#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wf9 n SER 2 N 0.00 -6.22 -4.61 1.61 7.64 -1.26 -4.83 113.62 105.94 1wf9 n SER 2 Ca 0.00 0.94 -0.43 0.00 1.01 0.00 0.00 58.87 60.39 1wf9 n SER 2 Cb 0.00 -3.12 -0.03 0.00 -1.01 0.00 0.00 64.21 60.05 1wf9 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wf9 s SER 3 N -0.90 6.75 -0.30 6.43 0.15 -1.26 -4.95 113.70 119.63 1wf9 s SER 3 Ca -0.05 0.71 -0.06 0.00 0.70 0.00 0.00 55.95 57.26 1wf9 s SER 3 Cb 0.00 -2.50 0.19 0.00 -1.71 0.00 0.00 66.02 62.00 1wf9 s SER 3 CO 0.33 -0.92 0.86 -0.83 1.20 0.00 0.00 173.24 173.88 1wf9 s GLY 4 N 1.89 -0.85 -0.00 9.45 0.00 -1.26 -5.14 107.32 111.41 1wf9 s GLY 4 Ca 0.42 2.02 -0.30 0.00 0.00 0.00 0.00 44.72 46.85 1wf9 s GLY 4 CO 0.19 3.79 1.15 -1.35 0.00 0.00 0.00 173.10 176.89 1wf9 s SER 5 N 2.91 7.13 0.03 1.64 1.04 -1.26 -4.96 113.70 120.23 1wf9 s SER 5 Ca 0.14 1.85 -0.30 0.00 0.48 0.00 0.00 55.95 58.11 1wf9 s SER 5 Cb -0.09 -2.57 -0.17 0.00 0.10 0.00 0.00 66.02 63.30 1wf9 s SER 5 CO -0.20 -0.47 1.27 0.28 0.98 0.00 0.00 173.24 175.10 1wf9 h SER 6 N 7.07 -0.93 0.00 7.02 0.02 -2.02 -3.49 113.55 121.22 1wf9 h SER 6 Ca -0.38 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1wf9 h SER 6 Cb 1.19 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1wf9 h SER 6 CO 0.83 -0.58 0.00 0.61 -1.14 0.00 0.00 176.83 176.55 1wf9 n GLY 7 N -1.04 1.28 3.14 -3.77 0.00 -1.26 -5.12 105.19 98.42 1wf9 n GLY 7 Ca -0.14 0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1wf9 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wf9 s THR 8 N 1.90 2.63 -0.15 2.61 2.01 -1.26 -5.03 115.64 118.35 1wf9 s THR 8 Ca 0.00 -1.38 -0.04 0.00 0.31 0.00 0.00 61.69 60.58 1wf9 s THR 8 Cb 0.00 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 70.01 1wf9 s THR 8 CO 0.00 0.02 -0.00 -0.32 -0.69 0.00 0.00 174.62 173.63 1wf9 s MET 9 N 1.22 3.63 -0.20 4.92 1.75 -1.26 -0.06 119.30 129.29 1wf9 s MET 9 Ca -0.05 -0.45 -0.04 0.00 -1.25 0.00 0.00 55.69 53.90 1wf9 s MET 9 Cb -0.19 -2.98 -0.02 0.00 2.84 0.00 0.00 34.83 34.48 1wf9 s MET 9 CO -0.04 0.34 -0.02 -0.51 -0.65 0.00 0.00 175.02 174.14 1wf9 s LEU 10 N 0.12 3.11 -0.64 4.11 2.01 0.13 -3.47 118.68 124.05 1wf9 s LEU 10 Ca 0.01 -0.27 -0.25 0.00 0.01 0.00 0.00 54.13 53.64 1wf9 s LEU 10 Cb -0.13 -1.78 0.05 0.00 0.01 0.00 0.00 46.19 44.33 1wf9 s LEU 10 CO 0.02 0.04 1.05 -0.13 1.01 0.00 0.00 176.35 178.35 1wf9 s ARG 11 N 1.11 3.24 0.25 1.70 0.52 -1.24 -1.42 118.95 123.11 1wf9 s ARG 11 Ca 0.02 -0.40 -0.02 0.00 -0.52 0.00 0.00 55.73 54.80 1wf9 s ARG 11 Cb -0.14 -4.14 -0.04 0.00 0.52 0.00 0.00 34.95 31.14 1wf9 s ARG 11 CO 0.01 -1.78 0.48 0.14 0.02 0.00 0.00 175.30 174.17 1wf9 s VAL 12 N 4.51 5.12 -0.13 3.52 -7.23 0.43 -2.11 120.40 124.51 1wf9 s VAL 12 Ca 0.30 -0.22 0.02 0.00 -1.81 0.00 0.00 61.98 60.28 1wf9 s VAL 12 Cb -0.12 -3.75 0.01 0.00 0.56 0.00 0.00 36.38 33.08 1wf9 s VAL 12 CO 0.16 -0.28 -0.20 -0.60 -0.31 0.00 0.00 175.10 173.86 1wf9 s ARG 13 N -3.54 2.85 0.17 4.82 6.06 0.53 0.54 118.95 130.38 1wf9 s ARG 13 Ca 0.41 -0.79 0.11 0.00 -2.50 0.00 0.00 55.73 52.96 1wf9 s ARG 13 Cb -0.11 -2.32 -0.04 0.00 0.06 0.00 0.00 34.95 32.54 1wf9 s ARG 13 CO 0.30 -0.03 -0.25 -1.54 -2.50 0.00 0.00 175.30 171.28 1wf9 s SER 14 N 0.87 3.37 0.55 -2.12 1.04 0.40 0.12 113.70 117.92 1wf9 s SER 14 Ca -0.07 -0.83 0.27 0.00 0.48 0.00 0.00 55.95 55.81 1wf9 s SER 14 Cb -0.15 -0.24 1.45 0.00 0.10 0.00 0.00 66.02 67.17 1wf9 s SER 14 CO -0.02 0.13 1.96 0.08 0.98 0.00 0.00 173.24 176.37 1wf9 h ARG 15 N 3.39 0.00 0.00 4.02 0.11 -1.92 1.05 114.38 121.04 1wf9 h ARG 15 Ca -0.47 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.53 1wf9 h ARG 15 Cb 1.20 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.27 1wf9 h ARG 15 CO 0.45 0.00 -0.38 0.22 0.10 0.00 0.00 179.97 180.36 1wf9 h ASP 16 N 0.00 0.00 -0.96 0.08 3.58 -1.94 -3.49 116.42 113.69 1wf9 h ASP 16 Ca 0.27 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.72 1wf9 h ASP 16 Cb 1.