#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wv5 h LEU 8 N 0.00 0.09 -1.02 0.64 5.85 -2.00 0.12 115.31 118.98 2wv5 h LEU 8 Ca 0.00 -0.40 0.05 0.00 0.84 0.00 0.00 57.88 58.37 2wv5 h LEU 8 Cb 0.00 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 2wv5 h LEU 8 CO 0.00 0.48 0.65 -0.61 -0.34 0.00 0.00 178.44 178.62 2wv5 h GLN 9 N -0.29 1.18 0.00 1.25 4.15 -2.02 0.49 115.11 119.87 2wv5 h GLN 9 Ca 0.01 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.28 2wv5 h GLN 9 Cb 0.44 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2wv5 h GLN 9 CO 0.01 0.78 -0.38 0.87 -1.93 0.00 0.00 178.83 178.18 2wv5 h LYS 10 N 1.22 0.00 0.09 1.69 1.57 -1.97 -1.94 116.57 117.22 2wv5 h LYS 10 Ca 0.41 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.93 2wv5 h LYS 10 Cb 0.08 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.40 2wv5 h LYS 10 CO -0.14 0.38 -1.14 1.98 -0.57 0.00 0.00 179.45 179.95 2wv5 h MET 11 N 0.00 0.39 0.12 3.15 1.85 0.19 -3.07 114.93 117.56 2wv5 h MET 11 Ca -0.00 -0.54 -0.28 0.00 -0.61 0.00 0.00 59.70 58.27 2wv5 h MET 11 Cb 0.88 0.18 0.02 0.00 0.43 0.00 0.00 31.60 33.11 2wv5 h MET 11 CO 0.05 1.21 -1.22 0.28 -0.40 0.00 0.00 176.91 176.84 2wv5 h VAL 12 N 0.17 1.37 0.00 -5.77 2.07 -0.08 -3.07 116.25 110.94 2wv5 h VAL 12 Ca -0.13 -2.68 -0.01 0.00 0.82 0.00 0.00 66.70 64.70 2wv5 h VAL 12 Cb 1.82 2.76 -0.00 0.00 -1.52 0.00 0.00 31.29 34.35 2wv5 h VAL 12 CO 0.20 0.80 -0.06 -0.03 0.02 0.00 0.00 177.57 178.49 2wv5 h MET 13 N 0.19 0.00 -0.06 1.57 -1.53 -1.45 0.93 114.93 114.58 2wv5 h MET 13 Ca -0.16 0.00 -0.11 0.00 -3.44 0.00 0.00 59.70 55.99 2wv5 h MET 13 Cb 1.90 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 32.94 2wv5 h MET 13 CO 0.22 0.06 -0.48 0.78 0.14 0.00 0.00 176.91 177.63 2wv5 h GLY 14 N 0.22 0.16 1.24 1.39 0.00 -1.45 -2.82 103.07 101.82 2wv5 h GLY 14 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2wv5 h GLY 14 CO 0.01 0.15 -0.40 0.70 0.00 0.00 0.00 176.54 177.00 2wv5 n ASN 15 N -3.97 0.41 -4.70 0.19 4.13 0.16 -4.87 115.26 106.62 2wv5 n ASN 15 Ca -0.02 -0.05 -0.41 0.00 1.68 0.00 0.00 54.58 55.79 2wv5 n ASN 15 Cb 0.52 0.07 -0.04 0.00 -1.54 0.00 0.00 39.78 38.79 2wv5 n ASN 15 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2wv5 s THR 16 N -3.01 4.91 0.07 3.41 2.01 -0.26 -1.38 115.64 121.38 2wv5 s THR 16 Ca 0.11 1.75 0.08 0.00 0.31 0.00 0.00 61.69 63.94 2wv5 s THR 16 Cb 0.17 -4.18 -0.03 0.00 0.01 0.00 0.00 72.50 68.47 2wv5 s THR 16 CO 0.66 0.13 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.97 2wv5 s LYS 17 N 1.42 1.28 0.25 4.92 -0.14 -0.05 -4.91 119.74 122.51 2wv5 s LYS 17 Ca 0.43 -1.03 -0.30 0.00 -1.36 0.00 0.00 55.97 53.71 2wv5 s LYS 17 Cb -0.18 -1.47 -0.09 0.00 -1.68 0.00 0.00 37.83 34.41 2wv5 s LYS 17 CO 0.19 0.36 1.01 -1.25 -0.76 0.00 0.00 175.35 174.90 2wv5 s PRO 18 N -1.48 4.76 -0.04 -1.68 0.04 -1.06 -1.50 135.00 134.03 2wv5 s PRO 18 Ca 0.07 1.62 0.06 0.00 0.04 0.00 0.00 61.00 62.79 2wv5 s PRO 18 Cb -0.09 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 31.19 2wv5 s PRO 18 CO 0.03 0.37 -0.23 0.08 0.04 0.00 0.00 177.00 177.28 2wv5 s VAL 19 N -1.07 1.90 -0.02 -0.36 1.01 -0.94 -0.94 120.40 119.97 2wv5 s VAL 19 Ca 0.43 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2wv5 s VAL 19 Cb -0.28 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.51 2wv5 s VAL 19 CO 0.35 0.53 -0.06 -1.61 0.00 0.00 0.00 175.10 174.32 2wv5 s GLU 20 N -0.25 0.70 -0.20 2.72 8.01 0.32 -2.18 118.70 127.81 2wv5 s GLU 20 Ca 0.00 -0.18 -0.14 0.00 0.01 0.00 0.00 54.97 54.67 2wv5 s GLU 20 Cb -0.12 -0.69 -0.04 0.00 -4.31 0.00 0.00 34.13 28.97 2wv5 s GLU 20 CO 0.02 0.04 0.29 -0.51 0.01 0.00 0.00 175.26 175.11 2wv5 s LEU 21 N 0.37 4.18 -0.14 1.80 1.43 0.51 0.10 118.68 126.94 2wv5 s LEU 21 Ca -0.05 0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 53.43 2wv5 s LEU 21 Cb -0.09 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2wv5 s LEU 21 CO 0.00 0.03 -0.04 -0.63 0.23 0.00 0.00 176.35 175.95 2wv5 s ILE 22 N 0.89 3.93 -0.30 -0.59 -1.09 0.11 -0.45 121.20 123.70 2wv5 s ILE 22 Ca 0.15 -0.35 -0.03 0.00 -2.23 0.00 0.00 60.65 58.19 2wv5 s ILE 22 Cb -0.14 -2.70 0.10 0.00 -1.58 0.00 0.00 42.46 38.14 2wv5 s ILE 22 CO 0.05 0.52 0.13 -0.22 -1.23 0.00 0.00 174.94 174.18 2wv5 s LEU 23 N 0.09 1.02 -0.61 2.97 2.96 0.20 -1.53 118.68 123.78 2wv5 s LEU 23 Ca -0.00 -1.43 -0.02 0.00 -0.22 0.00 0.00 54.13 52.45 2wv5 s LEU 23 Cb -0.13 -0.49 -0.03 0.00 0.50 0.00 0.00 46.19 46.04 2wv5 s LEU 23 CO 0.03 -0.43 0.53 0.47 -1.32 0.00 0.00 176.35 175.63 2wv5 n ASP 24 N 5.07 -3.81 0.00 3.68 8.00 -1.26 -3.20 116.55 125.03 2wv5 n ASP 24 Ca -0.04 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.08 2wv5 n ASP 24 Cb 0.42 -3.12 0.00 0.00 -0.02 0.00 0.00 41.12 38.40 2wv5 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wv5 n GLY 25 N -1.26 0.04 3.58 0.44 0.00 -1.26 -4.93 105.19 101.79 2wv5 n GLY 25 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 2wv5 n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wv5 s LYS 26 N -0.86 2.78 -0.39 1.61 0.00 -1.20 -5.07 119.74 116.61 2wv5 s LYS 26 Ca 0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 55.97 55.14 2wv5 s LYS 26 Cb 0.00 -2.60 0.01 0.00 0.00 0.00 0.00 37.83 35.24 2wv5 s LYS 26 CO 0.00 0.65 1.40 0.99 0.00 0.00 0.00 175.35 178.39 2wv5 s THR 27 N -0.77 3.93 -0.06 3.79 2.01 -1.26 -0.63 115.64 122.65 2wv5 s THR 27 Ca 0.12 0.97 0.22 0.00 0.31 0.00 0.00 61.69 63.30 2wv5 s THR 27 Cb -0.11 -4.19 -0.29 0.00 0.01 0.00 0.00 72.50 67.92 2wv5 s THR 27 CO 0.01 -0.71 0.53 1.33 -0.69 0.00 0.00 174.62 175.10 2wv5 n VAL 28 N 6.94 0.15 -3.75 3.82 0.24 0.40 -4.97 118.33 121.16 2wv5 n VAL 28 Ca 0.16 -0.52 -0.13 0.00 -2.04 0.00 0.00 64.34 61.81 2wv5 n VAL 28 Cb 0.48 -0.07 -0.10 0.00 -1.47 0.00 0.00 33.84 32.68 2wv5 n VAL 28 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wv5 s ALA 29 N -3.45 -0.83 -0.03 2.33 0.00 -1.18 -4.96 121.76 113.63 2wv5 s ALA 29 Ca -0.07 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.58 2wv5 s ALA 29 Cb 0.13 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2wv5 s ALA 29 CO 0.89 -0.21 -0.08 0.42 0.00 0.00 0.00 175.76 176.78 2wv5 s ILE 30 N -0.55 0.73 0.00 0.00 1.01 -1.26 -0.36 121.20 120.77 2wv5 s ILE 30 Ca -0.07 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.28 2wv5 s ILE 30 Cb -0.04 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.75 2wv5 s ILE 30 CO 0.02 0.25 0.00 0.00 0.00 0.00 0.00 174.94 175.21 2wv5 s ALA 33 N -3.10 -0.87 -0.31 0.00 0.00 -0.56 -4.49 121.76 112.42 2wv5 s ALA 33 Ca 0.22 1.31 -0.08 0.00 0.00 0.00 0.00 51.96 53.42 2wv5 s ALA 33 Cb 0.04 -0.91 0.01 0.00 0.00 0.00 0.00 23.12 22.26 2wv5 s ALA 