.94 -1.26 -4.54 117.00 119.52 1wf8 n LEU 8 Ca 0.06 -0.59 -0.43 0.00 -1.11 0.00 0.00 56.01 53.94 1wf8 n LEU 8 Cb 0.37 0.15 -0.06 0.00 0.53 0.00 0.00 43.42 44.41 1wf8 n LEU 8 CO 0.20 -0.09 0.17 -0.70 -1.11 0.00 0.00 177.39 175.86 1wf8 s GLU 9 N -2.31 2.94 -0.43 1.96 2.12 0.13 -4.82 118.70 118.29 1wf8 s GLU 9 Ca 0.02 -2.17 -0.19 0.00 0.36 0.00 0.00 54.97 53.00 1wf8 s GLU 9 Cb 0.00 -4.10 0.02 0.00 0.26 0.00 0.00 34.13 30.31 1wf8 s GLU 9 CO 0.02 -1.24 0.53 -0.51 -0.54 0.00 0.00 175.26 173.52 1wf8 s LEU 10 N 0.66 4.69 -0.06 2.70 1.43 -1.25 -1.15 118.68 125.70 1wf8 s LEU 10 Ca 0.12 -0.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1wf8 s LEU 10 Cb -0.20 -2.54 -0.00 0.00 0.03 0.00 0.00 46.19 43.48 1wf8 s LEU 10 CO -0.04 -0.66 -0.18 0.72 0.23 0.00 0.00 176.35 176.42 1wf8 s PHE 11 N 2.44 1.87 0.15 0.29 -0.71 -0.67 -4.96 117.98 116.38 1wf8 s PHE 11 Ca 0.17 -0.60 -0.30 0.00 -1.04 0.00 0.00 56.93 55.16 1wf8 s PHE 11 Cb -0.16 -1.27 -0.07 0.00 -1.21 0.00 0.00 43.02 40.32 1wf8 s PHE 11 CO 0.16 -0.22 1.13 -1.25 -1.34 0.00 0.00 175.22 173.70 1wf8 s PRO 12 N 0.14 4.54 -0.14 1.99 0.04 -1.26 -1.99 135.00 138.32 1wf8 s PRO 12 Ca -0.07 1.74 -0.00 0.00 0.04 0.00 0.00 61.00 62.71 1wf8 s PRO 12 Cb -0.13 -3.29 0.03 0.00 0.04 0.00 0.00 34.50 31.14 1wf8 s PRO 12 CO 0.03 -0.02 -0.09 0.08 0.04 0.00 0.00 177.00 177.04 1wf8 s VAL 13 N 0.11 1.26 0.18 -0.36 1.01 0.53 -4.90 120.40 118.23 1wf8 s VAL 13 Ca 0.52 -0.54 -0.28 0.00 0.00 0.00 0.00 61.98 61.68 1wf8 s VAL 13 Cb -0.29 -1.29 -0.08 0.00 0.00 0.00 0.00 36.38 34.71 1wf8 s VAL 13 CO 0.34 0.32 0.86 -1.61 0.00 0.00 0.00 175.10 175.00 1wf8 s GLU 14 N 1.60 4.69 0.00 2.72 2.02 -1.25 0.13 118.70 128.61 1wf8 s GLU 14 Ca 0.03 1.31 0.00 0.00 0.02 0.00 0.00 54.97 56.34 1wf8 s GLU 14 Cb -0.14 -3.29 -0.00 0.00 0.10 0.00 0.00 34.13 30.81 1wf8 s GLU 14 CO -0.09 0.50 -0.01 -0.51 0.02 0.00 0.00 175.26 175.17 1wf8 s LEU 15 N -0.99 2.01 -0.37 1.80 1.43 0.31 -4.92 118.68 117.95 1wf8 s LEU 15 Ca 0.39 -0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 53.39 1wf8 s LEU 15 Cb -0.24 -0.05 0.06 0.00 0.03 0.00 0.00 46.19 45.99 1wf8 s LEU 15 CO 0.29 0.00 0.16 -1.61 0.23 0.00 0.00 176.35 175.41 1wf8 s GLU 16 N -0.09 2.49 0.83 1.70 2.02 -1.25 0.13 118.70 124.53 1wf8 s GLU 16 Ca -0.00 -1.38 -0.17 0.00 0.02 0.00 0.00 54.97 53.44 1wf8 s GLU 16 Cb -0.01 -3.55 -0.15 0.00 0.10 0.00 0.00 34.13 30.53 1wf8 s GLU 16 CO -0.00 -0.82 -0.58 1.63 0.02 0.00 0.00 175.26 175.51 1wf8 n LYS 17 N 4.79 0.00 -4.49 1.61 5.02 0.52 -4.90 118.16 120.71 1wf8 n LYS 17 Ca -0.10 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.94 1wf8 n LYS 17 Cb 0.43 -0.98 -0.09 0.00 -0.02 0.00 0.00 35.03 34.38 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 -0.98 2.65 0.56 4.39 1.01 0.50 -4.91 116.67 119.89 1wf8 s ASP 18 Ca 0.45 -1.61 0.48 0.00 0.71 0.00 0.00 52.55 52.57 1wf8 s ASP 18 Cb -0.28 0.40 1.66 0.00 1.01 0.00 0.00 42.92 45.72 1wf8 s ASP 18 CO 0.76 -0.87 1.57 1.05 0.21 0.00 0.00 175.17 177.89 1wf8 h GLU 19 N 1.87 0.00 -1.48 8.23 9.09 -1.98 1.50 114.58 131.80 1wf8 h GLU 19 Ca -0.36 0.00 -0.58 0.00 0.05 0.00 0.00 59.36 58.47 1wf8 h GLU 19 Cb 1.27 0.00 -0.42 0.00 -1.65 0.00 0.00 28.75 27.95 1wf8 h GLU 19 CO 0.59 0.00 -0.75 -3.47 0.05 0.00 0.00 179.01 175.43 1wf8 n ASP 20 N -3.89 4.56 0.00 3.06 -0.08 -1.26 -5.08 116.55 113.86 1wf8 n ASP 20 Ca 0.41 -3.67 0.00 0.00 -1.51 0.00 0.00 54.79 50.02 1wf8 n ASP 20 Cb 1.92 -0.46 0.00 0.00 2.34 0.00 0.00 41.12 44.92 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 -0.47 2.37 0.14 0.27 0.00 0.51 -3.54 105.19 104.48 1wf8 n GLY 21 Ca 0.38 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.22 -0.29 0.99 3.38 -1.90 1.46 115.31 118.73 1wf8 h LEU 22 Ca 0.00 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1wf8 h LEU 22 Cb 0.00 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1wf8 h LEU 22 CO 0.00 0.33 0.00 0.61 0.09 0.00 0.00 178.44 179.47 1wf8 n GLY 23 N 0.79 0.53 3.05 0.83 0.00 -1.23 0.11 105.19 109.27 1wf8 n GLY 23 Ca -0.07 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.36 0.13 0.18 -0.61 -4.36 -1.26 -2.36 121.20 111.55 1wf8 s ILE 24 Ca 0.00 -1.04 0.06 0.00 -0.26 0.00 0.00 60.65 59.41 1wf8 s ILE 24 Cb 0.00 -0.63 -0.04 0.00 1.25 0.00 0.00 42.46 43.05 1wf8 s ILE 24 CO 0.00 -0.57 0.11 -0.44 0.24 0.00 0.00 174.94 174.28 1wf8 s SER 25 N -1.82 5.32 0.11 4.36 0.01 0.55 -4.95 113.70 117.28 1wf8 s SER 25 Ca -0.10 -0.22 0.04 0.00 1.31 0.00 0.00 55.95 56.98 1wf8 s SER 25 Cb -0.05 -1.33 -0.04 0.00 0.21 0.00 0.00 66.02 64.82 1wf8 s SER 25 CO -0.03 0.06 -0.10 0.27 0.41 0.00 0.00 173.24 173.86 1wf8 s ILE 26 N -1.80 0.96 0.01 1.44 -4.36 -1.26 -1.94 121.20 114.25 1wf8 s ILE 26 Ca 0.30 -1.78 0.03 0.00 -0.26 0.00 0.00 60.65 58.94 1wf8 s ILE 26 Cb -0.10 -1.52 -0.01 0.00 1.25 0.00 0.00 42.46 42.08 1wf8 s ILE 26 CO 0.22 -0.65 -0.09 -0.51 0.24 0.00 0.00 174.94 174.16 1wf8 s ILE 27 N -2.82 0.67 -0.31 8.37 2.07 0.54 -4.42 121.20 125.30 1wf8 s ILE 27 Ca 0.09 -0.58 -0.14 0.00 -1.41 0.00 0.00 60.65 58.61 1wf8 s ILE 27 Cb -0.00 -0.61 -0.03 0.00 0.13 0.00 0.00 42.46 41.95 1wf8 s ILE 27 CO -0.01 0.03 0.32 -0.83 -1.91 0.00 0.00 174.94 172.55 1wf8 s GLY 28 N -0.61 1.91 0.10 1.50 0.00 -1.26 -1.07 107.32 107.88 1wf8 s GLY 28 Ca 0.00 -1.10 0.03 0.00 0.00 0.00 0.00 44.72 43.66 1wf8 s GLY 28 CO 0.00 0.90 -0.09 1.06 0.00 0.00 0.00 173.10 174.97 1wf8 s MET 29 N 1.95 0.84 -0.51 2.90 -1.94 -0.96 -4.99 119.30 116.60 1wf8 s MET 29 Ca 0.11 -1.19 -0.17 0.00 -1.71 0.00 0.00 55.69 52.74 1wf8 s MET 29 Cb -0.16 -0.46 0.08 0.00 2.01 0.00 0.00 34.83 36.30 1wf8 s MET 29 CO 0.11 0.06 0.52 0.20 -0.01 0.00 0.00 175.02 175.90 1wf8 s GLY 30 N -2.55 1.94 0.17 -0.03 0.00 -1.26 0.21 107.32 105.79 1wf8 s GLY 30 Ca 0.06 -2.07 -0.24 0.00 0.00 0.00 0.00 44.72 42.47 1wf8 s GLY 30 CO -0.01 1.27 0.75 0.14 0.00 0.00 0.00 173.10 175.25 1wf8 s VAL 31 N 2.07 4.44 -0.38 1.40 1.01 -0.23 -4.42 120.40 124.28 1wf8 s VAL 31 Ca 0.08 1.57 -0.29 0.00 0.00 0.00 0.00 61.98 63.34 1wf8 s VAL 31 Cb -0.24 -4.05 0.04 0.00 0.00 0.00 0.00 36.38 32.14 1wf8 s VAL 31 CO 0.08 0.45 0.53 0.61 0.00 0.00 0.00 175.10 176.76 1wf8 n GLY 32 N 1.39 0.06 3.03 4.51 0.00 -1.26 -1.20 105.19 111.71 1wf8 n GLY 32 Ca -0.05 0.90 -0.33 0.00 0.00 0.00 0.00 46.02 46.54 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 -1.29 3.23 -0.04 4.61 0.00 -1.26 -3.58 121.76 123.43 1wf8 s ALA 33 Ca 0.29 -2.95 -0.03 0.00 0.00 0.00 0.00 51.96 49.27 1wf8 s ALA 33 Cb -0.03 -2.