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1wf9 h ASP 16 CO -0.00 0.38 0.00 0.61 -2.88 0.00 0.00 179.24 177.35 1wf9 n GLY 17 N 1.01 -1.56 3.71 -0.78 0.00 0.36 -5.11 105.19 102.82 1wf9 n GLY 17 Ca 0.02 -1.45 -0.39 0.00 0.00 0.00 0.00 46.02 44.20 1wf9 n GLY 17 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wf9 s LEU 18 N 0.00 4.29 0.12 0.99 2.96 -1.26 0.15 118.68 125.94 1wf9 s LEU 18 Ca 0.00 1.07 0.08 0.00 -0.22 0.00 0.00 54.13 55.06 1wf9 s LEU 18 Cb 0.00 -2.98 -0.04 0.00 0.50 0.00 0.00 46.19 43.68 1wf9 s LEU 18 CO 0.00 -0.11 -0.20 -1.61 -1.32 0.00 0.00 176.35 173.11 1wf9 s GLU 19 N 0.89 1.17 -0.00 1.98 2.02 0.19 -4.91 118.70 120.04 1wf9 s GLU 19 Ca 0.34 -1.25 0.08 0.00 0.02 0.00 0.00 54.97 54.16 1wf9 s GLU 19 Cb -0.17 -1.35 -0.02 0.00 0.10 0.00 0.00 34.13 32.68 1wf9 s GLU 19 CO 0.15 0.30 -0.26 -0.98 0.02 0.00 0.00 175.26 174.49 1wf9 s ARG 20 N -2.24 2.03 0.03 1.61 1.70 -1.26 0.16 118.95 120.98 1wf9 s ARG 20 Ca 0.10 -0.98 0.02 0.00 -0.47 0.00 0.00 55.73 54.40 1wf9 s ARG 20 Cb -0.08 -2.03 -0.02 0.00 -0.57 0.00 0.00 34.95 32.25 1wf9 s ARG 20 CO 0.05 0.55 -0.07 0.08 -1.08 0.00 0.00 175.30 174.83 1wf9 s VAL 21 N -0.67 0.50 -0.09 4.99 1.01 -0.51 -4.95 120.40 120.69 1wf9 s VAL 21 Ca 0.11 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.17 1wf9 s VAL 21 Cb -0.10 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 1wf9 s VAL 21 CO -0.00 -0.22 0.28 -0.55 0.00 0.00 0.00 175.10 174.61 1wf9 s SER 22 N -1.10 6.56 0.00 3.32 0.15 -1.26 0.17 113.70 121.53 1wf9 s SER 22 Ca -0.06 0.66 0.00 0.00 0.70 0.00 0.00 55.95 57.25 1wf9 s SER 22 Cb -0.07 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 1wf9 s SER 22 CO 0.00 0.30 0.00 1.33 1.20 0.00 0.00 173.24 176.07 1wf9 n VAL 23 N 2.33 0.00 -0.06 4.45 0.24 0.91 -4.94 118.33 121.26 1wf9 n VAL 23 Ca -0.16 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.05 1wf9 n VAL 23 Cb 0.53 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.87 1wf9 n VAL 23 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1wf9 n ASP 24 N -1.05 1.68 0.00 -1.34 8.00 -1.26 -4.09 116.55 118.50 1wf9 n ASP 24 Ca 0.00 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.78 1wf9 n ASP 24 Cb 0.00 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 1wf9 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wf9 n GLY 25 N 1.95 -0.55 0.18 0.44 0.00 -1.26 -4.70 105.19 101.26 1wf9 n GLY 25 Ca -0.15 -0.76 0.06 0.00 0.00 0.00 0.00 46.02 45.17 1wf9 n GLY 25 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wf9 h PRO 26 N 0.00 0.00 0.00 1.61 0.13 -1.96 -2.96 132.00 128.82 1wf9 h PRO 26 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1wf9 h PRO 26 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1wf9 h PRO 26 CO 0.00 0.37 0.17 1.12 -0.23 0.00 0.00 178.00 179.43 1wf9 h HIS 27 N 0.00 0.00 -2.79 1.56 2.07 -2.02 -3.40 115.15 110.57 1wf9 h HIS 27 Ca -0.00 0.00 -0.47 0.00 -2.85 0.00 0.00 60.37 57.05 1wf9 h HIS 27 Cb 1.03 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.03 1wf9 h HIS 27 CO 0.00 0.00 -0.13 0.96 -3.07 0.00 0.00 177.93 175.69 1wf9 s ILE 28 N -3.88 4.54 0.53 6.12 -5.25 -1.12 -5.08 121.20 117.05 1wf9 s ILE 28 Ca -0.03 -0.46 0.04 0.00 -0.99 0.00 0.00 60.65 59.21 1wf9 s ILE 28 Cb 0.09 -3.67 0.02 0.00 2.95 0.00 0.00 42.46 41.85 1wf9 s ILE 28 CO 