33 CO 0.12 -0.35 0.11 0.99 0.00 0.00 0.00 175.76 176.63 2wv5 s THR 34 N 1.62 4.19 -0.01 0.00 2.01 -0.05 -0.87 115.64 122.53 2wv5 s THR 34 Ca -0.07 -0.65 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 2wv5 s THR 34 Cb -0.10 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 2wv5 s THR 34 CO -0.11 0.04 1.12 -0.83 -0.69 0.00 0.00 174.62 174.15 2wv5 s GLY 35 N 1.53 2.45 -0.15 4.40 0.00 -0.48 0.10 107.32 115.18 2wv5 s GLY 35 Ca 0.03 0.65 0.09 0.00 0.00 0.00 0.00 44.72 45.50 2wv5 s GLY 35 CO 0.04 1.98 -0.00 3.33 0.00 0.00 0.00 173.10 178.45 2wv5 n VAL 36 N 4.17 0.95 -3.55 1.40 0.24 -0.93 -4.77 118.33 115.86 2wv5 n VAL 36 Ca 0.09 -0.53 -0.07 0.00 -2.04 0.00 0.00 64.34 61.79 2wv5 n VAL 36 Cb 0.48 -0.76 -0.02 0.00 -1.47 0.00 0.00 33.84 32.07 2wv5 n VAL 36 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2wv5 s PHE 37 N -2.34 -0.25 0.00 6.34 -0.12 -1.23 -0.53 117.98 119.86 2wv5 s PHE 37 Ca -0.11 0.15 0.00 0.00 -0.05 0.00 0.00 56.93 56.92 2wv5 s PHE 37 Cb 0.05 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 42.96 2wv5 s PHE 37 CO 0.52 -0.38 0.00 0.41 -0.05 0.00 0.00 175.22 175.72 2wv5 n GLY 38 N -0.16 2.31 1.01 1.99 0.00 -1.26 0.00 105.19 109.08 2wv5 n GLY 38 Ca -0.04 0.38 0.02 0.00 0.00 0.00 0.00 46.02 46.37 2wv5 n GLY 38 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wv5 n THR 39 N 0.00 1.86 -3.85 2.61 -2.24 -1.26 -1.58 114.28 109.82 2wv5 n THR 39 Ca 0.00 -3.00 -0.36 0.00 -2.27 0.00 0.00 64.05 58.42 2wv5 n THR 39 Cb 0.00 -0.11 -0.08 0.00 -2.10 0.00 0.00 70.33 68.05 2wv5 n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wv5 s ALA 40 N -2.78 3.68 0.05 6.98 0.00 0.10 -1.04 121.76 128.75 2wv5 s ALA 40 Ca 0.39 -0.69 0.05 0.00 0.00 0.00 0.00 51.96 51.71 2wv5 s ALA 40 Cb 0.38 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.44 2wv5 s ALA 40 CO -0.07 0.32 -0.14 0.71 0.00 0.00 0.00 175.76 176.59 2wv5 s TYR 41 N -0.12 1.20 -0.23 0.00 1.51 -0.05 -2.18 117.35 117.47 2wv5 s TYR 41 Ca 0.10 -0.38 -0.19 0.00 -1.01 0.00 0.00 57.07 55.59 2wv5 s TYR 41 Cb -0.12 -0.70 -0.03 0.00 -0.11 0.00 0.00 41.96 41.01 2wv5 s TYR 41 CO 0.00 0.04 0.56 -0.51 -1.11 0.00 0.00 175.55 174.53 2wv5 s LEU 42 N -1.28 4.10 0.19 -1.29 1.43 0.28 0.57 118.68 122.67 2wv5 s LEU 42 Ca 0.00 0.65 0.02 0.00 -1.03 0.00 0.00 54.13 53.78 2wv5 s LEU 42 Cb -0.08 -2.75 -0.05 0.00 0.03 0.00 0.00 46.19 43.34 2wv5 s LEU 42 CO 0.01 -0.27 0.00 0.68 0.23 0.00 0.00 176.35 177.01 2wv5 s VAL 43 N 2.07 0.75 0.24 -1.59 -7.23 0.15 -0.88 120.40 113.91 2wv5 s VAL 43 Ca 0.24 -1.99 -0.30 0.00 -1.81 0.00 0.00 61.98 58.12 2wv5 s VAL 43 Cb -0.16 -2.19 -0.09 0.00 0.56 0.00 0.00 36.38 34.51 2wv5 s VAL 43 CO 0.09 -0.42 1.24 -2.84 -0.31 0.00 0.00 175.10 172.86 2wv5 s PRO 44 N -3.91 4.46 0.13 4.82 0.02 -1.26 -1.36 135.00 137.89 2wv5 s PRO 44 Ca 0.25 2.00 -0.11 0.00 0.02 0.00 0.00 61.00 63.16 2wv5 s PRO 44 Cb 0.06 -3.18 -0.09 0.00 0.02 0.00 0.00 34.50 31.32 2wv5 s PRO 44 CO 0.05 -0.10 1.39 -0.09 -0.33 0.00 0.00 177.00 177.92 2wv5 h ARG 45 N 4.58 0.82 0.00 5.54 2.43 -0.86 -2.92 114.38 123.97 2wv5 h ARG 45 Ca -0.46 -0.56 0.00 0.00 -0.81 0.00 0.00 59.98 58.15 2wv5 h ARG 45 Cb 1.22 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 2wv5 h ARG 45 CO 0.72 1.19 0.00 -2.39 -1.51 0.00 0.00 179.97 177.98 2wv5 n HIS 46 N -3.98 0.00 -0.07 2.20 1.44 -1.26 -1.49 115.22 112.06 2wv5 n HIS 46 Ca -0.05 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.51 2wv5 n HIS 46 Cb 0.66 -0.06 -0.05 0.00 0.12 0.00 0.00 29.99 30.66 2wv5 n HIS 46 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2wv5 h LEU 47 N 0.00 0.81 0.00 2.39 5.85 -1.90 -3.01 115.31 119.44 2wv5 h LEU 47 Ca 0.00 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.18 2wv5 h LEU 47 Cb 0.00 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.80 2wv5 h LEU 47 CO 0.00 1.19 0.00 0.49 -0.34 0.00 0.00 178.44 179.78 2wv5 n PHE 48 N -4.16 0.00 0.13 1.25 3.01 -0.56 -2.36 117.46 114.78 2wv5 n PHE 48 Ca -0.05 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.47 2wv5 n PHE 48 Cb 0.57 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 40.07 2wv5 n PHE 48 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wv5 h ALA 49 N 3.36 0.72 -2.31 4.37 0.00 -1.68 -3.46 119.26 120.26 2wv5 h ALA 49 Ca 0.00 -0.34 -0.49 0.00 0.00 0.00 0.00 54.91 54.08 2wv5 h ALA 49 Cb 0.00 0.02 0.05 0.00 0.00 0.00 0.00 17.79 17.86 2wv5 h ALA 49 CO 0.00 0.43 0.38 -1.21 0.00 0.00 0.00 179.25 178.85 2wv5 s GLU 50 N -3.08 3.45 -0.22 0.00 0.41 -1.00 -5.01 118.70 113.25 2wv5 s GLU 50 Ca 0.03 1.12 -0.24 0.00 -0.41 0.00 0.00 54.97 55.47 2wv5 s GLU 50 Cb 0.07 -2.05 -0.01 0.00 -1.78 0.00 0.00 34.13 30.36 2wv5 s GLU 50 CO 0.75 -0.70 0.79 -1.59 -0.49 0.00 0.00 175.26 174.02 2wv5 s LYS 51 N -4.17 4.21 0.25 1.61 -2.85 -1.26 -5.01 119.74 112.52 2wv5 s LYS 51 Ca 0.62 0.89 -0.14 0.00 -1.00 0.00 0.00 55.97 56.34 2wv5 s LYS 51 Cb -0.14 -3.62 -0.00 0.00 -2.06 0.00 0.00 37.83 32.00 2wv5 s LYS 51 CO 0.37 -0.43 0.51 1.52 0.10 0.00 0.00 175.35 177.42 2wv5 s TYR 52 N 2.55 0.30 0.00 1.78 -0.85 -1.26 -4.83 117.35 115.04 2wv5 s TYR 52 Ca 0.34 -0.68 0.00 0.00 -0.52 0.00 0.00 57.07 56.21 2wv5 s TYR 52 Cb -0.16 0.25 0.00 0.00 0.38 0.00 0.00 41.96 42.43 2wv5 s TYR 52 CO 0.09 -1.03 0.06 -0.40 -1.52 0.00 0.00 175.55 172.75 2wv5 n ASP 53 N -0.40 0.12 -3.69 -0.18 3.85 -0.58 -4.99 116.55 110.67 2wv5 n ASP 53 Ca -0.02 -0.48 -0.10 0.00 -0.71 0.00 0.00 54.79 53.47 2wv5 n ASP 53 Cb 0.62 0.18 -0.10 0.00 -1.35 0.00 0.00 41.12 40.46 2wv5 n ASP 53 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 2wv5 s LYS 54 N -0.18 0.46 -0.27 0.11 1.02 -0.97 -4.77 119.74 115.14 2wv5 s LYS 54 Ca 0.00 0.83 -0.06 0.00 0.02 0.00 0.00 55.97 56.76 2wv5 s LYS 54 Cb 0.00 0.05 0.01 0.00 -0.52 0.00 0.00 37.83 37.36 2wv5 s LYS 54 CO 0.00 -0.14 0.04 0.42 -0.92 0.00 0.00 175.35 174.75 2wv5 s ILE 55 N 1.25 3.73 -0.36 2.17 1.01 0.02 0.08 121.20 129.09 2wv5 s ILE 55 Ca -0.08 -0.69 -0.24 0.00 0.00 0.00 0.00 60.65 59.64 2wv5 s ILE 55 Cb -0.07 -2.88 0.01 0.00 0.01 0.00 0.00 42.46 39.53 2wv5 s ILE 55 CO -0.12 0.16 0.81 -0.04 0.00 0.00 0.00 174.94 175.75 2wv5 s MET 56 N 1.47 3.78 -0.32 2.79 -1.94 0.28 -1.44 119.30 123.92 2wv5 s MET 56 Ca 0.03 0.37 0.02 0.00 -1.71 0.00 0.00 55.69 54.40 2wv5 s MET 56 Cb -0.17 -3.80 0.08 0.00 2.01 0.00 0.00 34.83 32.95 2wv5 s MET 56 CO 0.01 -0.86 0.02 -1.17 -0.01 0.00 0.00 175.02 173.01 2wv5 s LEU 57 N 3.16 4.34 -1.32 -0.03 2.96 -0.73 -0.53 118.68 126.53 2wv5 s LEU 57 Ca 0.33 -1.80 -0.06 0.00 -0.22 0.00 0.00 54.13 52.38 2wv5 s LEU 57 Cb -0.13 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 44.92 2wv5 s LEU 57 CO 0.17 -0.33 0.79 -0.67 -1.32 0.00 0.00 176.35 174.99 2wv5 