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.81 1wf8 s ALA 33 CO 0.70 -1.91 0.19 0.22 0.00 0.00 0.00 175.76 174.96 1wf8 h ASP 34 N 7.18 -0.10 0.00 0.00 1.82 -1.91 -3.47 116.42 119.94 1wf8 h ASP 34 Ca -0.06 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.57 1wf8 h ASP 34 Cb 0.97 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.99 1wf8 h ASP 34 CO 0.65 0.18 -0.02 0.00 -1.61 0.00 0.00 179.24 178.44 1wf8 n ALA 35 N -2.44 -1.52 0.00 -0.78 0.00 -1.26 -4.96 120.51 109.55 1wf8 n ALA 35 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1wf8 n ALA 35 Cb 0.04 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.07 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 -0.06 0.34 2.20 0.00 0.00 -1.26 -4.98 105.19 101.43 1wf8 n GLY 36 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1wf8 n GLY 36 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wf8 n LEU 37 N 0.00 7.12 -4.70 0.99 -0.00 -1.26 -4.96 117.00 114.20 1wf8 n LEU 37 Ca 0.00 -3.87 -0.42 0.00 -0.00 0.00 0.00 56.01 51.71 1wf8 n LEU 37 Cb 0.00 -0.93 -0.03 0.00 -0.00 0.00 0.00 43.42 42.46 1wf8 n LEU 37 CO 0.00 1.29 0.86 -1.83 -0.00 0.00 0.00 177.39 177.71 1wf8 s GLU 38 N -3.29 4.42 -0.39 1.47 -1.05 -1.24 -4.42 118.70 114.20 1wf8 s GLU 38 Ca 0.56 1.61 0.03 0.00 -0.15 0.00 0.00 54.97 57.02 1wf8 s GLU 38 Cb 0.45 -3.48 0.11 0.00 -0.44 0.00 0.00 34.13 30.77 1wf8 s GLU 38 CO 0.03 -0.30 0.12 0.15 0.95 0.00 0.00 175.26 176.20 1wf8 s LYS 39 N 1.66 1.53 0.16 -4.83 -0.14 -0.34 -4.89 119.74 112.89 1wf8 s LYS 39 Ca 0.55 -2.01 -0.34 0.00 -1.36 0.00 0.00 55.97 52.81 1wf8 s LYS 39 Cb -0.24 -3.09 -0.14 0.00 -1.68 0.00 0.00 37.83 32.68 1wf8 s LYS 39 CO 0.24 -1.00 1.47 -0.11 -0.76 0.00 0.00 175.35 175.20 1wf8 n LEU 40 N 3.97 2.72 -4.26 3.17 -0.00 -1.26 -1.07 117.00 120.27 1wf8 n LEU 40 Ca 0.04 1.11 -0.34 0.00 -0.00 0.00 0.00 56.01 56.81 1wf8 n LEU 40 Cb 0.39 -1.37 -0.15 0.00 -0.00 0.00 0.00 43.42 42.30 1wf8 n LEU 40 CO 0.24 -0.54 -0.43 -0.83 -0.00 0.00 0.00 177.39 175.84 1wf8 s GLY 41 N 0.65 1.54 -0.72 -3.96 0.00 0.56 -0.53 107.32 104.86 1wf8 s GLY 41 Ca 0.78 -1.17 -0.24 0.00 0.00 0.00 0.00 44.72 44.08 1wf8 s GLY 41 CO 0.43 0.36 1.13 -0.42 0.00 0.00 0.00 173.10 174.60 1wf8 s ILE 42 N 1.39 4.05 0.32 0.90 -1.09 -1.25 -2.25 121.20 123.25 1wf8 s ILE 42 Ca 0.05 -0.06 0.06 0.00 -2.23 0.00 0.00 60.65 58.46 1wf8 s ILE 42 Cb -0.14 -4.81 -0.01 0.00 -1.58 0.00 0.00 42.46 35.92 1wf8 s ILE 42 CO -0.06 -1.66 0.46 -0.36 -1.23 0.00 0.00 174.94 172.09 1wf8 s PHE 43 N 4.82 3.20 -0.43 3.97 0.08 -0.23 -1.27 117.98 128.12 1wf8 s PHE 43 Ca 0.29 -0.14 -0.22 0.00 0.12 0.00 0.00 56.93 56.98 1wf8 s PHE 43 Cb -0.12 -1.91 0.02 0.00 -0.57 0.00 0.00 43.02 40.44 1wf8 s PHE 43 CO 0.11 0.08 0.70 0.08 -0.10 0.00 0.00 175.22 176.09 1wf8 s VAL 44 N -2.15 4.76 0.15 -0.44 1.01 0.98 0.20 120.40 124.91 1wf8 s VAL 44 Ca 0.43 0.29 -0.16 0.00 0.00 0.00 0.00 61.98 62.53 1wf8 s VAL 44 Cb -0.09 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.06 1wf8 s VAL 44 CO 0.31 -0.62 1.77 0.50 0.00 0.00 0.00 175.10 177.06 1wf8 h LYS 45 N 8.88 0.56 -2.06 2.72 1.63 -1.60 1.28 116.57 127.97 1wf8 h LYS 45 Ca -0.25 -0.05 0.23 0.00 -0.85 0.00 0.00 60.65 59.73 1wf8 h LYS 45 Cb 1.09 -0.12 -0.09 0.00 -0.60 0.00 0.00 32.23 32.52 1wf8 h LYS 45 CO 0.91 0.43 0.63 -0.08 -3.45 0.00 0.00 179.45 177.89 1wf8 s THR 46 N -5.96 0.00 -0.14 1.00 -1.32 -1.25 -4.50 115.64 103.48 1wf8 s THR 46 Ca -0.13 -0.49 0.01 0.00 -1.21 0.00 0.00 61.69 59.87 1wf8 s THR 46 Cb 0.11 -2.16 0.02 0.00 -1.51 0.00 0.00 72.50 68.95 1wf8 s THR 46 CO 0.73 0.00 -0.16 -0.69 -2.21 0.00 0.00 174.62 172.29 1wf8 s VAL 47 N -2.80 1.67 0.27 5.08 1.01 -1.26 -0.33 120.40 124.04 1wf8 s VAL 47 Ca 0.15 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 1wf8 s VAL 47 Cb 0.01 -1.53 -0.14 0.00 0.00 0.00 0.00 36.38 34.71 1wf8 s VAL 47 CO 0.01 0.48 1.18 0.41 0.00 0.00 0.00 175.10 177.17 1wf8 n THR 48 N 4.47 1.55 -2.05 3.92 -1.04 -0.99 -4.80 114.28 115.34 1wf8 n THR 48 Ca -0.18 -0.39 -0.32 0.00 -2.04 0.00 0.00 64.05 61.12 1wf8 n THR 48 Cb 0.51 -1.19 -0.04 0.00 -1.82 0.00 0.00 70.33 67.79 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 -1.13 2.59 0.00 -2.82 2.12 -1.26 -2.26 118.70 115.94 1wf8 s GLU 49 Ca 0.63 0.09 0.00 0.00 0.36 0.00 0.00 54.97 56.05 1wf8 s GLU 49 Cb -0.69 -4.78 0.00 0.00 0.26 0.00 0.00 34.13 28.92 1wf8 s GLU 49 CO 0.57 -3.10 0.00 0.41 -0.54 0.00 0.00 175.26 172.59 1wf8 n GLY 50 N 6.36 0.97 0.79 -1.50 0.00 -1.26 -5.12 105.19 105.42 1wf8 n GLY 50 Ca 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.30 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 0.00 2.02 0.13 -0.02 0.00 -0.96 -4.88 105.19 101.48 1wf8 n GLY 51 Ca 0.00 -2.15 -0.17 0.00 0.00 0.00 0.00 46.02 43.70 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 0.45 0.08 -0.07 4.61 0.00 0.58 -0.87 119.26 124.03 1wf8 h ALA 52 Ca -0.06 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.22 1wf8 h ALA 52 Cb 0.25 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wf8 h ALA 52 CO 0.08 0.28 -0.44 0.00 0.00 0.00 0.00 179.25 179.17 1wf8 h ALA 53 N 0.33 1.12 0.23 0.00 0.00 -1.80 -2.70 119.26 116.44 1wf8 h ALA 53 Ca -0.06 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1wf8 h ALA 53 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1wf8 h ALA 53 CO 0.10 0.60 -0.11 0.37 0.00 0.00 0.00 179.25 180.21 1wf8 h GLN 54 N 0.14 -0.29 -0.99 0.00 -0.00 -1.82 -2.96 115.11 109.20 1wf8 h GLN 54 Ca 0.01 0.02 0.32 0.00 -0.00 0.00 0.00 58.65 59.00 1wf8 h GLN 54 Cb 0.84 0.07 -0.18 0.00 0.00 0.00 0.00 27.48 28.21 1wf8 h GLN 54 CO 0.07 -0.20 0.23 0.00 0.00 0.00 0.00 178.83 178.93 1wf8 h ARG 55 N -0.51 0.02 -0.05 1.69 3.08 -1.22 0.64 114.38 118.04 1wf8 h ARG 55 Ca -0.03 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.05 1wf8 h ARG 55 Cb 0.23 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.22 1wf8 h ARG 55 CO 0.05 0.02 -0.36 0.22 -1.07 0.00 0.00 179.97 178.83 1wf8 h ASP 56 N 0.02 -1.09 0.00 7.04 3.58 -1.51 -3.46 116.42 121.01 1wf8 h ASP 56 Ca 0.69 0.14 0.00 0.00 0.42 0.00 0.00 57.03 58.28 1wf8 h ASP 56 Cb 1.59 0.44 0.00 0.00 1.72 0.00 0.00 39.33 43.09 1wf8 h ASP 56 CO -0.85 -0.40 0.00 0.61 -2.88 0.00 0.00 179.24 175.72 1wf8 n GLY 57 N -1.43 0.76 0.03 -0.78 0.00 0.22 -4.94 105.19 99.05 1wf8 n GLY 57 Ca -0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 4.02 0.00 -6.36 1.61 2.47 -1.82 -3.45 114.38 110.85 1wf8 h ARG 58 Ca 0.00 