0.27 -0.46 0.24 0.42 -1.79 0.00 0.00 174.94 173.62 1wf9 s THR 29 N -2.45 1.46 0.32 8.37 -4.23 -1.26 -3.75 115.64 114.09 1wf9 s THR 29 Ca 0.45 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 59.27 1wf9 s THR 29 Cb -0.10 -2.15 0.27 0.00 1.34 0.00 0.00 72.50 71.86 1wf9 s THR 29 CO 0.37 0.00 1.96 0.58 -0.54 0.00 0.00 174.62 176.99 1wf9 h VAL 30 N 1.00 1.12 -0.56 2.29 2.07 0.17 0.54 116.25 122.89 1wf9 h VAL 30 Ca -0.40 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 66.86 1wf9 h VAL 30 Cb 1.31 0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1wf9 h VAL 30 CO 0.64 0.18 0.22 0.77 0.02 0.00 0.00 177.57 179.40 1wf9 h SER 31 N 0.97 0.25 0.61 0.57 4.64 -1.40 0.84 113.55 120.03 1wf9 h SER 31 Ca 0.32 0.06 -0.14 0.00 -0.47 0.00 0.00 61.79 61.56 1wf9 h SER 31 Cb 0.06 0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 1wf9 h SER 31 CO -0.09 0.17 -0.64 1.56 -0.87 0.00 0.00 176.83 176.95 1wf9 h GLN 32 N 0.42 0.03 0.50 4.77 4.20 -1.53 -1.74 115.11 121.76 1wf9 h GLN 32 Ca 0.27 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 1wf9 h GLN 32 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1wf9 h GLN 32 CO -0.25 0.66 -0.24 1.25 -0.67 0.00 0.00 178.83 179.58 1wf9 h LEU 33 N 0.02 -0.56 -0.51 1.46 6.46 0.77 -2.06 115.31 120.89 1wf9 h LEU 33 Ca -0.01 -0.04 0.09 0.00 -0.12 0.00 0.00 57.88 57.81 1wf9 h LEU 33 Cb 1.14 0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 41.14 1wf9 h LEU 33 CO 0.09 -0.15 0.07 0.11 -0.62 0.00 0.00 178.44 177.93 1wf9 h LYS 34 N -1.11 0.19 -0.97 1.25 1.57 0.57 0.96 116.57 119.03 1wf9 h LYS 34 Ca -0.07 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.87 1wf9 h LYS 34 Cb 0.57 -0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.73 1wf9 h LYS 34 CO 0.11 0.13 0.57 1.15 -0.57 0.00 0.00 179.45 180.84 1wf9 h THR 35 N 0.20 0.74 0.35 -0.16 2.02 -1.34 1.55 112.91 116.27 1wf9 h THR 35 Ca 0.26 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1wf9 h THR 35 Cb 0.36 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 1wf9 h THR 35 CO -0.36 0.14 -0.17 -0.07 0.37 0.00 0.00 175.52 175.43 1wf9 h LEU 36 N 0.77 -0.39 -2.01 2.58 3.38 -0.09 0.49 115.31 120.03 1wf9 h LEU 36 Ca 0.54 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.66 1wf9 h LEU 36 Cb 0.78 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1wf9 h LEU 36 CO -0.36 -0.27 0.34 0.40 0.09 0.00 0.00 178.44 178.64 1wf9 h ILE 37 N -0.50 0.74 -0.03 1.22 5.03 -0.87 1.22 117.51 124.32 1wf9 h ILE 37 Ca -0.05 0.00 -0.08 0.00 -0.12 0.00 0.00 64.86 64.61 1wf9 h ILE 37 Cb 0.36 0.76 -0.01 0.00 -3.03 0.00 0.00 36.82 34.90 1wf9 h ILE 37 CO 0.08 0.00 -0.36 -0.61 -0.68 0.00 0.00 178.15 176.58 1wf9 h GLN 38 N 0.00 0.06 0.08 2.37 -0.00 0.25 0.93 115.11 118.80 1wf9 h GLN 38 Ca 0.22 -0.02 -0.36 0.00 -0.00 0.00 0.00 58.65 58.49 1wf9 h GLN 38 Cb 0.89 -0.00 -0.03 0.00 0.00 0.00 0.00 27.48 28.34 1wf9 h GLN 38 CO -0.00 0.41 -2.04 -3.47 0.00 0.00 0.00 178.83 173.73 1wf9 n ASP 39 N -4.10 2.07 0.23 -0.69 -0.08 0.18 -0.28 116.55 113.87 1wf9 n ASP 39 Ca -0.02 0.17 -0.11 0.00 -1.51 0.00 0.00 54.79 53.32 1wf9 n ASP 39 Cb 0.41 -0.79 -0.06 0.00 2.34 0.00 0.00 41.12 43.02 1wf9 n ASP 39 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 1wf9 h GLN 40 N -0.09 -0.62 0.00 -0.67 4.20 0.13 -3.14 115.11 114.92 1wf9 h GLN 40 Ca -0.46 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.29 1wf9 h GLN 40 Cb 1.92 0.14 0.00 0.00 0.30 0.00 0.00 27.48 29.84 1wf9 h GLN 40 CO 0.00 -0.37 0.00 1.28 -0.67 0.00 0.00 178.83 179.08 1wf9 n LEU 41 N -5.21 0.03 -3.37 1.46 4.77 0.32 -4.91 117.00 110.09 1wf9 n LEU 41 Ca -0.09 0.50 -0.16 0.00 -0.03 0.00 