n ASP 58 N 4.41 -5.82 0.00 3.68 2.03 -0.12 -2.36 116.55 118.37 2wv5 n ASP 58 Ca -0.05 -0.36 0.00 0.00 0.52 0.00 0.00 54.79 54.90 2wv5 n ASP 58 Cb 0.42 -4.55 0.00 0.00 -0.72 0.00 0.00 41.12 36.27 2wv5 n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wv5 n GLY 59 N -1.64 0.83 3.35 0.27 0.00 -1.26 -5.02 105.19 101.72 2wv5 n GLY 59 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2wv5 n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wv5 s ARG 60 N -0.32 2.99 0.05 1.61 3.52 -1.00 -5.08 118.95 120.72 2wv5 s ARG 60 Ca 0.00 -0.94 -0.30 0.00 -0.13 0.00 0.00 55.73 54.36 2wv5 s ARG 60 Cb 0.00 -3.49 -0.05 0.00 -1.56 0.00 0.00 34.95 29.85 2wv5 s ARG 60 CO 0.00 -0.53 1.15 0.00 -0.81 0.00 0.00 175.30 175.11 2wv5 s ALA 61 N 1.51 3.34 0.07 6.12 0.00 -1.26 -1.78 121.76 129.76 2wv5 s ALA 61 Ca 0.02 0.78 0.02 0.00 0.00 0.00 0.00 51.96 52.78 2wv5 s ALA 61 Cb -0.18 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 2wv5 s ALA 61 CO 0.04 -0.40 -0.07 -1.64 0.00 0.00 0.00 175.76 173.69 2wv5 s MET 62 N 1.07 0.66 0.35 0.00 1.00 -0.52 -4.95 119.30 116.90 2wv5 s MET 62 Ca 0.57 -1.04 0.08 0.00 0.00 0.00 0.00 55.69 55.31 2wv5 s MET 62 Cb -0.28 -0.20 -0.05 0.00 0.00 0.00 0.00 34.83 34.30 2wv5 s MET 62 CO 0.29 0.01 0.11 0.95 0.00 0.00 0.00 175.02 176.38 2wv5 s THR 63 N -2.54 2.83 0.55 2.05 -4.23 -1.26 -0.80 115.64 112.23 2wv5 s THR 63 Ca 0.00 -1.77 0.35 0.00 -1.18 0.00 0.00 61.69 59.09 2wv5 s THR 63 Cb -0.02 -2.93 0.52 0.00 1.34 0.00 0.00 72.50 71.41 2wv5 s THR 63 CO -0.03 -0.16 1.82 0.44 -0.54 0.00 0.00 174.62 176.15 2wv5 h ASP 64 N 1.60 0.00 0.12 3.99 3.32 -1.93 0.08 116.42 123.60 2wv5 h ASP 64 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2wv5 h ASP 64 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2wv5 h ASP 64 CO 0.65 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.63 2wv5 n SER 65 N -4.13 0.00 -0.45 6.45 3.41 -1.26 -3.25 113.62 114.39 2wv5 n SER 65 Ca 0.22 -0.61 0.12 0.00 -0.26 0.00 0.00 58.87 58.35 2wv5 n SER 65 Cb 1.15 -0.07 0.22 0.00 -0.26 0.00 0.00 64.21 65.24 2wv5 n SER 65 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2wv5 n ASP 66 N -1.07 1.68 -3.58 4.04 10.43 0.01 -4.96 116.55 123.10 2wv5 n ASP 66 Ca 0.17 -1.32 -0.08 0.00 2.57 0.00 0.00 54.79 56.13 2wv5 n ASP 66 Cb 0.11 0.24 -0.01 0.00 1.84 0.00 0.00 41.12 43.30 2wv5 n ASP 66 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 2wv5 s TYR 67 N -2.38 0.04 0.08 1.24 -0.85 -1.20 -0.87 117.35 113.41 2wv5 s TYR 67 Ca 0.24 -0.54 0.08 0.00 -0.52 0.00 0.00 57.07 56.33 2wv5 s TYR 67 Cb 0.19 0.64 -0.03 0.00 0.38 0.00 0.00 41.96 43.14 2wv5 s TYR 67 CO 0.50 -1.30 -0.21 1.03 -1.52 0.00 0.00 175.55 174.05 2wv5 s ARG 68 N -3.42 1.18 -0.32 -3.49 3.00 0.18 -4.93 118.95 111.15 2wv5 s ARG 68 Ca 0.15 -1.09 0.02 0.00 0.00 0.00 0.00 55.73 54.81 2wv5 s ARG 68 Cb -0.05 -1.40 0.09 0.00 0.00 0.00 0.00 34.95 33.60 2wv5 s ARG 68 CO 0.09 0.33 0.04 0.08 0.00 0.00 0.00 175.30 175.85 2wv5 s VAL 69 N -1.06 1.80 0.14 3.52 1.01 -1.26 -0.80 120.40 123.75 2wv5 s VAL 69 Ca 0.06 -1.92 -0.21 0.00 0.00 0.00 0.00 61.98 59.92 2wv5 s VAL 69 Cb -0.10 -2.28 -0.07 0.00 0.00 0.00 0.00 36.38 33.93 2wv5 s VAL 69 CO 0.03 -0.53 0.67 -0.36 0.00 0.00 0.00 175.10 174.91 2wv5 s PHE 70 N 1.17 3.78 0.18 5.22 0.40 -0.47 -4.90 117.98 123.35 2wv5 s PHE 70 Ca 0.08 1.39 0.07 0.00 -0.60 0.00 0.00 56.93 57.86 2wv5 s PHE 70 Cb -0.19 -2.60 -0.04 0.00 0.51 0.00 0.00 43.02 40.71 2wv5 s PHE 70 CO -0.12 0.49 0.05 -1.21 0.70 0.00 0.00 175.22 175.13 2wv5 s GLU 71 N -1.41 2.59 -0.08 0.44 2.02 -1.26 -1.16 118.70 119.84 2wv5 s GLU 71 Ca 0.35 -1.03 -0.02 0.00 0.02 0.00 0.00 54.97 54.29 2wv5 s GLU 71 Cb -0.19 -2.46 -0.03 0.00 0.10 0.00 0.00 34.13 31.54 2wv5 s GLU 71 CO 0.22 0.46 -0.00 -0.06 0.02 0.00 0.00 175.26 175.89 2wv5 s PHE 72 N -1.77 3.14 -0.15 1.61 0.40 -1.26 -4.99 117.98 114.97 2wv5 s PHE 72 Ca 0.29 0.18 0.01 0.00 -0.60 0.00 0.00 56.93 56.81 2wv5 s PHE 72 Cb -0.09 -1.78 0.00 0.00 0.51 0.00 0.00 43.02 41.66 2wv5 s PHE 72 CO 0.20 0.46 -0.18 -2.00 0.70 0.00 0.00 175.22 174.41 2wv5 s GLU 73 N -0.89 3.14 -0.05 0.44 2.12 -1.26 -0.56 118.70 121.65 2wv5 s GLU 73 Ca 0.13 -0.79 0.05 0.00 0.36 0.00 0.00 54.97 54.72 2wv5 s GLU 73 Cb -0.11 -2.55 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 2wv5 s GLU 73 CO 0.02 0.00 -0.18 0.96 -0.54 0.00 0.00 175.26 175.53 2wv5 s ILE 74 N 0.82 2.76 -0.40 -3.70 -4.36 0.33 -4.83 121.20 111.82 2wv5 s ILE 74 Ca -0.06 -0.83 -0.29 0.00 -0.26 0.00 0.00 60.65 59.21 2wv5 s ILE 74 Cb -0.15 -2.05 0.00 0.00 1.25 0.00 0.00 42.46 41.51 2wv5 s ILE 74 CO -0.01 0.58 1.49 -1.59 0.24 0.00 0.00 174.94 175.66 2wv5 s LYS 75 N -0.63 3.52 -0.35 0.37 0.00 -1.26 -0.05 119.74 121.34 2wv5 s LYS 75 Ca 0.09 1.04 0.01 0.00 0.00 0.00 0.00 55.97 57.12 2wv5 s LYS 75 Cb -0.11 -4.06 0.11 0.00 0.00 0.00 0.00 37.83 33.77 2wv5 s LYS 75 CO 0.00 -1.63 0.11 0.54 0.00 0.00 0.00 175.35 174.37 2wv5 s VAL 76 N 5.74 1.50 -0.84 1.79 0.11 -0.68 -4.83 120.40 123.19 2wv5 s VAL 76 Ca 0.65 -1.96 -0.04 0.00 -2.93 0.00 0.00 61.98 57.70 2wv5 s VAL 76 Cb -0.15 -2.11 -0.05 0.00 -1.53 0.00 0.00 36.38 32.54 2wv5 s VAL 76 CO 0.33 -0.69 0.73 2.29 -3.33 0.00 0.00 175.10 174.44 2wv5 n LYS 77 N 4.39 -2.34 0.00 1.54 0.00 -1.26 -4.06 118.16 116.43 2wv5 n LYS 77 Ca 0.02 0.68 0.00 0.00 -0.00 0.00 0.00 58.31 59.01 2wv5 n LYS 77 Cb 0.41 -4.94 0.00 0.00 -0.00 0.00 0.00 35.03 30.49 2wv5 n LYS 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wv5 n GLY 78 N -1.26 2.20 3.75 2.58 0.00 -1.26 -4.97 105.19 106.23 2wv5 n GLY 78 Ca -0.08 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 2wv5 n GLY 78 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2wv5 s GLN 79 N 0.00 2.91 -0.02 1.61 -2.07 -1.26 -4.93 119.66 115.90 2wv5 s GLN 79 Ca 0.00 1.91 -0.14 0.00 -1.82 0.00 0.00 55.36 55.30 2wv5 s GLN 79 Cb 0.00 -1.94 -0.05 0.00 -1.09 0.00 0.00 33.01 29.92 2wv5 s GLN 79 CO 0.00 -1.27 0.39 -0.51 -1.32 0.00 0.00 175.29 172.58 2wv5 s ASP 80 N -1.50 6.76 0.27 12.60 1.01 -1.26 -1.69 116.67 132.86 2wv5 s ASP 80 Ca 0.78 0.91 0.10 0.00 0.71 0.00 0.00 52.55 55.05 2wv5 s ASP 80 Cb -0.33 -2.24 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 2wv5 s ASP 80 CO 0.35 0.30 -0.17 -0.04 0.21 0.00 0.00 175.17 175.82 2wv5 s MET 81 N -0.88 1.59 -0.36 8.23 -1.94 0.93 -4.88 119.30 121.99 2wv5 s MET 81 Ca 0.23 -1.74 -0.24 0.00 -1.71 0.00 0.00 55.69 52.23 2wv5 s MET 81 Cb -0.16 -1.55 0.01 0.00 2.01 0.00 0.00 34.83 35.14 2wv5 s MET 81 CO 0.12 0.26 0.83 -1.17 -0.01 0.00 0.00 175.02 175.05 2wv5 s LEU 82 N -3.46 4.08 0.49 -0.03 2.96 -1.26 0.12 118.68 121.57 2wv5 s LEU 82 Ca 0.28 0.48 -0.23 0.00 -0.22 0.00 0.00 54.13 54.44 2wv5 s LEU 82 Cb -0.03 -3.11 -0.06 