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 58.18 1wf8 h ARG 58 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1wf8 h ARG 58 CO 0.00 0.00 0.96 0.42 0.56 0.00 0.00 179.97 181.91 1wf8 s ILE 59 N -1.33 3.47 0.49 2.04 1.01 -1.26 -5.00 121.20 120.62 1wf8 s ILE 59 Ca -0.01 0.80 0.05 0.00 0.00 0.00 0.00 60.65 61.49 1wf8 s ILE 59 Cb 0.00 -3.52 -0.00 0.00 0.01 0.00 0.00 42.46 38.95 1wf8 s ILE 59 CO 0.02 -0.02 0.25 -1.10 0.00 0.00 0.00 174.94 174.09 1wf8 s GLN 60 N 2.95 2.25 0.41 2.79 -1.52 -1.26 -4.65 119.66 120.63 1wf8 s GLN 60 Ca 0.69 -2.01 -0.22 0.00 -1.95 0.00 0.00 55.36 51.87 1wf8 s GLN 60 Cb -0.34 -1.97 -0.10 0.00 -0.22 0.00 0.00 33.01 30.38 1wf8 s GLN 60 CO 0.29 -0.38 0.98 0.08 -0.25 0.00 0.00 175.29 176.01 1wf8 s VAL 61 N -2.72 4.12 0.00 1.09 1.01 -1.26 -2.98 120.40 119.66 1wf8 s VAL 61 Ca 0.32 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.75 1wf8 s VAL 61 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.72 1wf8 s VAL 61 CO 0.19 -0.16 0.00 0.59 0.00 0.00 0.00 175.10 175.72 1wf8 n ASN 62 N -0.37 -0.06 -4.37 3.32 3.02 0.44 -4.94 115.26 112.31 1wf8 n ASN 62 Ca 0.06 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.33 1wf8 n ASN 62 Cb 0.52 -0.36 0.26 0.00 -0.61 0.00 0.00 39.78 39.59 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 -2.85 0.70 -0.21 6.41 1.11 -1.16 -4.46 116.67 116.22 1wf8 s ASP 63 Ca 0.00 1.37 -0.01 0.00 0.18 0.00 0.00 52.55 54.09 1wf8 s ASP 63 Cb 0.00 -2.11 0.06 0.00 1.07 0.00 0.00 42.92 41.94 1wf8 s ASP 63 CO 0.00 -4.35 -0.02 -1.58 1.18 0.00 0.00 175.17 170.40 1wf8 s GLN 64 N -4.57 1.23 -1.06 8.23 0.74 -1.26 -0.02 119.66 122.95 1wf8 s GLN 64 Ca 0.68 -0.70 -0.22 0.00 0.05 0.00 0.00 55.36 55.18 1wf8 s GLN 64 Cb -0.23 -2.32 0.06 0.00 1.10 0.00 0.00 33.01 31.63 1wf8 s GLN 64 CO 0.64 -0.59 1.47 0.42 -0.55 0.00 0.00 175.29 176.68 1wf8 s ILE 65 N 1.60 4.05 0.21 -2.34 1.01 -0.39 -1.95 121.20 123.39 1wf8 s ILE 65 Ca -0.03 -1.07 -0.08 0.00 0.00 0.00 0.00 60.65 59.47 1wf8 s ILE 65 Cb -0.18 -5.06 0.13 0.00 0.01 0.00 0.00 42.46 37.37 1wf8 s ILE 65 CO -0.07 -1.91 1.74 0.58 0.00 0.00 0.00 174.94 175.28 1wf8 h VAL 66 N 6.46 1.26 -3.95 2.92 2.07 -1.42 -3.38 116.25 120.21 1wf8 h VAL 66 Ca 0.24 -0.93 -0.11 0.00 0.82 0.00 0.00 66.70 66.73 1wf8 h VAL 66 Cb 0.98 0.46 -0.15 0.00 -1.52 0.00 0.00 31.29 31.06 1wf8 h VAL 66 CO 1.40 0.36 -0.51 -0.70 0.02 0.00 0.00 177.57 178.14 1wf8 s GLU 67 N -5.38 0.70 -0.10 1.57 2.12 -1.16 -0.91 118.70 115.54 1wf8 s GLU 67 Ca -0.12 -0.99 -0.04 0.00 0.36 0.00 0.00 54.97 54.18 1wf8 s GLU 67 Cb 0.15 0.27 0.05 0.00 0.26 0.00 0.00 34.13 34.86 1wf8 s GLU 67 CO 0.84 -0.18 0.17 0.08 -0.54 0.00 0.00 175.26 175.63 1wf8 s VAL 68 N -3.55 -0.27 -1.33 3.70 1.01 0.57 -0.90 120.40 119.62 1wf8 s VAL 68 Ca 0.03 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1wf8 s VAL 68 Cb 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 36.38 36.06 1wf8 s VAL 68 CO -0.09 0.09 0.00 0.47 0.00 0.00 0.00 175.10 175.57 1wf8 n ASP 69 N 5.33 -3.46 0.00 3.32 9.92 0.58 0.16 116.55 132.40 1wf8 n ASP 69 Ca -0.05 0.30 0.00 0.00 -0.53 0.00 0.00 54.79 54.51 1wf8 n ASP 69 Cb 0.50 -3.20 0.00 0.00 -0.64 0.00 0.00 41.12 37.77 1wf8 n ASP 69 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1wf8 