0.00 56.01 56.23 1wf9 n LEU 41 Cb 0.28 -0.50 0.08 0.00 -2.33 0.00 0.00 43.42 40.95 1wf9 n LEU 41 CO 0.22 -0.10 0.09 0.00 -1.33 0.00 0.00 177.39 176.28 1wf9 n GLN 42 N -1.53 -5.49 -4.76 3.23 1.13 -0.93 -4.62 117.38 104.41 1wf9 n GLN 42 Ca 0.06 0.85 -0.24 0.00 -1.94 0.00 0.00 57.00 55.72 1wf9 n GLN 42 Cb 0.28 -5.84 -0.15 0.00 0.11 0.00 0.00 30.24 24.64 1wf9 n GLN 42 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1wf9 s ILE 43 N -3.37 1.40 0.06 5.09 1.01 0.61 -1.19 121.20 124.81 1wf9 s ILE 43 Ca 0.12 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 59.62 1wf9 s ILE 43 Cb -0.02 -1.18 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1wf9 s ILE 43 CO 0.73 0.32 1.17 -2.16 0.00 0.00 0.00 174.94 175.00 1wf9 s PRO 44 N -0.60 4.45 0.45 2.79 0.04 -1.26 -3.94 135.00 136.93 1wf9 s PRO 44 Ca 0.06 1.72 0.21 0.00 0.04 0.00 0.00 61.00 63.03 1wf9 s PRO 44 Cb -0.07 -3.36 1.18 0.00 0.04 0.00 0.00 34.50 32.29 1wf9 s PRO 44 CO -0.00 -0.22 1.88 0.82 0.04 0.00 0.00 177.00 179.52 1wf9 h ILE 45 N 4.51 0.67 0.00 0.56 2.04 -1.89 1.89 117.51 125.28 1wf9 h ILE 45 Ca -0.42 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1wf9 h ILE 45 Cb 1.21 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1wf9 h ILE 45 CO 0.80 0.05 0.00 0.00 0.00 0.00 0.00 178.15 179.00 1wf9 n HIS 46 N -4.45 0.17 -0.03 1.37 1.44 -1.26 -2.74 115.22 109.72 1wf9 n HIS 46 Ca 0.18 0.08 -0.04 0.00 -2.01 0.00 0.00 57.72 55.92 1wf9 n HIS 46 Cb 0.73 -0.62 -0.02 0.00 0.12 0.00 0.00 29.99 30.19 1wf9 n HIS 46 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 1wf9 n ASN 47 N -1.66 2.65 -4.59 4.39 3.02 0.56 -5.01 115.26 114.61 1wf9 n ASN 47 Ca 0.01 0.00 -0.45 0.00 -0.03 0.00 0.00 54.58 54.11 1wf9 n ASN 47 Cb 0.09 -0.11 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 1wf9 n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wf9 n GLN 48 N -2.83 1.33 -3.73 3.52 6.02 0.33 -4.04 117.38 117.98 1wf9 n GLN 48 Ca -0.10 0.47 -0.28 0.00 -0.01 0.00 0.00 57.00 57.08 1wf9 n GLN 48 Cb 0.59 -1.85 -0.16 0.00 1.02 0.00 0.00 30.24 29.84 1wf9 n GLN 48 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1wf9 s THR 49 N -0.96 0.54 0.00 5.09 2.01 0.44 -4.87 115.64 117.88 1wf9 s THR 49 Ca 0.60 -0.67 -0.13 0.00 0.31 0.00 0.00 61.69 61.80 1wf9 s THR 49 Cb -0.72 -1.10 -0.06 0.00 0.01 0.00 0.00 72.50 70.64 1wf9 s THR 49 CO 0.59 -0.29 0.38 -0.76 -0.69 0.00 0.00 174.62 173.85 1wf9 s LEU 50 N 1.84 4.45 0.16 4.42 2.01 -1.26 -0.61 118.68 129.68 1wf9 s LEU 50 Ca 0.01 0.89 -0.24 0.00 0.01 0.00 0.00 54.13 54.80 1wf9 s LEU 50 Cb -0.17 -2.60 0.06 0.00 0.01 0.00 0.00 46.19 43.50 1wf9 s LEU 50 CO -0.11 0.31 0.70 -0.55 1.01 0.00 0.00 176.35 177.70 1wf9 s SER 51 N -1.18 -0.45 -0.34 2.29 0.15 -0.95 -4.10 113.70 109.13 1wf9 s SER 51 Ca 0.24 -0.15 0.07 0.00 0.70 0.00 0.00 55.95 56.81 1wf9 s SER 51 Cb -0.16 0.58 0.49 0.00 -1.71 0.00 0.00 66.02 65.22 1wf9 s SER 51 CO 0.13 -0.99 1.46 0.35 1.20 0.00 0.00 173.24 175.40 1wf9 n THR 52 N -0.38 2.67 -4.01 6.45 -2.24 -1.26 -1.83 114.28 113.68 1wf9 n THR 52 Ca -0.12 -3.16 -0.14 0.00 -2.27 0.00 0.00 64.05 58.36 1wf9 n THR 52 Cb 0.63 -0.62 -0.14 0.00 -2.10 0.00 0.00 70.33 68.10 1wf9 n THR 52 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1wf9 s ASN 53 N -2.74 0.33 0.36 3.42 -0.87 -1.26 -5.00 114.94 109.17 1wf9 s ASN 53 Ca 0.48 -0.09 0.27 0.00 -1.57 0.00 0.00 52.86 51.95 1wf9 s ASN 53 Cb 0.42 -0.02 1.02 0.00 -0.02 0.00 0.00 41.25 42.65 1wf9 s ASN 53 CO 0.00 0.01 1.80 0.08 -2.57 0.00 0.00 177.10 176.41 1wf9 h ARG 54 N 5.95 0.00 0.00 -0.60 -0.00 -1.98 -2.50 114.38 115.25 1wf9 h ARG 54 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.71 