0.00 0.50 0.00 0.00 46.19 43.49 2wv5 s LEU 82 CO 0.13 -0.75 1.27 -0.55 -1.32 0.00 0.00 176.35 175.12 2wv5 s SER 83 N 1.82 5.81 0.00 3.68 0.15 0.28 -4.27 113.70 121.17 2wv5 s SER 83 Ca 0.34 2.55 0.25 0.00 0.70 0.00 0.00 55.95 59.79 2wv5 s SER 83 Cb -0.13 -2.62 1.47 0.00 -1.71 0.00 0.00 66.02 63.03 2wv5 s SER 83 CO 0.17 -1.19 1.87 -0.67 1.20 0.00 0.00 173.24 174.63 2wv5 n ASP 84 N -0.63 0.00 -4.44 5.45 2.03 -1.26 -4.54 116.55 113.17 2wv5 n ASP 84 Ca 0.08 -0.98 -0.44 0.00 0.52 0.00 0.00 54.79 53.98 2wv5 n ASP 84 Cb 0.46 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.79 2wv5 n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wv5 s ALA 85 N -2.00 3.46 0.05 -1.67 0.00 -1.26 -0.15 121.76 120.19 2wv5 s ALA 85 Ca 0.37 -1.80 0.02 0.00 0.00 0.00 0.00 51.96 50.55 2wv5 s ALA 85 Cb 0.17 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 2wv5 s ALA 85 CO 0.28 -1.78 0.06 0.00 0.00 0.00 0.00 175.76 174.32 2wv5 s ALA 86 N 2.14 3.50 -0.28 0.00 0.00 -0.47 -4.07 121.76 122.58 2wv5 s ALA 86 Ca 0.10 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 51.00 2wv5 s ALA 86 Cb -0.20 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.47 2wv5 s ALA 86 CO 0.11 0.72 0.10 -1.17 0.00 0.00 0.00 175.76 175.51 2wv5 s LEU 87 N -2.13 3.72 -0.49 0.00 2.96 -0.31 -0.68 118.68 121.75 2wv5 s LEU 87 Ca 0.26 -0.39 -0.15 0.00 -0.22 0.00 0.00 54.13 53.63 2wv5 s LEU 87 Cb -0.12 -1.94 0.09 0.00 0.50 0.00 0.00 46.19 44.72 2wv5 s LEU 87 CO 0.18 -0.11 0.43 -0.32 -1.32 0.00 0.00 176.35 175.21 2wv5 s MET 88 N 1.60 2.96 -0.41 1.98 -2.45 0.19 -1.37 119.30 121.80 2wv5 s MET 88 Ca 0.05 -1.49 -0.15 0.00 -1.25 0.00 0.00 55.69 52.86 2wv5 s MET 88 Cb -0.16 -4.17 0.02 0.00 1.25 0.00 0.00 34.83 31.76 2wv5 s MET 88 CO 0.04 -1.13 0.30 0.08 1.05 0.00 0.00 175.02 175.36 2wv5 s VAL 89 N 1.61 5.26 0.40 10.11 1.01 0.01 -0.87 120.40 137.93 2wv5 s VAL 89 Ca 0.04 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.13 2wv5 s VAL 89 Cb -0.26 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 2wv5 s VAL 89 CO 0.05 -0.30 1.04 -0.76 0.00 0.00 0.00 175.10 175.13 2wv5 s LEU 90 N 1.68 4.14 -0.01 3.92 1.43 -0.21 -0.65 118.68 128.99 2wv5 s LEU 90 Ca 0.05 2.02 -0.24 0.00 -1.03 0.00 0.00 54.13 54.93 2wv5 s LEU 90 Cb -0.19 -4.19 -0.15 0.00 0.03 0.00 0.00 46.19 41.69 2wv5 s LEU 90 CO 0.10 -0.47 1.08 0.45 0.23 0.00 0.00 176.35 177.74 2wv5 h HIS 91 N 2.51 -0.45 -3.91 0.29 3.86 -1.34 -3.44 115.15 112.66 2wv5 h HIS 91 Ca -0.48 -0.01 -0.69 0.00 -1.16 0.00 0.00 60.37 58.03 2wv5 h HIS 91 Cb 1.21 0.15 -0.22 0.00 1.06 0.00 0.00 27.41 29.61 2wv5 h HIS 91 CO 0.58 -0.12 -0.75 1.03 0.86 0.00 0.00 177.93 179.53 2wv5 s ARG 92 N -4.30 2.52 0.00 2.45 3.00 -1.26 -5.06 118.95 116.29 2wv5 s ARG 92 Ca -0.13 -0.69 0.00 0.00 0.00 0.00 0.00 55.73 54.90 2wv5 s ARG 92 Cb 0.02 -2.42 0.00 0.00 0.00 0.00 0.00 34.95 32.55 2wv5 s ARG 92 CO 0.48 0.62 0.00 0.41 0.00 0.00 0.00 175.30 176.81 2wv5 n GLY 93 N 2.15 0.72 3.62 -3.53 0.00 -1.26 -5.09 105.19 101.79 2wv5 n GLY 93 Ca -0.17 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 2wv5 n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wv5 s ASN 94 N 0.00 6.76 0.37 1.61 0.01 -1.26 -4.91 114.94 117.52 2wv5 s ASN 94 Ca 0.00 0.90 -0.25 0.00 -0.71 0.00 0.00 52.86 52.80 2wv5 s ASN 94 Cb 0.00 -2.54 -0.13 0.00 0.41 0.00 0.00 41.25 38.99 2wv5 s ASN 94 CO 0.00 -1.06 0.78 2.29 -1.51 0.00 0.00 177.10 177.60 2wv5 n LYS 95 N 7.32 0.92 -4.16 -0.60 2.85 -1.26 -4.84 118.16 118.39 2wv5 n LYS 95 Ca 0.13 0.33 -0.24 0.00 -1.05 0.00 0.00 58.31 57.48 2wv5 n LYS 95 Cb 0.48 -1.69 -0.07 0.00 -0.65 0.00 0.00 35.03 33.09 2wv5 n LYS 95 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 2wv5 s VAL 96 N -1.28 2.86 -0.16 0.58 -7.23 -0.61 -5.01 120.40 109.54 2wv5 s VAL 96 Ca 0.62 -1.76 -0.29 0.00 -1.81 0.00 0.00 61.98 58.74 2wv5 s VAL 96 Cb -0.64 -2.94 -0.02 0.00 0.56 0.00 0.00 36.38 33.35 2wv5 s VAL 96 CO 0.58 -0.17 1.33 0.00 -0.31 0.00 0.00 175.10 176.53 2wv5 s ARG 97 N -3.82 4.19 -0.21 4.82 3.03 -1.26 -4.17 118.95 121.53 2wv5 s ARG 97 Ca 0.37 1.70 -0.29 0.00 2.03 0.00 0.00 55.73 59.55 2wv5 s ARG 97 Cb -0.01 -3.81 -0.06 0.00 -1.03 0.00 0.00 34.95 30.04 2wv5 s ARG 97 CO 0.22 -0.77 2.21 -3.47 -1.13 0.00 0.00 175.30 172.36 2wv5 n ASP 98 N 6.81 3.25 -0.12 -2.89 -0.08 -1.26 -4.50 116.55 117.77 2wv5 n ASP 98 Ca 0.15 0.25 0.04 0.00 -1.51 0.00 0.00 54.79 53.72 2wv5 n ASP 98 Cb 0.45 -1.54 0.07 0.00 2.34 0.00 0.00 41.12 42.44 2wv5 n ASP 98 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 2wv5 n ILE 99 N 7.59 1.35 0.10 5.18 -5.35 0.31 -4.75 119.36 123.79 2wv5 n ILE 99 Ca 0.30 -1.45 0.13 0.00 -0.27 0.00 0.00 62.75 61.46 2wv5 n ILE 99 Cb 0.43 0.23 0.64 0.00 -1.74 0.00 0.00 39.64 39.19 2wv5 n ILE 99 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 2wv5 h THR 100 N 0.25 0.88 0.00 7.28 1.35 -1.88 -1.40 112.91 119.39 2wv5 h THR 100 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 2wv5 h THR 100 Cb 0.73 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2wv5 h THR 100 CO 0.01 0.01 0.00 2.29 -0.25 0.00 0.00 175.52 177.58 2wv5 n LYS 101 N -4.46 0.03 -0.19 4.72 2.85 -1.26 -2.02 118.16 117.82 2wv5 n LYS 101 Ca 0.04 0.31 0.11 0.00 -1.05 0.00 0.00 58.31 57.72 2wv5 n LYS 101 Cb 0.33 -1.50 0.26 0.00 -0.65 0.00 0.00 35.03 33.48 2wv5 n LYS 101 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2wv5 n HIS 102 N -1.46 0.51 -2.90 5.58 8.25 -0.53 -4.89 115.22 119.78 2wv5 n HIS 102 Ca 0.03 -0.26 -0.19 0.00 -0.26 0.00 0.00 57.72 57.04 2wv5 n HIS 102 Cb 0.10 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.25 2wv5 n HIS 102 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wv5 s PHE 103 N -1.49 2.41 0.33 4.41 0.40 -0.85 -1.16 117.98 122.03 2wv5 s PHE 103 Ca 0.37 -0.38 0.05 0.00 -0.60 0.00 0.00 56.93 56.38 2wv5 s PHE 103 Cb 0.21 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 41.23 2wv5 s PHE 103 CO 0.29 -0.79 0.22 1.03 0.70 0.00 0.00 175.22 176.67 2wv5 s ARG 104 N -4.57 1.72 0.00 0.44 0.52 -1.26 -4.72 118.95 111.08 2wv5 s ARG 104 Ca 0.58 -2.01 0.17 0.00 -0.52 0.00 0.00 55.73 53.95 2wv5 s ARG 104 Cb -0.09 0.07 0.26 0.00 0.52 0.00 0.00 34.95 35.71 2wv5 s ARG 104 CO 0.36 -0.57 1.18 -0.25 0.02 0.00 0.00 175.30 176.04 2wv5 n ASP 105 N -1.31 2.81 -3.86 0.23 8.00 -1.26 -0.63 116.55 120.53 2wv5 n ASP 105 Ca 0.03 -1.82 -0.10 0.00 0.71 0.00 0.00 54.79 53.61 2wv5 n ASP 105 Cb 0.63 -0.13 -0.08 0.00 -0.02 0.00 0.00 41.12 41.52 2wv5 n ASP 105 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2wv5 s THR 106 N -1.29 0.12 -0.65 -3.53 -4.23 -1.26 -4.97 115.64 99.84 2wv5 s THR 106 Ca 0.26 -1.01 -0.05 0.00 -1.18 0.00 0.00 61.69 59.71 2wv5 s THR 106 Cb 0.16 -1.05 -0.07 