n GLY 70 N -0.31 2.21 3.75 0.44 0.00 -1.26 -4.90 105.19 105.12 1wf8 n GLY 70 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.29 2.75 -0.20 -0.61 1.01 0.44 -4.98 121.20 117.31 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 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 1wf8 s ILE 71 CO 0.00 0.12 0.49 -0.55 0.00 0.00 0.00 174.94 175.00 1wf8 s SER 72 N 0.11 6.52 -0.57 3.58 0.15 -1.26 0.21 113.70 122.43 1wf8 s SER 72 Ca 0.56 0.62 0.01 0.00 0.70 0.00 0.00 55.95 57.84 1wf8 s SER 72 Cb -0.40 -2.28 0.43 0.00 -1.71 0.00 0.00 66.02 62.06 1wf8 s SER 72 CO 0.46 -0.16 1.69 0.18 1.20 0.00 0.00 173.24 176.60 1wf8 n LEU 73 N 4.76 6.54 -4.54 3.45 4.77 -0.09 -4.96 117.00 126.95 1wf8 n LEU 73 Ca -0.06 -4.65 -0.33 0.00 -0.03 0.00 0.00 56.01 50.94 1wf8 n LEU 73 Cb 0.51 -0.76 -0.12 0.00 -2.33 0.00 0.00 43.42 40.72 1wf8 n LEU 73 CO 0.41 1.80 -0.41 -0.69 -1.33 0.00 0.00 177.39 177.18 1wf8 s VAL 74 N -4.91 3.46 -1.49 4.08 1.01 -1.26 -3.86 120.40 117.42 1wf8 s VAL 74 Ca 0.56 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 1wf8 s VAL 74 Cb 0.45 -2.40 0.07 0.00 0.00 0.00 0.00 36.38 34.51 1wf8 s VAL 74 CO -0.10 0.59 0.94 0.61 0.00 0.00 0.00 175.10 177.14 1wf8 n GLY 75 N 2.32 -0.46 3.06 4.51 0.00 0.31 -4.89 105.19 110.04 1wf8 n GLY 75 Ca -0.18 0.19 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.37 0.70 0.34 1.61 -7.23 -1.24 -4.65 120.40 106.57 1wf8 s VAL 76 Ca 0.55 -0.77 -0.28 0.00 -1.81 0.00 0.00 61.98 59.67 1wf8 s VAL 76 Cb -0.27 -0.67 -0.10 0.00 0.56 0.00 0.00 36.38 35.90 1wf8 s VAL 76 CO 0.83 -0.08 1.26 0.28 -0.31 0.00 0.00 175.10 177.07 1wf8 s THR 77 N -0.78 2.86 0.28 5.32 -1.32 -1.26 -4.65 115.64 116.09 1wf8 s THR 77 Ca -0.02 0.84 0.06 0.00 -1.21 0.00 0.00 61.69 61.36 1wf8 s THR 77 Cb -0.07 -3.52 0.35 0.00 -1.51 0.00 0.00 72.50 67.75 1wf8 s THR 77 CO 0.00 0.18 1.35 1.67 -2.21 0.00 0.00 174.62 175.61 1wf8 n GLN 78 N 0.67 -0.06 -0.25 7.08 7.27 -1.26 0.13 117.38 130.95 1wf8 n GLN 78 Ca 0.01 1.27 -0.06 0.00 0.07 0.00 0.00 57.00 58.28 1wf8 n GLN 78 Cb 0.43 -2.07 -0.01 0.00 2.41 0.00 0.00 30.24 31.00 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 -1.40 -0.18 1.69 4.21 -1.98 0.75 115.58 118.66 1wf8 h ASN 79 Ca 0.57 0.25 0.05 0.00 1.21 0.00 0.00 56.30 58.39 1wf8 h ASN 79 Cb 1.28 0.67 -0.07 0.00 -1.12 0.00 0.00 38.32 39.08 1wf8 h ASN 79 CO -0.78 -0.31 -0.39 0.15 -1.29 0.00 0.00 177.43 174.81 1wf8 h PHE 80 N -0.16 -1.11 -0.46 1.19 3.57 0.66 0.78 116.94 121.41 1wf8 h PHE 80 Ca 0.23 0.05 0.07 0.00 3.53 0.00 0.00 57.97 61.84 1wf8 h PHE 80 Cb 0.56 0.51 -0.06 0.00 2.79 0.00 0.00 35.95 39.75 1wf8 h PHE 80 CO -0.73 -0.45 0.12 0.00 -2.23 0.00 0.00 178.31 175.02 1wf8 h ALA 81 N 0.28 0.53 -0.83 2.41 0.00 -0.87 0.33 119.26 121.11 1wf8 h ALA 81 Ca 0.10 0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.25 1wf8 h ALA 81 Cb 0.60 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.37 1wf8 h ALA 81 CO -0.42 -0.28 0.37 0.00 0.00 0.00 0.00 179.25 178.92 1wf8 h ALA 82 N 1.33 1.24 -0.04 0.00 0.00 0.17 0.35 119.26 122.32 1wf8 h ALA 82 Ca 0.22 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1wf8 h ALA 82 Cb 0.27 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1wf8 h ALA 82 CO -0.27 -0.22 0.01 1.15 0.00 0.00 0.00 179.25 179.93 1wf8 h THR 83 N 0.48 1.18 0.21 0.00 2.02 0.10 -1.47 112.91 115.43 1wf8 h THR 83 Ca 0.48 -0.55 0.01 0.00 0.77 0.00 0.00 66.41 67.11 1wf8 h THR 83 Cb 0.77 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.63 1wf8 h THR 83 CO -0.44 0.15 -0.39 0.58 0.37 0.00 0.00 175.52 175.80 1wf8 h VAL 84 N -0.15 0.21 -0.60 3.16 2.07 0.77 0.78 116.25 122.48 1wf8 h VAL 84 Ca 0.01 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.71 1wf8 h VAL 84 Cb 0.23 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1wf8 h VAL 84 CO 0.00 0.00 0.50 -0.07 0.02 0.00 0.00 177.57 178.02 1wf8 h LEU 85 N -0.68 0.00 0.00 2.57 3.38 -0.37 1.35 115.31 121.56 1wf8 h LEU 85 Ca 0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1wf8 h LEU 85 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1wf8 h LEU 85 CO -0.17 0.00 -0.59 0.03 0.09 0.00 0.00 178.44 177.79 1wf8 h ARG 86 N 0.00 0.00 0.09 1.13 3.08 0.46 -3.32 114.38 115.82 1wf8 h ARG 86 Ca 0.29 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.20 1wf8 h ARG 86 Cb 1.29 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.36 1wf8 h ARG 86 CO -0.00 0.19 -0.60 -0.91 -1.07 0.00 0.00 179.97 177.58 1wf8 h ASN 87 N 0.00 0.36 -1.81 7.04 2.35 0.79 -3.47 115.58 120.85 1wf8 h ASN 87 Ca -0.03 -0.94 -0.52 0.00 -0.55 0.00 0.00 56.30 54.27 1wf8 h ASN 87 Cb 1.20 -0.12 0.19 0.00 0.05 0.00 0.00 38.32 39.65 1wf8 h ASN 87 CO 0.03 1.27 -1.40 0.35 -1.65 0.00 0.00 177.43 176.03 1wf8 n THR 88 N -4.25 0.00 -4.02 2.81 -2.24 0.73 -4.99 114.28 102.31 1wf8 n THR 88 Ca -0.13 -0.45 -0.01 0.00 -2.27 0.00 0.00 64.05 61.19 1wf8 n THR 88 Cb 0.72 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.95 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 1.86 1.11 0.00 -0.78 5.02 -1.26 -5.02 118.16 119.09 1wf8 n LYS 89 Ca 0.02 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1wf8 n LYS 89 Cb 0.47 0.08 0.00 0.00 -0.02 0.00 0.00 35.03 35.56 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 2.68 0.00 3.75 0.72 0.00 -1.26 -3.90 105.19 107.18 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 7.57 -0.03 1.61 3.84 -1.25 0.20 114.94 126.87 1wf8 s ASN 91 Ca 0.00 1.86 -0.01 0.00 0.21 0.00 0.00 52.86 54.92 1wf8 s ASN 91 Cb 0.00 -2.58 0.02 0.00 -0.55 0.00 0.00 41.25 38.14 1wf8 s ASN 91 CO 0.00 0.13 0.06 -0.69 -2.79 0.00 0.00 177.10 173.81 1wf8 s VAL 92 N -0.95 -0.04 -0.46 -5.21 1.01 0.35 -4.92 120.40 110.18 1wf8 s VAL 92 Ca 0.41 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.42 1wf8 s VAL 92 Cb -0.25 -0.12 0.09 0.00 0.00 0.00 0.00 36.38 36.11 1wf8 s VAL 92 CO 0.30 0.06 0.34 -0.60 0.00 0.00 0.00 175.10 175.20 1wf8 s ARG 93 N 0.80 2.71 -0.26 2.72 3.52 -1.26 0.12 118.95 127.30 1wf8 s ARG 93 Ca -0.06 -1.52 -0.11 0.00 -0.13 0.00 0.00 55.73 53.90 1wf8 s ARG 93 Cb -0.09 -3.95 -0.05 0.00 -1.56 0.00 0.00 34.95 29.30 1wf8 s ARG 93 CO -0.03 -1.06 0.21 -0.06 -0.81 0.00 0.00 175.30 173.55 1wf8 s PHE 94 N 1.48 3.26 -0.74 5.12 0.08 0.36 0.21 117.98 127.76 1wf8 s PHE 94 Ca 0.04 0.20 -0.14 0.00 0.12 0.00 0.00 56.93 57.15 1wf8 s PHE 94 Cb -0.25 -2.37 0.19 0.00 -0.57 0.00 0.00 43.02 40.02 1wf8 s PHE 94 CO 0.03 -0.09 0.67 0.08 -0.10 0.00 0.00 175.22 175.81 1wf8 