1wf9 h ARG 54 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.17 1wf9 h ARG 54 CO 0.50 0.00 0.00 0.09 -0.00 0.00 0.00 179.97 180.56 1wf9 n ASN 55 N -2.57 0.28 -0.04 0.08 3.02 -1.26 -2.35 115.26 112.42 1wf9 n ASN 55 Ca 0.02 0.60 -0.09 0.00 -0.03 0.00 0.00 54.58 55.08 1wf9 n ASN 55 Cb 0.31 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 38.80 1wf9 n ASN 55 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1wf9 h LEU 56 N 0.00 -0.15 -0.31 3.41 5.85 -1.84 0.41 115.31 122.69 1wf9 h LEU 56 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1wf9 h LEU 56 Cb 0.16 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1wf9 h LEU 56 CO 0.00 -0.05 0.00 0.18 -0.34 0.00 0.00 178.44 178.23 1wf9 n LEU 57 N -5.18 0.20 0.07 2.25 4.32 -0.99 -0.88 117.00 116.79 1wf9 n LEU 57 Ca -0.03 0.56 -0.02 0.00 -0.02 0.00 0.00 56.01 56.51 1wf9 n LEU 57 Cb 0.12 -0.55 -0.06 0.00 -1.62 0.00 0.00 43.42 41.30 1wf9 n LEU 57 CO 0.25 -0.46 0.01 0.17 -1.22 0.00 0.00 177.39 176.14 1wf9 h LEU 58 N 0.00 0.00 -9.23 2.23 8.10 -0.35 -3.45 115.31 112.61 1wf9 h LEU 58 Ca 0.00 0.00 -0.56 0.00 0.11 0.00 0.00 57.88 57.43 1wf9 h LEU 58 Cb 0.18 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.38 1wf9 h LEU 58 CO 0.00 0.69 0.97 0.00 -4.11 0.00 0.00 178.44 175.99 1wf9 s ALA 59 N -2.85 3.63 -0.08 0.17 0.00 -0.06 -4.84 121.76 117.73 1wf9 s ALA 59 Ca -0.00 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.75 1wf9 s ALA 59 Cb 0.08 -3.67 -0.11 0.00 0.00 0.00 0.00 23.12 19.42 1wf9 s ALA 59 CO 0.79 -1.23 0.04 1.63 0.00 0.00 0.00 175.76 176.99 1wf9 n LYS 60 N 6.66 2.42 -2.56 0.00 4.76 -1.26 -4.90 118.16 123.28 1wf9 n LYS 60 Ca 0.15 -0.01 -0.25 0.00 -2.87 0.00 0.00 58.31 55.33 1wf9 n LYS 60 Cb 0.44 -1.23 0.03 0.00 -1.84 0.00 0.00 35.03 32.43 1wf9 n LYS 60 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1wf9 s SER 61 N -4.02 5.51 0.15 4.39 0.01 -1.26 -5.01 113.70 113.48 1wf9 s SER 61 Ca -0.04 0.47 -0.02 0.00 1.31 0.00 0.00 55.95 57.67 1wf9 s SER 61 Cb 0.03 -1.47 -0.02 0.00 0.21 0.00 0.00 66.02 64.77 1wf9 s SER 61 CO 0.36 -1.05 1.37 1.55 0.41 0.00 0.00 173.24 175.88 1wf9 h PRO 62 N -0.05 0.36 0.00 12.44 0.13 -2.00 -3.04 132.00 139.84 1wf9 h PRO 62 Ca -0.45 -0.35 -0.12 0.00 -0.87 0.00 0.00 66.00 64.21 1wf9 h PRO 62 Cb 1.27 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 1wf9 h PRO 62 CO 0.59 1.02 -0.56 0.77 -0.23 0.00 0.00 178.00 179.59 1wf9 h SER 63 N 0.22 0.00 -0.43 1.44 0.02 -1.99 -3.05 113.55 109.76 1wf9 h SER 63 Ca -0.05 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.86 1wf9 h SER 63 Cb 1.46 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.98 1wf9 h SER 63 CO 0.14 0.56 0.12 0.44 -1.14 0.00 0.00 176.83 176.95 1wf9 h ASP 64 N 0.00 0.63 0.46 3.07 5.19 -1.94 -1.72 116.42 122.11 1wf9 h ASP 64 Ca -0.01 -0.22 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 1wf9 h ASP 64 Cb 1.09 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.43 1wf9 h ASP 64 CO 0.07 0.68 0.00 -0.26 -3.12 0.00 0.00 179.24 176.61 1wf9 h PHE 65 N 0.55 0.00 0.00 4.55 0.04 -1.43 0.01 116.94 120.66 1wf9 h PHE 65 Ca 0.14 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.91 1wf9 h PHE 65 Cb 0.