0.00 1.34 0.00 0.00 72.50 72.88 2wv5 s THR 106 CO 0.23 -0.56 2.04 0.00 -0.54 0.00 0.00 174.62 175.79 2wv5 n ALA 107 N 0.46 4.25 0.28 3.99 0.00 -1.26 -4.56 120.51 123.67 2wv5 n ALA 107 Ca -0.18 -1.62 0.09 0.00 0.00 0.00 0.00 53.44 51.73 2wv5 n ALA 107 Cb 0.60 -2.80 0.46 0.00 0.00 0.00 0.00 19.45 17.71 2wv5 n ALA 107 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2wv5 h ARG 108 N 6.00 0.00 -6.70 0.00 9.65 -1.99 -3.44 114.38 117.90 2wv5 h ARG 108 Ca 0.37 0.00 -0.53 0.00 -1.10 0.00 0.00 59.98 58.72 2wv5 h ARG 108 Cb 0.29 0.00 0.22 0.00 -1.39 0.00 0.00 29.97 29.09 2wv5 h ARG 108 CO 1.17 0.00 -0.74 -1.33 2.80 0.00 0.00 179.97 181.87 2wv5 n MET 109 N -2.52 -0.35 -3.65 0.20 2.81 -1.26 -4.94 117.12 107.40 2wv5 n MET 109 Ca -0.01 -0.07 -0.28 0.00 -1.81 0.00 0.00 57.70 55.53 2wv5 n MET 109 Cb 0.55 -1.76 -0.16 0.00 -0.71 0.00 0.00 33.22 31.13 2wv5 n MET 109 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 2wv5 s LYS 110 N -3.47 0.37 0.03 0.03 0.00 -1.26 -5.11 119.74 110.34 2wv5 s LYS 110 Ca 0.55 -0.44 -0.13 0.00 0.00 0.00 0.00 55.97 55.95 2wv5 s LYS 110 Cb -0.20 -1.78 -0.07 0.00 0.00 0.00 0.00 37.83 35.78 2wv5 s LYS 110 CO 0.69 -0.79 0.31 1.17 0.00 0.00 0.00 175.35 176.73 2wv5 n LYS 111 N 5.14 0.00 -0.10 1.78 4.81 -1.26 -2.00 118.16 126.53 2wv5 n LYS 111 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 2wv5 n LYS 111 Cb 0.46 -0.49 0.00 0.00 0.02 0.00 0.00 35.03 35.02 2wv5 n LYS 111 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wv5 n GLY 112 N 0.66 1.47 3.85 3.14 0.00 0.21 -4.93 105.19 109.59 2wv5 n GLY 112 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2wv5 n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wv5 s THR 113 N -2.64 4.62 0.21 2.61 -4.23 -0.85 -4.52 115.64 110.84 2wv5 s THR 113 Ca 0.00 1.02 -0.31 0.00 -1.18 0.00 0.00 61.69 61.21 2wv5 s THR 113 Cb 0.00 -3.69 -0.15 0.00 1.34 0.00 0.00 72.50 69.99 2wv5 s THR 113 CO 0.00 -0.52 1.09 -2.65 -0.54 0.00 0.00 174.62 172.00 2wv5 n PRO 114 N -1.20 1.16 -4.00 3.99 -0.02 -1.26 -1.08 135.00 132.59 2wv5 n PRO 114 Ca 0.05 0.41 -0.19 0.00 -2.02 0.00 0.00 63.50 61.75 2wv5 n PRO 114 Cb 0.54 -1.85 -0.17 0.00 -0.02 0.00 0.00 33.50 32.00 2wv5 n PRO 114 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wv5 s VAL 115 N -0.47 0.36 -0.12 -1.45 1.01 -0.47 -3.03 120.40 116.23 2wv5 s VAL 115 Ca 0.69 0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.69 2wv5 s VAL 115 Cb -0.81 -0.44 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 2wv5 s VAL 115 CO 0.55 0.20 -0.18 -0.69 0.00 0.00 0.00 175.10 174.98 2wv5 s VAL 116 N 1.17 2.58 -0.10 2.92 1.01 -0.36 -1.80 120.40 125.82 2wv5 s VAL 116 Ca -0.07 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 2wv5 s VAL 116 Cb -0.14 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 2wv5 s VAL 116 CO -0.02 0.54 0.00 -0.83 0.00 0.00 0.00 175.10 174.80 2wv5 s GLY 117 N 0.42 1.85 -0.20 4.51 0.00 0.12 -0.46 107.32 113.56 2wv5 s GLY 117 Ca -0.13 -0.80 -0.03 0.00 0.00 0.00 0.00 44.72 43.75 2wv5 s GLY 117 CO 0.06 -0.50 -0.05 0.14 0.00 0.00 0.00 173.10 172.75 2wv5 s VAL 118 N -0.74 3.47 0.29 1.40 1.01 0.15 -1.42 120.40 124.55 2wv5 s VAL 118 Ca 0.12 -0.48 0.11 0.00 0.00 0.00 0.00 61.98 61.73 2wv5 s VAL 118 Cb -0.12 -2.55 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 2wv5 s VAL 118 CO 0.02 0.44 -0.17 -0.69 0.00 0.00 0.00 175.10 174.71 2wv5 s VAL 119 N 1.13 2.31 -0.31 2.92 1.01 -0.44 -3.17 120.40 123.86 2wv5 s VAL 119 Ca 0.02 -2.33 -0.11 0.00 0.00 0.00 0.00 61.98 59.55 2wv5 s VAL 119 Cb -0.15 -2.35 0.19 0.00 0.00 0.00 0.00 36.38 34.07 2wv5 s VAL 119 CO -0.01 -0.37 1.07 0.21 0.00 0.00 0.00 175.10 176.00 2wv5 s ASN 120 N -3.51 -0.31 0.34 3.32 2.47 -1.20 -2.73 114.94 113.32 2wv5 s ASN 120 Ca 0.30 -0.04 0.01 0.00 0.42 0.00 0.00 52.86 53.54 2wv5 s ASN 120 Cb -0.03 0.85 -0.00 0.00 -1.45 0.00 0.00 41.25 40.62 2wv5 s ASN 120 CO 0.14 -0.05 0.43 -0.46 -3.72 0.00 0.00 177.10 173.45 2wv5 n ASN 121 N 4.48 -1.18 0.00 -4.21 0.23 -0.93 -2.57 115.26 111.08 2wv5 n ASN 121 Ca 0.08 -2.94 0.10 0.00 -0.53 0.00 0.00 54.58 51.28 2wv5 n ASN 121 Cb 0.60 2.30 0.48 0.00 -2.08 0.00 0.00 39.78 41.08 2wv5 n ASN 121 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2wv5 n ALA 122 N -0.73 2.02 -0.03 -2.53 0.00 -1.26 -1.40 120.51 116.57 2wv5 n ALA 122 Ca -0.13 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.01 2wv5 n ALA 122 Cb 0.58 -1.32 -0.13 0.00 0.00 0.00 0.00 19.45 18.58 2wv5 n ALA 122 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2wv5 n ASP 123 N -1.34 2.04 -0.18 0.00 2.03 -1.26 -4.73 116.55 113.11 2wv5 n ASP 123 Ca 0.08 0.27 0.01 0.00 0.52 0.00 0.00 54.79 55.67 2wv5 n ASP 123 Cb 0.18 -0.89 0.01 0.00 -0.72 0.00 0.00 41.12 39.70 2wv5 n ASP 123 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2wv5 n VAL 124 N -3.79 0.21 -4.40 5.18 0.24 -1.24 -5.13 118.33 109.40 2wv5 n VAL 124 Ca -0.33 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 2wv5 n VAL 124 Cb 0.93 0.70 0.00 0.00 -1.47 0.00 0.00 33.84 34.00 2wv5 n VAL 124 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wv5 n GLY 125 N -0.13 2.53 3.75 7.63 0.00 -0.49 -4.60 105.19 113.87 2wv5 n GLY 125 Ca 0.01 -0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 2wv5 n GLY 125 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wv5 s ARG 126 N 0.00 4.21 0.07 1.61 0.52 -1.26 -2.18 118.95 121.92 2wv5 s ARG 126 Ca 0.00 0.26 -0.19 0.00 -0.52 0.00 0.00 55.73 55.28 2wv5 s ARG 126 Cb 0.00 -3.39 0.04 0.00 0.52 0.00 0.00 34.95 32.12 2wv5 s ARG 126 CO 0.00 0.30 0.45 -1.17 0.02 0.00 0.00 175.30 174.89 2wv5 s LEU 127 N 0.24 0.23 -0.03 2.53 0.20 -1.10 -4.99 118.68 115.75 2wv5 s LEU 127 Ca 0.21 -0.04 0.03 0.00 0.69 0.00 0.00 54.13 55.01 2wv5 s LEU 127 Cb -0.14 1.91 0.00 0.00 -0.43 0.00 0.00 46.19 47.53 2wv5 s LEU 127 CO 0.07 -0.75 -0.11 -0.63 -0.29 0.00 0.00 176.35 174.65 2wv5 s ILE 128 N -2.91 0.94 0.01 6.68 -1.09 -1.26 -1.33 121.20 122.24 2wv5 s ILE 128 Ca -0.03 -0.44 0.09 0.00 -2.23 0.00 0.00 60.65 58.04 2wv5 s ILE 128 Cb -0.00 -0.83 -0.02 0.00 -1.58 0.00 0.00 42.46 40.03 2wv5 s ILE 128 CO -0.05 0.29 -0.26 0.72 -1.23 0.00 0.00 174.94 174.40 2wv5 s PHE 129 N 0.18 2.32 0.26 3.97 -0.12 -0.51 -4.93 117.98 119.15 2wv5 s PHE 129 Ca -0.04 -0.43 0.11 0.00 -0.05 0.00 0.00 56.93 56.53 2wv5 s PHE 129 Cb -0.09 -1.44 -0.05 0.00 -0.63 0.00 0.00 43.02 40.80 2wv5 s PHE 129 CO 0.01 0.04 -0.14 -1.54 -0.05 0.00 0.00 175.22 173.53 2wv5 s SER 130 N -0.91 3.88 0.00 1.98 1.04 -1.26 0.11 113.70 118.55 2wv5 s SER 130 Ca 0.11 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.66 2wv5 s SER 130 Cb -0.10 -0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.55 2wv5 s SER 130 CO 0.00 