s VAL 95 N 1.56 5.35 0.56 -0.44 1.01 -0.08 0.20 120.40 128.55 1wf8 s VAL 95 Ca 0.08 -2.26 -0.14 0.00 0.00 0.00 0.00 61.98 59.67 1wf8 s VAL 95 Cb -0.15 -4.35 -0.06 0.00 0.00 0.00 0.00 36.38 31.82 1wf8 s VAL 95 CO 0.09 -0.97 1.00 -0.63 0.00 0.00 0.00 175.10 174.58 1wf8 s ILE 96 N 0.51 4.63 -0.16 2.22 -1.09 -0.84 -1.15 121.20 125.32 1wf8 s ILE 96 Ca 0.14 1.03 0.01 0.00 -2.23 0.00 0.00 60.65 59.60 1wf8 s ILE 96 Cb -0.16 -3.79 0.02 0.00 -1.58 0.00 0.00 42.46 36.95 1wf8 s ILE 96 CO -0.06 -0.90 -0.19 -0.83 -1.23 0.00 0.00 174.94 171.73 1wf8 s GLY 97 N -3.59 1.32 0.03 6.18 0.00 -0.82 -1.68 107.32 108.75 1wf8 s GLY 97 Ca 0.57 -1.10 0.06 0.00 0.00 0.00 0.00 44.72 44.25 1wf8 s GLY 97 CO 0.42 0.23 -0.17 -1.60 0.00 0.00 0.00 173.10 171.98 1wf8 s ARG 98 N 1.17 2.16 -0.27 2.90 6.06 -0.30 -4.43 118.95 126.23 1wf8 s ARG 98 Ca 0.01 -0.93 -0.28 0.00 -2.50 0.00 0.00 55.73 52.03 1wf8 s ARG 98 Cb -0.14 -2.23 -0.04 0.00 0.06 0.00 0.00 34.95 32.60 1wf8 s ARG 98 CO -0.09 0.56 2.14 -1.21 -2.50 0.00 0.00 175.30 174.20 1wf8 s GLU 99 N -1.33 3.07 0.76 5.12 2.02 -1.26 0.17 118.70 127.24 1wf8 s GLU 99 Ca 0.14 1.82 -0.12 0.00 0.02 0.00 0.00 54.97 56.84 1wf8 s GLU 99 Cb -0.11 -4.36 0.05 0.00 0.10 0.00 0.00 34.13 29.82 1wf8 s GLU 99 CO 0.05 -2.18 1.12 0.15 0.02 0.00 0.00 175.26 174.42 1wf8 s LYS 100 N 6.39 2.21 1.12 1.61 1.02 -1.26 -4.90 119.74 125.93 1wf8 s LYS 100 Ca 0.95 1.35 -0.19 0.00 0.02 0.00 0.00 55.97 58.11 1wf8 s LYS 100 Cb -0.29 -1.88 0.27 0.00 -0.52 0.00 0.00 37.83 35.41 1wf8 s LYS 100 CO 0.34 -1.70 1.24 -1.25 -0.92 0.00 0.00 175.35 173.05 1wf8 s PRO 101 N -4.54 -0.61 -0.47 -1.68 0.04 -1.26 -5.03 135.00 121.45 1wf8 s PRO 101 Ca 0.65 -0.38 0.03 0.00 0.04 0.00 0.00 61.00 61.35 1wf8 s PRO 101 Cb -0.20 -1.70 0.21 0.00 0.04 0.00 0.00 34.50 32.85 1wf8 s PRO 101 CO 0.51 -3.26 0.87 0.45 0.04 0.00 0.00 177.00 175.62 1wf8 n SER 102 N -4.37 -2.81 0.00 6.66 2.88 -1.26 -5.14 113.62 109.58 1wf8 n SER 102 Ca 0.16 -2.54 0.00 0.00 -1.33 0.00 0.00 58.87 55.17 1wf8 n SER 102 Cb 0.59 1.50 0.00 0.00 -0.75 0.00 0.00 64.21 65.56 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 2.51 2.81 3.80 0.46 0.00 -1.26 -5.08 105.19 108.43 1wf8 n GLY 103 Ca 0.14 -1.93 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 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 -3.07 1.83 0.00 1.61 0.04 -1.26 -5.08 135.00 129.07 1wf8 s PRO 104 Ca 0.00 0.54 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1wf8 s PRO 104 Cb 0.00 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1wf8 s PRO 104 CO 0.00 -1.78 0.00 0.43 0.04 0.00 0.00 177.00 175.69 1wf8 n SER 105 N -3.52 0.00 -4.89 6.66 7.64 -1.26 -5.17 113.62 113.09 1wf8 n SER 105 Ca 0.07 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.63 1wf8 n SER 105 Cb 0.57 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.72 1wf8 n SER 105 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wf8 s SER 106 N 0.00 6.22 0.00 6.43 0.15 -1.26 -5.25 113.70 119.98 1wf8 s SER 106 Ca 0.00 0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.91 1wf8 s SER 106 Cb 0.00 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.41 1wf8 s SER 106 CO 0.00 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.27