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1wf9 h PHE 65 CO 0.01 0.00 0.00 1.28 -0.60 0.00 0.00 178.31 179.00 1wf9 n LEU 66 N -2.83 0.00 0.09 1.54 4.77 -0.65 -2.50 117.00 117.41 1wf9 n LEU 66 Ca -0.01 0.17 -0.09 0.00 -0.03 0.00 0.00 56.01 56.06 1wf9 n LEU 66 Cb 0.17 -0.17 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1wf9 n LEU 66 CO 0.21 -0.04 0.20 0.00 -1.33 0.00 0.00 177.39 176.43 1wf9 h ALA 67 N 3.29 0.45 -1.92 -1.18 0.00 -1.03 -3.39 119.26 115.47 1wf9 h ALA 67 Ca 0.00 -0.77 -0.68 0.00 0.00 0.00 0.00 54.91 53.45 1wf9 h ALA 67 Cb 0.14 -0.08 -0.18 0.00 0.00 0.00 0.00 17.79 17.67 1wf9 h ALA 67 CO 0.00 0.98 0.64 -0.06 0.00 0.00 0.00 179.25 180.81 1wf9 s PHE 68 N -3.05 3.05 -0.49 0.00 0.08 -1.04 -4.85 117.98 111.67 1wf9 s PHE 68 Ca -0.02 -1.19 0.03 0.00 0.12 0.00 0.00 56.93 55.87 1wf9 s PHE 68 Cb 0.10 -4.22 0.43 0.00 -0.57 0.00 0.00 43.02 38.76 1wf9 s PHE 68 CO 0.83 -1.47 1.48 0.25 -0.10 0.00 0.00 175.22 176.21 1wf9 n THR 69 N 5.50 2.89 -0.11 0.64 -2.24 -1.26 -4.62 114.28 115.08 1wf9 n THR 69 Ca 0.13 -4.13 -0.25 0.00 -2.27 0.00 0.00 64.05 57.54 1wf9 n THR 69 Cb 0.47 -1.19 -0.11 0.00 -2.10 0.00 0.00 70.33 67.40 1wf9 n THR 69 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1wf9 n ASP 70 N -0.67 1.92 -1.72 3.42 9.92 -1.26 -4.47 116.55 123.67 1wf9 n ASP 70 Ca 0.48 0.36 -0.18 0.00 -0.53 0.00 0.00 54.79 54.92 1wf9 n ASP 70 Cb 0.71 -0.89 0.10 0.00 -0.64 0.00 0.00 41.12 40.41 1wf9 n ASP 70 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1wf9 n MET 71 N -4.27 2.70 0.04 -1.24 2.81 -1.26 -4.57 117.12 111.33 1wf9 n MET 71 Ca -0.41 -3.61 -0.09 0.00 -1.81 0.00 0.00 57.70 51.78 1wf9 n MET 71 Cb 0.79 -2.09 -0.13 0.00 -0.71 0.00 0.00 33.22 31.08 1wf9 n MET 71 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1wf9 h ALA 72 N 1.67 0.47 -2.16 3.04 0.00 -1.82 -3.42 119.26 117.03 1wf9 h ALA 72 Ca 0.35 -1.12 -0.57 0.00 0.00 0.00 0.00 54.91 53.58 1wf9 h ALA 72 Cb 1.43 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 1wf9 h ALA 72 CO 0.77 1.33 0.80 0.34 0.00 0.00 0.00 179.25 182.49 1wf9 s ASP 73 N -6.57 7.05 0.49 0.00 2.15 -1.26 -4.90 116.67 113.64 1wf9 s ASP 73 Ca -0.02 1.58 0.28 0.00 0.43 0.00 0.00 52.55 54.82 1wf9 s ASP 73 Cb 0.09 -2.54 0.86 0.00 -0.30 0.00 0.00 42.92 41.02 1wf9 s ASP 73 CO 0.83 -0.67 1.80 1.55 -0.17 0.00 0.00 175.17 178.51 1wf9 h PRO 74 N 7.70 0.00 -0.41 4.34 0.13 -1.92 -2.50 132.00 139.33 1wf9 h PRO 74 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1wf9 h PRO 74 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1wf9 h PRO 74 CO 0.95 0.01 0.00 0.09 -0.23 0.00 0.00 178.00 178.82 1wf9 n ASN 75 N -3.10 2.47 -4.82 1.44 3.02 -1.26 -1.21 115.26 111.79 1wf9 n ASN 75 Ca 0.02 -1.94 -0.38 0.00 -0.03 0.00 0.00 54.58 52.25 1wf9 n ASN 75 Cb 0.42 -0.27 -0.06 0.00 -0.61 0.00 0.00 39.78 39.26 1wf9 n ASN 75 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1wf9 s LEU 76 N -1.16 4.48 0.21 3.41 2.96 -0.94 -4.90 118.68 122.74 1wf9 s LEU 76 Ca 0.33 1.16 -0.06 0.00 -0.22 0.00 0.00 54.13 55.33 1wf9 s LEU 76 Cb 0.17 -2.91 -0.06 0.00 0.50 0.00 0.00 46.19 43.90 1wf9 s LEU 76 CO 0.24 0.25 0.48 -0.13 -1.32 0.00 0.00 176.35 175.86 1wf9 s ARG 77 N -1.28 3.68 0.36 1.98 3.00 -1.26 0.64 118.95 126.06 1wf9 s ARG 77 Ca 0.30 0.04 0.27 0.00 0.00 0.00 0.00 55.73 56.34 1wf9 s ARG 77 Cb -0.18 -2.73 1.06 0.00 0.00 0.00 0.00 34.95 33.10 1wf9 s ARG 77 CO 0.18 0.35 1.80 -0.84 0.00 0.00 0.00 175.30 176.79 1wf9 h ILE 78 N 1.84 0.00 0.00 1.52 3.07 -1.77 -2.42 117.51 119.75 1wf9 h ILE 78 Ca -0.47 -0.38 0.00 0.00 1.55 0.00 0.00 64.86 65.56 1wf9 h ILE 78 Cb 1.17 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 38.96 1wf9 h ILE 78 CO 0.70 0.00 0.00 -1.28 -1.05 0.00 0.00 178.15 176.52 1wf9 h SER 79 N 0.00 0.00 -0.35 2.16 0.87 -1.86 -0.34 113.55 114.03 1wf9 h SER 79 Ca 0.00 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1wf9 h SER 79 Cb 0.48 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 1wf9 h SER 79 CO 0.00 0.00 0.00 -1.28 -0.53 0.00 0.00 176.83 175.02 1wf9 h SER 80 N 0.00 0.68 0.56 6.23 0.87 -1.84 -2.76 