0.04 0.00 0.61 0.98 0.00 0.00 173.24 174.88 2wv5 n GLY 131 N -0.56 0.50 3.67 7.32 0.00 -0.74 -4.50 105.19 110.87 2wv5 n GLY 131 Ca -0.07 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 44.86 2wv5 n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wv5 s GLU 132 N -1.33 2.85 0.10 1.61 2.02 -0.43 -1.37 118.70 122.15 2wv5 s GLU 132 Ca 0.00 -0.53 -0.31 0.00 0.02 0.00 0.00 54.97 54.16 2wv5 s GLU 132 Cb 0.00 -2.70 -0.07 0.00 0.10 0.00 0.00 34.13 31.46 2wv5 s GLU 132 CO 0.00 0.66 1.32 0.00 0.02 0.00 0.00 175.26 177.26 2wv5 s ALA 133 N -0.97 3.52 0.00 5.21 0.00 -0.24 0.43 121.76 129.70 2wv5 s ALA 133 Ca 0.16 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.14 2wv5 s ALA 133 Cb -0.11 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2wv5 s ALA 133 CO 0.06 -0.54 0.00 1.28 0.00 0.00 0.00 175.76 176.56 2wv5 n LEU 134 N 3.89 0.00 0.00 0.00 4.77 0.15 0.65 117.00 126.45 2wv5 n LEU 134 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2wv5 n LEU 134 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2wv5 n LEU 134 CO 0.57 0.00 0.00 0.35 -1.33 0.00 0.00 177.39 176.98 2wv5 n THR 135 N 0.00 0.00 -3.26 -5.08 -2.24 -1.22 -4.07 114.28 98.40 2wv5 n THR 135 Ca 0.00 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.51 2wv5 n THR 135 Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 2wv5 n THR 135 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2wv5 s TYR 136 N -1.74 3.50 -0.13 4.78 5.04 -1.26 -0.41 117.35 127.12 2wv5 s TYR 136 Ca 0.00 0.56 -0.04 0.00 -2.44 0.00 0.00 57.07 55.15 2wv5 s TYR 136 Cb 0.00 -2.05 0.05 0.00 0.35 0.00 0.00 41.96 40.31 2wv5 s TYR 136 CO 0.00 0.09 0.09 0.15 -1.34 0.00 0.00 175.55 174.54 2wv5 s LYS 137 N -3.99 0.02 0.08 4.97 -0.14 -0.43 -4.86 119.74 115.39 2wv5 s LYS 137 Ca 0.43 0.09 -0.29 0.00 -1.36 0.00 0.00 55.97 54.84 2wv5 s LYS 137 Cb -0.10 -1.35 -0.17 0.00 -1.68 0.00 0.00 37.83 34.53 2wv5 s LYS 137 CO 0.34 -0.55 1.66 -0.44 -0.76 0.00 0.00 175.35 175.60 2wv5 h ASP 138 N 8.42 -0.56 -3.55 2.83 3.45 -1.95 -1.37 116.42 123.69 2wv5 h ASP 138 Ca -0.14 0.03 -0.33 0.00 0.43 0.00 0.00 57.03 57.02 2wv5 h ASP 138 Cb 1.14 0.16 -0.33 0.00 -0.56 0.00 0.00 39.33 39.74 2wv5 h ASP 138 CO 0.24 -0.38 -0.74 -0.63 -1.57 0.00 0.00 179.24 176.16 2wv5 s ILE 139 N -6.09 0.18 0.10 0.35 1.01 -1.26 0.64 121.20 116.12 2wv5 s ILE 139 Ca -0.16 0.05 0.09 0.00 0.00 0.00 0.00 60.65 60.63 2wv5 s ILE 139 Cb 0.05 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.23 2wv5 s ILE 139 CO 0.63 0.13 -0.19 -0.69 0.00 0.00 0.00 174.94 174.82 2wv5 s VAL 140 N 0.83 2.74 -0.35 2.92 1.01 -0.92 -5.02 120.40 121.61 2wv5 s VAL 140 Ca -0.08 -1.44 -0.02 0.00 0.00 0.00 0.00 61.98 60.44 2wv5 s VAL 140 Cb -0.12 -2.22 0.08 0.00 0.00 0.00 0.00 36.38 34.12 2wv5 s VAL 140 CO -0.01 0.17 0.08 -0.69 0.00 0.00 0.00 175.10 174.65 2wv5 s VAL 141 N -1.06 3.08 0.63 2.92 1.01 -1.26 -2.83 120.40 122.88 2wv5 s VAL 141 Ca 0.16 -1.70 -0.14 0.00 0.00 0.00 0.00 61.98 60.31 2wv5 s VAL 141 Cb -0.10 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 2wv5 s VAL 141 CO 0.08 -0.37 1.05 -0.76 0.00 0.00 0.00 175.10 175.11 2wv5 s LEU 142 N 1.19 3.36 0.18 3.92 1.43 -1.13 -4.94 118.68 122.70 2wv5 s LEU 142 Ca 0.01 1.71 -0.26 0.00 -1.03 0.00 0.00 54.13 54.57 2wv5 s LEU 142 Cb -0.21 -4.52 0.05 0.00 0.03 0.00 0.00 46.19 41.54 2wv5 s LEU 142 CO -0.03 -1.22 1.55 -0.03 0.23 0.00 0.00 176.35 176.85 2wv5 h MET 143 N 0.02 -0.06 0.00 1.70 1.85 -1.99 0.96 114.93 117.41 2wv5 h MET 143 Ca -0.46 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.64 2wv5 h MET 143 Cb 1.21 0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.26 2wv5 h MET 143 CO 0.58 -0.04 0.00 -0.40 -0.40 0.00 0.00 176.91 176.65 2wv5 n ASP 144 N -5.35 0.00 0.00 1.39 5.75 -1.26 -4.74 116.55 112.34 2wv5 n ASP 144 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.82 2wv5 n ASP 144 Cb 0.32 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 2wv5 n ASP 144 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wv5 n GLY 145 N -0.89 1.51 3.66 6.12 0.00 0.33 -5.04 105.19 110.89 2wv5 n GLY 145 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2wv5 n GLY 145 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wv5 n ASP 146 N 0.00 -0.70 -3.70 1.61 -0.08 -1.25 -4.86 116.55 107.56 2wv5 n ASP 146 Ca 0.00 -1.36 -0.11 0.00 -1.51 0.00 0.00 54.79 51.82 2wv5 n ASP 146 Cb 0.00 -1.00 -0.11 0.00 2.34 0.00 0.00 41.12 42.35 2wv5 n ASP 146 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2wv5 s THR 147 N -3.52 -0.03 -0.02 5.18 2.01 -1.26 -2.84 115.64 115.16 2wv5 s THR 147 Ca 0.73 0.09 0.05 0.00 0.31 0.00 0.00 61.69 62.87 2wv5 s THR 147 Cb -0.04 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 71.86 2wv5 s THR 147 CO 0.53 0.04 -0.16 -0.04 -0.69 0.00 0.00 174.62 174.30 2wv5 s MET 148 N 1.31 2.36 0.56 4.92 1.00 -1.13 -5.00 119.30 123.32 2wv5 s MET 148 Ca -0.09 -0.79 -0.01 0.00 0.00 0.00 0.00 55.69 54.80 2wv5 s MET 148 Cb -0.08 -2.30 0.03 0.00 0.00 0.00 0.00 34.83 32.47 2wv5 s MET 148 CO -0.11 0.59 0.81 -1.25 0.00 0.00 0.00 175.02 175.06 2wv5 s PRO 149 N -0.96 2.64 -0.23 2.03 0.04 -1.26 -2.17 135.00 135.09 2wv5 s PRO 149 Ca 0.13 -0.54 -0.03 0.00 0.04 0.00 0.00 61.00 60.59 2wv5 s PRO 149 Cb -0.11 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 32.01 2wv5 s PRO 149 CO 0.02 -0.70 0.19 0.41 0.04 0.00 0.00 177.00 176.96 2wv5 n GLY 150 N -2.41 -0.30 3.81 0.56 0.00 0.21 -4.63 105.19 102.43 2wv5 n GLY 150 Ca 0.06 0.23 -0.22 0.00 0.00 0.00 0.00 46.02 46.09 2wv5 n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wv5 s LEU 151 N -2.41 3.31 -0.11 0.99 1.43 -0.52 -2.13 118.68 119.24 2wv5 s LEU 151 Ca 0.03 -0.83 -0.00 0.00 -1.03 0.00 0.00 54.13 52.30 2wv5 s LEU 151 Cb -0.00 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.40 2wv5 s LEU 151 CO 0.28 -0.55 -0.08 0.12 0.23 0.00 0.00 176.35 176.35 2wv5 s PHE 152 N -2.49 1.54 0.46 0.29 5.36 -0.47 -1.31 117.98 121.35 2wv5 s PHE 152 Ca 0.44 -0.78 -0.14 0.00 -0.96 0.00 0.00 56.93 55.50 2wv5 s PHE 152 Cb -0.01 -1.26 -0.07 0.00 -0.34 0.00 0.00 43.02 41.33 2wv5 s PHE 152 CO 0.25 -0.52 0.88 0.00 -1.46 0.00 0.00 175.22 174.37 2wv5 s ALA 153 N 1.66 3.20 -0.10 11.12 0.00 0.45 -2.76 121.76 135.33 2wv5 s ALA 153 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.70 2wv5 s ALA 153 Cb -0.13 -2.92 0.11 0.00 0.00 0.00 0.00 23.12 20.18 2wv5 s ALA 153 CO -0.08 -0.11 0.88 1.52 0.00 0.00 0.00 175.76 177.96 2wv5 s TYR 154 N -2.49 -0.47 -0.55 0.00 -0.85 -0.78 0.31 117.35 112.53 2wv5 s TYR 154 Ca 0.55 0.75 -0.24 0.00 -0.52 0.00 0.00 57.07 57.61 2wv5 s TYR 154 Cb -0.10 0.45 0.04 0.00 0.38 0.00 0.00 41.96 42.73 2wv5 s TYR 154 CO 0.31 -0.46 0.95 0.15 -1.52 0.00 