113.55 117.29 1wf9 h SER 80 Ca 0.00 -0.15 -0.19 0.00 -1.23 0.00 0.00 61.79 60.22 1wf9 h SER 80 Cb 0.18 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 1wf9 h SER 80 CO 0.00 0.75 -1.58 0.18 -0.53 0.00 0.00 176.83 175.65 1wf9 n LEU 81 N -4.23 0.71 -0.67 2.23 4.77 -0.54 -4.99 117.00 114.28 1wf9 n LEU 81 Ca 0.02 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1wf9 n LEU 81 Cb 0.28 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1wf9 n LEU 81 CO 0.41 0.20 0.00 -3.20 -1.33 0.00 0.00 177.39 173.46 1wf9 n ASN 82 N -2.85 -1.99 -4.76 -1.43 5.15 -0.25 -5.01 115.26 104.12 1wf9 n ASN 82 Ca -0.12 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.45 1wf9 n ASN 82 Cb 0.88 -0.50 -0.04 0.00 -0.53 0.00 0.00 39.78 39.59 1wf9 n ASN 82 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1wf9 s LEU 83 N -1.34 4.50 0.21 1.20 2.01 -1.17 -5.03 118.68 119.06 1wf9 s LEU 83 Ca 0.00 2.36 0.00 0.00 0.01 0.00 0.00 54.13 56.51 1wf9 s LEU 83 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 46.19 42.53 1wf9 s LEU 83 CO 0.00 -0.30 0.09 0.00 1.01 0.00 0.00 176.35 177.16 1wf9 s ALA 84 N -0.86 1.37 -0.74 4.21 0.00 -1.26 -4.91 121.76 119.56 1wf9 s ALA 84 Ca 0.48 -1.73 -0.25 0.00 0.00 0.00 0.00 51.96 50.46 1wf9 s ALA 84 Cb -0.34 1.11 -0.14 0.00 0.00 0.00 0.00 23.12 23.75 1wf9 s ALA 84 CO 0.43 -0.50 2.41 1.58 0.00 0.00 0.00 175.76 179.68 1wf9 n HIS 85 N -0.32 1.14 0.00 0.00 -0.00 -1.26 0.49 115.22 115.26 1wf9 n HIS 85 Ca -0.01 0.02 0.00 0.00 0.46 0.00 0.00 57.72 58.19 1wf9 n HIS 85 Cb 0.66 -2.49 0.00 0.00 -0.12 0.00 0.00 29.99 28.03 1wf9 n HIS 85 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1wf9 n GLY 86 N 6.56 1.07 3.24 1.57 0.00 -1.23 -4.98 105.19 111.42 1wf9 n GLY 86 Ca 0.47 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.19 1wf9 n GLY 86 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wf9 n SER 87 N 0.00 -2.54 -4.31 1.61 7.64 0.18 -4.79 113.62 111.40 1wf9 n SER 87 Ca 0.00 -0.21 -0.29 0.00 1.01 0.00 0.00 58.87 59.38 1wf9 n SER 87 Cb 0.00 -0.93 -0.14 0.00 -1.01 0.00 0.00 64.21 62.12 1wf9 n SER 87 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1wf9 s MET 88 N -3.54 1.66 0.13 1.43 -2.45 -1.26 -3.61 119.30 111.66 1wf9 s MET 88 Ca 0.54 -1.06 -0.13 0.00 -1.25 0.00 0.00 55.69 53.79 1wf9 s MET 88 Cb -0.11 -1.82 0.02 0.00 1.25 0.00 0.00 34.83 34.16 1wf9 s MET 88 CO 0.61 0.47 0.33 0.54 1.05 0.00 0.00 175.02 178.02 1wf9 s VAL 89 N -0.80 0.09 -0.07 10.11 0.11 -0.90 -4.91 120.40 124.03 1wf9 s VAL 89 Ca 0.10 -0.90 0.03 0.00 -2.93 0.00 0.00 61.98 58.29 1wf9 s VAL 89 Cb -0.10 -1.35 0.01 0.00 -1.53 0.00 0.00 36.38 33.41 1wf9 s VAL 89 CO 0.02 -0.40 -0.16 -0.31 -3.33 0.00 0.00 175.10 170.92 1wf9 s TYR 90 N -3.85 1.79 -0.00 1.54 2.02 -0.76 0.20 117.35 118.29 1wf9 s TYR 90 Ca 0.06 -0.65 0.01 0.00 -0.37 0.00 0.00 57.07 56.12 1wf9 s TYR 90 Cb 0.03 -1.25 -0.04 0.00 -0.40 0.00 0.00 41.96 40.30 1wf9 s TYR 90 CO -0.09 -0.28 0.03 -1.17 -1.57 0.00 0.00 175.55 172.46 1wf9 s LEU 91 N 0.43 3.64 -0.09 -1.29 2.96 0.32 -2.24 118.68 122.41 1wf9 s LEU 91 Ca -0.13 0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 53.78 1wf9 s LEU 91 Cb -0.15 -2.10 0.05 0.00 0.50 0.00 0.00 46.19 44.48 1wf9 s LEU 91 CO 0.05 0.28 0.20 0.00 -1.32 0.00 0.00 176.35 175.55 1wf9 s ALA 92 N -1.12 -0.35 0.13 5.97 0.00 0.22 -4.21 121.76 122.40 1wf9 s ALA 92 Ca 0.21 0.75 -0.01 0.00 0.00 0.00 0.00 51.96 52.91 1wf9 s ALA 92 Cb -0.12 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.22 1wf9 s ALA 92 CO 0.12 -0.42 0.07 1.52 0.00 0.00 0.00 175.76 177.04 1wf9 s TYR 93 N 1.88 0.85 -0.14 0.00 1.13 -1.26 0.17 117.35 119.97 1wf9 s TYR 93 Ca -0.02 -1.21 -0.07 0.00 -1.41 0.00 0.00 57.07 54.35 1wf9 s TYR 93 Cb -0.12 -0.46 -0.04 0.00 -1.10 0.00 0.00 41.96 40.24 1wf9 s TYR 93 CO -0.07 -0.53 0.11 -1.83 -2.51 0.00 0.00 175.55 170.71 1wf9 s GLU 94 N -4.05 3.56 0.26 -3.49 -1.05 -1.26 -4.98 118.70 107.69 1wf9 s GLU 94 Ca 0.24 -0.22 0.00 0.00 -0.15 0.00 0.00 54.97 54.85 1wf9 s GLU 94 Cb 0.07 -3.17 0.00 0.00 -0.44 0.00 0.00 34.13 30.59 1wf9 s GLU 94 CO 0.02 0.62 0.00 0.41 0.95 0.00 0.00 175.26 177.26 1wf9 n GLY 95 N 2.46 -1.82 1.06 -3.83 0.00 -1.26 -4.89 105.19 96.92 1wf9 n GLY 95 Ca -0.19 -1.26 -0.09 0.00 0.00 0.00 0.00 46.02 44.48 1wf9 n GLY 95 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wf9 n GLU 96 N -3.40 -1.77 -0.30 1.61 1.02 -1.26 -5.07 120.64 111.47 1wf9 n GLU 96 Ca 0.00 -0.53 0.00 0.00 -0.02 0.00 0.00 57.16 56.61 1wf9 n GLU 96 Cb 0.48 -0.51 0.00 0.00 -0.02 0.00 0.00 31.44 31.39 1wf9 n GLU 96 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wf9 n ARG 97 N -2.58 0.89 -3.06 3.49 1.74 -1.26 -5.02 116.66 110.86 1wf9 n ARG 97 Ca 0.05 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.98 1wf9 n ARG 97 Cb 0.18 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.60 1wf9 n ARG 97 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1wf9 n THR 98 N -1.08 0.00 -3.17 0.55 -2.24 -0.33 -5.04 114.28 102.98 1wf9 n THR 98 Ca 0.00 -1.14 -0.38 0.00 -2.27 0.00 0.00 64.05 60.26 1wf9 n THR 98 Cb 0.00 0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 1wf9 n THR 98 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1wf9 s ILE 99 N -1.68 4.61 0.52 2.28 1.01 -1.26 -4.90 121.20 121.77 1wf9 s ILE 99 Ca 0.06 1.31 -0.23 0.00 0.00 0.00 0.00 60.65 61.79 1wf9 s ILE 99 Cb -0.00 -3.93 -0.06 0.00 0.01 0.00 0.00 42.46 38.48 1wf9 s ILE 99 CO 0.04 0.42 1.38 -0.13 0.00 0.00 0.00 174.94 176.65 1wf9 s ARG 100 N -1.45 3.29 -0.06 2.79 0.52 -1.26 -5.02 118.95 117.77 1wf9 s ARG 100 Ca 0.35 2.30 -0.28 0.00 -0.52 0.00 0.00 55.73 57.59 1wf9 s ARG 100 Cb -0.19 -2.38 0.06 0.00 0.52 0.00 0.00 34.95 32.97 1wf9 s ARG 100 CO 0.21 -1.09 0.62 0.20 0.02 0.00 0.00 175.30 175.27 1wf9 s GLY 101 N -0.81 -0.51 -0.10 -3.53 0.00 -1.26 -5.17 107.32 95.94 1wf9 s GLY 101 Ca 0.68 1.20 -0.18 0.00 0.00 0.00 0.00 44.72 46.42 1wf9 s GLY 101 CO 0.51 0.87 0.44 -1.35 0.00 0.00 0.00 173.10 173.56 1wf9 s SER 102 N -1.13 -0.40 -0.25 1.64 1.04 -1.26 -5.08 113.70 108.26 1wf9 s SER 102 Ca -0.11 0.59 -0.04 0.00 0.48 0.00 0.00 55.95 56.87 1wf9 s SER 102 Cb -0.01 0.65 0.09 0.00 0.10 0.00 0.00 66.02 66.84 1wf9 s SER 102 CO 0.09 -0.33 0.12 -0.83 0.98 0.00 0.00 173.24 173.26 1wf9 s GLY 103 N -0.55 0.44 1.10 7.32 0.00 -1.26 -5.14 107.32 109.22 1wf9 s GLY 103 Ca -0.07 -0.84 -0.18 0.00 0.00 0.00 0.00 44.72 43.64 1wf9 s GLY 103 CO 0.03 1.97 1.23 2.56 0.00 0.00 0.00 173.10 178.89 1wf9 s PRO 104 N 2.11 -0.42 0.30 2.90 0.04 -1.26 -5.10 135.00 133.57 1wf9 s PRO 104 Ca 0.07 -0.30 -0.11 0.00 0.04 0.00 0.00 61.00 60.70 1wf9 s PRO 104 Cb -0.16 -1.71 0.01 0.00 0.04 0.00 0.00 34.50 32.68 1wf9 s PRO 104 CO -0.28 -3.14 0.54 -1.12 0.04 0.00 0.00 177.00 173.04 1wf9 s SER 105 N -4.44 0.18 -0.01 6.66 0.01 -1.26 -5.16 113.70 109.68 1wf9 s SER 105 Ca 0.73 -1.09 -0.03 0.00 1.31 0.00 0.00 55.95 56.87 1wf9 s SER 105 Cb -0.06 0.66 -0.04 0.00 0.21 0.00 0.00 66.02 66.79 1wf9 s SER 105 CO 0.55 -1.29 0.19 -0.55 0.41 0.00 0.00 173.24 172.55 1wf9 s SER 106 N -3.08 6.39 0.00 2.44 0.15 -1.26 -5.37 113.70 112.97 1wf9 s SER 106 Ca 0.23 0.38 0.00 0.00 0.70 0.00 0.00 55.95 57.26 1wf9 s SER 106 Cb -0.02 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.28 1wf9 s SER 106 CO 0.12 0.27 0.43 0.61 1.20 0.00 0.00 173.24 175.87