0.00 175.55 174.99 2wv5 s LYS 155 N -1.36 3.35 0.00 -3.49 3.01 0.17 -0.09 119.74 121.34 2wv5 s LYS 155 Ca -0.04 -0.21 -0.28 0.00 -1.01 0.00 0.00 55.97 54.42 2wv5 s LYS 155 Cb -0.00 -4.04 0.08 0.00 -1.01 0.00 0.00 37.83 32.85 2wv5 s LYS 155 CO 0.03 -1.48 0.70 0.00 0.51 0.00 0.00 175.35 175.11 2wv5 s ALA 156 N 3.99 -1.74 -0.73 5.17 0.00 -1.14 -1.32 121.76 126.00 2wv5 s ALA 156 Ca 0.31 1.08 -0.22 0.00 0.00 0.00 0.00 51.96 53.14 2wv5 s ALA 156 Cb -0.12 0.22 0.08 0.00 0.00 0.00 0.00 23.12 23.30 2wv5 s ALA 156 CO 0.20 -0.50 1.01 0.00 0.00 0.00 0.00 175.76 176.46 2wv5 s ALA 157 N -2.06 3.16 0.33 0.00 0.00 -1.26 -4.06 121.76 117.88 2wv5 s ALA 157 Ca -0.06 -2.06 0.07 0.00 0.00 0.00 0.00 51.96 49.92 2wv5 s ALA 157 Cb -0.00 -3.91 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 2wv5 s ALA 157 CO 0.01 -2.84 0.29 0.95 0.00 0.00 0.00 175.76 174.17 2wv5 s THR 158 N 3.77 3.55 0.22 0.00 -4.23 -1.26 -4.98 115.64 112.71 2wv5 s THR 158 Ca 0.25 -1.38 -0.05 0.00 -1.18 0.00 0.00 61.69 59.33 2wv5 s THR 158 Cb -0.14 -3.19 -0.03 0.00 1.34 0.00 0.00 72.50 70.49 2wv5 s THR 158 CO 0.05 -0.18 0.26 -0.13 -0.54 0.00 0.00 174.62 174.09 2wv5 s ARG 159 N -3.99 1.36 0.18 3.99 0.52 -1.26 -4.90 118.95 114.85 2wv5 s ARG 159 Ca 0.41 -1.52 -0.30 0.00 -0.52 0.00 0.00 55.73 53.79 2wv5 s ARG 159 Cb -0.06 0.34 -0.08 0.00 0.52 0.00 0.00 34.95 35.68 2wv5 s ARG 159 CO 0.26 -0.50 1.25 0.00 0.02 0.00 0.00 175.30 176.33 2wv5 s ALA 160 N -4.05 3.47 0.00 2.13 0.00 -1.26 -2.64 121.76 119.41 2wv5 s ALA 160 Ca 0.33 1.01 0.00 0.00 0.00 0.00 0.00 51.96 53.30 2wv5 s ALA 160 Cb 0.04 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2wv5 s ALA 160 CO 0.12 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.84 2wv5 n GLY 161 N 2.35 1.70 0.18 0.00 0.00 -1.26 -4.94 105.19 103.22 2wv5 n GLY 161 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2wv5 n GLY 161 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2wv5 h TYR 162 N 0.00 0.00 -2.92 1.61 -1.99 -1.81 -3.32 116.97 108.54 2wv5 h TYR 162 Ca 0.00 0.00 -0.58 0.00 2.00 0.00 0.00 58.73 60.15 2wv5 h TYR 162 Cb 0.00 0.00 0.10 0.00 2.00 0.00 0.00 36.73 38.83 2wv5 h TYR 162 CO 0.00 0.00 0.54 0.00 -0.00 0.00 0.00 178.16 178.70 2wv5 n ALA 163 N -1.96 1.09 -0.21 3.88 0.00 -1.26 -2.33 120.51 119.73 2wv5 n ALA 163 Ca 0.04 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2wv5 n ALA 163 Cb 0.44 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.64 2wv5 n ALA 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wv5 n GLY 164 N 1.52 0.70 3.83 0.00 0.00 0.16 -0.87 105.19 110.52 2wv5 n GLY 164 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2wv5 n GLY 164 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wv5 s GLY 165 N -1.48 2.57 0.52 -0.02 0.00 -0.98 -3.19 107.32 104.75 2wv5 s GLY 165 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 44.72 44.47 2wv5 s GLY 165 CO 0.00 0.31 1.10 0.00 0.00 0.00 0.00 173.10 174.51 2wv5 s ALA 166 N -1.24 2.75 -0.12 3.20 0.00 -1.19 -1.02 121.76 124.15 2wv5 s ALA 166 Ca 0.32 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.03 2wv5 s ALA 166 Cb -0.18 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.64 2wv5 s ALA 166 CO 0.18 -0.62 -0.10 0.08 0.00 0.00 0.00 175.76 175.30 2wv5 s VAL 167 N -1.85 1.23 -0.02 0.00 1.01 -0.95 0.32 120.40 120.14 2wv5 s VAL 167 Ca 0.71 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 62.27 2wv5 s VAL 167 Cb -0.21 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 2wv5 s VAL 167 CO 0.25 0.40 -0.02 -1.48 0.00 0.00 0.00 175.10 174.25 2wv5 s LEU 168 N 1.55 3.41 0.31 3.92 2.34 0.40 0.68 118.68 131.28 2wv5 s LEU 168 Ca 0.03 -0.01 0.11 0.00 0.06 0.00 0.00 54.13 54.32 2wv5 s LEU 168 Cb -0.13 -1.90 -0.05 0.00 -0.56 0.00 0.00 46.19 43.54 2wv5 s LEU 168 CO -0.08 0.31 -0.12 0.00 -1.06 0.00 0.00 176.35 175.40 2wv5 s ALA 169 N -1.00 2.92 -1.03 1.48 0.00 -0.52 -1.23 121.76 122.38 2wv5 s ALA 169 Ca 0.17 -1.93 -0.04 0.00 0.00 0.00 0.00 51.96 50.16 2wv5 s ALA 169 Cb -0.11 -0.27 0.29 0.00 0.00 0.00 0.00 23.12 23.02 2wv5 s ALA 169 CO 0.07 0.19 1.23 1.63 0.00 0.00 0.00 175.76 178.88 2wv5 n LYS 170 N -0.75 3.82 -1.67 0.00 4.76 -1.17 -1.09 118.16 122.06 2wv5 n LYS 170 Ca -0.05 -4.53 -0.39 0.00 -2.87 0.00 0.00 58.31 50.47 2wv5 n LYS 170 Cb 0.61 -2.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.28 2wv5 n LYS 170 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wv5 s ASP 171 N -0.74 4.99 1.90 4.39 2.15 0.31 -4.59 116.67 125.09 2wv5 s ASP 171 Ca 0.31 1.28 0.00 0.00 0.43 0.00 0.00 52.55 54.57 2wv5 s ASP 171 Cb -0.00 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 2wv5 s ASP 171 CO 0.01 -2.42 0.00 0.61 -0.17 0.00 0.00 175.17 173.20 2wv5 n GLY 172 N 5.84 4.13 0.12 2.66 0.00 -1.26 -1.54 105.19 115.14 2wv5 n GLY 172 Ca 0.31 0.11 -0.18 0.00 0.00 0.00 0.00 46.02 46.26 2wv5 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wv5 h ALA 173 N -0.95 0.50 -2.41 4.61 0.00 -2.01 -3.47 119.26 115.52 2wv5 h ALA 173 Ca 0.00 -1.38 -0.49 0.00 0.00 0.00 0.00 54.91 53.04 2wv5 h ALA 173 Cb 0.00 0.61 0.07 0.00 0.00 0.00 0.00 17.79 18.47 2wv5 h ALA 173 CO 0.00 1.36 0.39 0.16 0.00 0.00 0.00 179.25 181.16 2wv5 s ASP 174 N -6.81 5.72 0.21 0.00 -4.77 -0.59 -5.02 116.67 105.41 2wv5 s ASP 174 Ca -0.17 1.94 0.08 0.00 -3.30 0.00 0.00 52.55 51.10 2wv5 s ASP 174 Cb 0.07 -2.55 -0.04 0.00 -1.09 0.00 0.00 42.92 39.31 2wv5 s ASP 174 CO 0.79 -1.21 0.03 -0.89 0.70 0.00 0.00 175.17 174.59 2wv5 s THR 175 N -2.22 3.78 -0.19 2.11 2.01 -1.26 -0.53 115.64 119.35 2wv5 s THR 175 Ca 0.67 -1.54 -0.23 0.00 0.31 0.00 0.00 61.69 60.90 2wv5 s THR 175 Cb -0.18 -2.96 0.06 0.00 0.01 0.00 0.00 72.50 69.43 2wv5 s THR 175 CO 0.33 -0.22 0.61 0.72 -0.69 0.00 0.00 174.62 175.37 2wv5 s PHE 176 N -1.96 -0.64 -0.22 4.92 -0.12 -0.25 -4.88 117.98 114.83 2wv5 s PHE 176 Ca 0.29 1.48 -0.29 0.00 -0.05 0.00 0.00 56.93 58.36 2wv5 s PHE 176 Cb -0.08 0.25 -0.03 0.00 -0.63 0.00 0.00 43.02 42.53 2wv5 s PHE 176 CO 0.20 -0.38 1.59 0.42 -0.05 0.00 0.00 175.22 177.01 2wv5 s ILE 177 N -0.03 3.72 -0.03 -4.49 1.01 -0.31 -1.44 121.20 119.64 2wv5 s ILE 177 Ca -0.03 0.82 -0.24 0.00 0.00 0.00 0.00 60.65 61.20 2wv5 s ILE 177 Cb -0.04 -3.73 -0.21 0.00 0.01 0.00 0.00 42.46 38.50 2wv5 s ILE 177 CO 0.03 -0.30 1.16 0.58 0.00 0.00 0.00 174.94 176.40 2wv5 h VAL 178 N 6.12 1.47 0.00 2.92 2.07 -0.06 -3.40 116.25 125.37 2wv5 h VAL 178 Ca -0.33 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.59 2wv5 h VAL 178 Cb 1.15 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 33.34 2wv5 h VAL 178 CO 1.00 0.44 0.00 0.61 0.02 0.00 0.00 177.57 179.64 2wv5 n GLY 179 N 0.65 -1.14 3.90 2.17 0.00 -1.25 -1.94 105.19 107.59 2wv5 n GLY 179 Ca -0.09 -1.06 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 2wv5 n GLY 179 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wv5 s THR 180 N -3.00 5.12 -0.03 2.61 -4.23 -0.73 -2.24 115.64 113.14 2wv5 s THR 180 Ca 0.00 0.08 -0.30 0.00 -1.18 0.00 0.00 61.69 60.29 2wv5 s THR 180 Cb 0.00 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 2wv5 s THR 180 CO 0.00 -0.02 1.23 -2.28 -0.54 0.00 0.00 174.62 173.01 2wv5 s HIS 181 N -1.73 3.18 -0.02 3.99 2.46 -0.19 0.34 115.29 123.33 2wv5 s HIS 181 Ca 0.42 1.17 -0.04 0.00 0.47 0.00 0.00 55.06 57.09 2wv5 s HIS 181 Cb -0.12 -3.45 -0.02 0.00 -0.13 0.00 0.00 32.58 28.86 2wv5 s HIS 181 CO 0.25 -1.46 -0.08 0.43 -2.47 0.00 0.00 174.74 171.40 2wv5 n SER 182 N 5.03 0.82 -4.46 9.88 7.64 0.07 0.37 113.62 132.96 2wv5 n SER 182 Ca 0.11 0.12 -0.26 0.00 1.01 0.00 0.00 58.87 59.85 2wv5 n SER 182 Cb 0.46 -0.29 -0.10 0.00 -1.01 0.00 0.00 64.21 63.27 2wv5 n SER 182 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wv5 s ALA 183 N -2.15 2.96 -0.03 -0.43 0.00 -0.74 -4.75 121.76 116.61 2wv5 s ALA 183 Ca -0.08 -1.63 -0.30 0.00 0.00 0.00 0.00 51.96 49.94 2wv5 s ALA 183 Cb 0.02 0.47 0.11 0.00 0.00 0.00 0.00 23.12 23.72 2wv5 s ALA 183 CO 0.10 -0.23 1.09 0.20 0.00 0.00 0.00 175.76 176.93 2wv5 s GLY 184 N -3.63 -0.36 0.00 0.00 0.00 -1.26 -0.72 107.32 101.35 2wv5 s GLY 184 Ca 0.28 0.95 0.00 0.00 0.00 0.00 0.00 44.72 45.95 2wv5 s GLY 184 CO 0.14 0.28 0.00 0.61 0.00 0.00 0.00 173.10 174.13 2wv5 n GLY 185 N -0.30 2.22 2.73 0.20 0.00 0.29 -4.98 105.19 105.34 2wv5 n GLY 185 Ca -0.05 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 2wv5 n GLY 185 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wv5 n ASN 186 N 0.00 -0.38 0.00 1.61 5.15 -1.26 0.99 115.26 121.37 2wv5 n ASN 186 Ca 0.00 -0.44 0.00 0.00 -0.60 0.00 0.00 54.58 53.54 2wv5 n ASN 186 Cb 0.00 -0.56 0.00 0.00 -0.53 0.00 0.00 39.78 38.69 2wv5 n ASN 186 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wv5 n GLY 187 N -0.93 0.77 2.83 8.20 0.00 -1.26 -5.07 105.19 109.73 2wv5 n GLY 187 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2wv5 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wv5 s VAL 188 N -2.18 0.19 0.06 1.61 0.11 0.28 -2.88 120.40 117.60 2wv5 s VAL 188 Ca 0.00 0.07 0.04 0.00 -2.93 0.00 0.00 61.98 59.15 2wv5 s VAL 188 Cb 0.00 -0.28 -0.04 0.00 -1.53 0.00 0.00 36.38 34.54 2wv5 s VAL 188 CO 0.00 0.14 0.00 -0.83 -3.33 0.00 0.00 175.10 171.08 2wv5 s GLY 189 N 0.94 1.91 -0.20 6.54 0.00 0.87 -0.55 107.32 116.83 2wv5 s GLY 189 Ca -0.10 -1.07 0.01 0.00 0.00 0.00 0.00 44.72 43.57 2wv5 s GLY 189 CO -0.02 -1.01 -0.11 -0.19 0.00 0.00 0.00 173.10 171.77 2wv5 s TYR 190 N -1.25 2.47 -0.09 1.90 1.51 0.10 -1.87 117.35 120.13 2wv5 s TYR 190 Ca 0.24 -1.62 -0.05 0.00 -1.01 0.00 0.00 57.07 54.63 2wv5 s TYR 190 Cb -0.12 -1.67 -0.04 0.00 -0.11 0.00 0.00 41.96 40.03 2wv5 s TYR 190 CO 0.16 -0.75 0.11 0.00 -1.11 0.00 0.00 175.55 173.96 2wv5 s SER 192 N -1.19 6.74 0.29 0.00 0.01 1.04 -1.37 113.70 119.22 2wv5 s SER 192 Ca 0.17 0.67 -0.30 0.00 1.31 0.00 0.00 55.95 57.80 2wv5 s SER 192 Cb -0.12 -2.53 -0.12 0.00 0.21 0.00 0.00 66.02 63.47 2wv5 s SER 192 CO 0.07 -1.04 1.59 0.00 0.41 0.00 0.00 173.24 174.27 2wv5 s VAL 194 N 0.01 1.73 0.16 0.00 1.01 -0.82 -4.92 120.40 117.57 2wv5 s VAL 194 Ca 0.64 -0.75 -0.31 0.00 0.00 0.00 0.00 61.98 61.56 2wv5 s VAL 194 Cb -0.50 -1.61 -0.08 0.00 0.00 0.00 0.00 36.38 34.19 2wv5 s VAL 194 CO 0.48 0.46 1.35 -0.55 0.00 0.00 0.00 175.10 176.85 2wv5 s SER 195 N 1.42 6.85 0.18 3.32 0.15 -1.26 -4.53 113.70 119.83 2wv5 s SER 195 Ca 0.05 2.37 -0.13 0.00 0.70 0.00 0.00 55.95 58.94 2wv5 s SER 195 Cb -0.13 -2.60 0.09 0.00 -1.71 0.00 0.00 66.02 61.67 2wv5 s SER 195 CO -0.11 -0.60 1.82 -0.09 1.20 0.00 0.00 173.24 175.46 2wv5 h ARG 196 N 6.10 0.80 -0.09 5.44 1.12 -1.16 -2.46 114.38 124.13 2wv5 h ARG 196 Ca -0.43 -0.07 0.04 0.00 -1.11 0.00 0.00 59.98 58.40 2wv5 h ARG 196 Cb 1.21 -0.17 -0.05 0.00 -0.01 0.00 0.00 29.97 30.96 2wv5 h ARG 196 CO 0.82 0.57 -0.18 0.77 -3.11 0.00 0.00 179.97 178.84 2wv5 h SER 197 N 0.80 -0.56 -0.34 -3.80 0.02 -1.92 -0.51 113.55 107.23 2wv5 h SER 197 Ca 0.21 0.09 0.10 0.00 -0.84 0.00 0.00 61.79 61.36 2wv5 h SER 197 Cb -0.02 0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2wv5 h SER 197 CO -0.04 -0.24 0.29 0.24 -1.14 0.00 0.00 176.83 175.94 2wv5 h MET 198 N -0.25 0.00 0.18 3.45 2.86 -1.85 -1.00 114.93 118.31 2wv5 h MET 198 Ca 0.09 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.39 2wv5 h MET 198 Cb 0.38 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.04 2wv5 h MET 198 CO -0.24 0.00 -1.68 -0.07 1.06 0.00 0.00 176.91 175.98 2wv5 h LEU 199 N 0.00 0.58 0.13 1.22 3.38 -0.91 -2.56 115.31 117.16 2wv5 h LEU 199 Ca 0.16 -0.83 0.01 0.00 0.09 0.00 0.00 57.88 57.31 2wv5 h LEU 199 Cb 0.74 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2wv5 h LEU 199 CO -0.00 1.70 -0.20 1.56 0.09 0.00 0.00 178.44 181.59 2wv5 h GLN 200 N 0.10 -0.38 0.37 1.13 1.08 -0.09 0.87 115.11 118.20 2wv5 h GLN 200 Ca -0.31 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 56.91 2wv5 h GLN 200 Cb 2.09 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 29.59 2wv5 h GLN 200 CO 0.18 -0.25 -0.31 0.87 -0.95 0.00 0.00 178.83 178.37 2wv5 h LYS 201 N -0.39 -0.67 -0.98 1.46 1.79 -1.36 0.47 116.57 116.89 2wv5 h LYS 201 Ca 0.02 0.05 0.26 0.00 -2.18 0.00 0.00 60.65 58.80 2wv5 h LYS 201 Cb 0.40 0.15 -0.06 0.00 -1.58 0.00 0.00 32.23 31.15 2wv5 h LYS 201 CO -0.10 -0.45 0.68 1.98 -1.08 0.00 0.00 179.45 180.48 2wv5 h MET 202 N -0.70 0.16 -0.04 3.15 -1.53 -1.08 0.20 114.93 115.09 2wv5 h MET 202 Ca -0.03 -0.01 -0.04 0.00 -3.44 0.00 0.00 59.70 56.18 2wv5 h MET 202 Cb 0.61 -0.04 0.00 0.00 -0.55 0.00 0.00 31.60 31.63 2wv5 h MET 202 CO -0.02 0.10 -0.15 -0.22 0.14 0.00 0.00 176.91 176.76 2wv5 h LYS 203 N 0.16 0.17 0.00 0.39 3.64 0.22 -3.04 116.57 118.11 2wv5 h LYS 203 Ca 0.49 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 2wv5 h LYS 203 Cb 1.66 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 2wv5 h LYS 203 CO -0.10 0.78 0.00 0.00 -2.27 0.00 0.00 179.45 177.86 2wv5 h ALA 204 N 0.39 1.00 0.00 5.00 0.00 0.13 -0.54 119.26 125.24 2wv5 h ALA 204 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wv5 h ALA 204 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2wv5 h ALA 204 CO 0.03 0.00 0.00 1.58 0.00 0.00 0.00 179.25 180.86 2wv5 n HIS 205 N -2.98 0.51 0.15 0.00 -0.00 0.43 -5.09 115.22 108.23 2wv5 n HIS 205 Ca -0.01 0.15 0.02 0.00 -0.00 0.00 0.00 57.72 57.88 2wv5 n HIS 205 Cb 0.18 -0.75 0.02 0.00 -0.00 0.00 0.00 29.99 29.44 2wv5 n HIS 205 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62