#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 0.06 -0.61 -2.67 5.85 -2.00 -2.13 115.31 113.80 2wv5 h LEU 8 Ca 0.00 -0.48 0.10 0.00 0.84 0.00 0.00 57.88 58.34 2wv5 h LEU 8 Cb 0.00 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 40.94 2wv5 h LEU 8 CO 0.00 0.52 0.23 -0.61 -0.34 0.00 0.00 178.44 178.24 2wv5 h GLN 9 N -0.40 0.40 0.00 1.25 4.15 -2.01 0.37 115.11 118.87 2wv5 h GLN 9 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2wv5 h GLN 9 Cb 0.50 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.10 2wv5 h GLN 9 CO 0.01 0.26 0.00 0.87 -1.93 0.00 0.00 178.83 178.04 2wv5 h LYS 10 N 0.41 0.00 0.12 1.69 1.57 -1.99 -2.09 116.57 116.28 2wv5 h LYS 10 Ca 0.31 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.78 2wv5 h LYS 10 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2wv5 h LYS 10 CO -0.31 0.00 -1.58 1.98 -0.57 0.00 0.00 179.45 178.96 2wv5 h MET 11 N 0.00 0.26 0.07 3.15 1.85 0.11 -3.14 114.93 117.24 2wv5 h MET 11 Ca 0.00 -0.45 -0.25 0.00 -0.61 0.00 0.00 59.70 58.39 2wv5 h MET 11 Cb 0.54 0.17 -0.00 0.00 0.43 0.00 0.00 31.60 32.74 2wv5 h MET 11 CO 0.00 1.13 -1.10 0.28 -0.40 0.00 0.00 176.91 176.81 2wv5 h VAL 12 N 0.07 1.49 -0.04 -5.77 2.07 -0.32 -3.04 116.25 110.70 2wv5 h VAL 12 Ca -0.26 -2.87 -0.03 0.00 0.82 0.00 0.00 66.70 64.35 2wv5 h VAL 12 Cb 2.03 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 34.54 2wv5 h VAL 12 CO 0.16 0.84 -0.13 -0.03 0.02 0.00 0.00 177.57 178.43 2wv5 h MET 13 N 0.11 0.07 -0.09 1.57 -1.53 -1.50 0.34 114.93 113.89 2wv5 h MET 13 Ca -0.10 -0.01 -0.11 0.00 -3.44 0.00 0.00 59.70 56.03 2wv5 h MET 13 Cb 1.80 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 32.82 2wv5 h MET 13 CO 0.18 0.20 -0.46 0.78 0.14 0.00 0.00 176.91 177.75 2wv5 h GLY 14 N 0.51 0.23 1.46 1.39 0.00 -1.48 -2.88 103.07 102.30 2wv5 h GLY 14 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2wv5 h GLY 14 CO 0.02 0.21 -0.46 3.43 0.00 0.00 0.00 176.54 179.74 2wv5 h ASN 15 N 0.17 0.00 -3.30 0.19 4.21 -1.02 -3.46 115.58 112.38 2wv5 h ASN 15 Ca 0.01 -0.09 -0.57 0.00 1.21 0.00 0.00 56.30 56.87 2wv5 h ASN 15 Cb 0.88 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 38.02 2wv5 h ASN 15 CO 0.07 0.04 0.91 -0.89 -1.29 0.00 0.00 177.43 176.27 2wv5 s THR 16 N -3.20 4.32 0.07 2.81 2.01 -0.05 -1.89 115.64 119.71 2wv5 s THR 16 Ca 0.06 1.50 0.05 0.00 0.31 0.00 0.00 61.69 63.61 2wv5 s THR 16 Cb 0.11 -4.34 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 2wv5 s THR 16 CO 0.70 -0.55 -0.07 -0.54 -0.69 0.00 0.00 174.62 173.47 2wv5 s LYS 17 N 3.96 2.35 0.26 4.92 -0.14 0.28 -4.79 119.74 126.58 2wv5 s LYS 17 Ca 0.50 -0.89 -0.29 0.00 -1.36 0.00 0.00 55.97 53.93 2wv5 s LYS 17 Cb -0.13 -2.42 -0.09 0.00 -1.68 0.00 0.00 37.83 33.51 2wv5 s LYS 17 CO 0.21 0.54 0.97 -1.25 -0.76 0.00 0.00 175.35 175.06 2wv5 s PRO 18 N -1.99 4.76 -0.04 -1.68 0.04 -1.24 -0.97 135.00 133.89 2wv5 s PRO 18 Ca 0.21 1.52 0.06 0.00 0.04 0.00 0.00 61.00 62.83 2wv5 s PRO 18 Cb -0.11 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.24 2wv5 s PRO 18 CO 0.13 0.41 -0.22 0.08 0.04 0.00 0.00 177.00 177.44 2wv5 s VAL 19 N -1.25 1.78 -0.01 -0.36 1.01 -0.94 -0.51 120.40 120.11 2wv5 s VAL 19 Ca 0.43 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.50 2wv5 s VAL 19 Cb -0.26 -1.50 -0.00 0.00 0.00 0.00 0.00 36.38 34.62 2wv5 s VAL 19 CO 0.32 0.50 -0.06 -1.61 0.00 0.00 0.00 175.10 174.26 2wv5 s GLU 20 N -0.28 0.53 -0.26 2.72 8.01 0.38 -2.14 118.70 127.66 2wv5 s GLU 20 Ca 0.02 -0.20 -0.10 0.00 0.01 0.00 0.00 54.97 54.70 2wv5 s GLU 20 Cb -0.11 -0.52 -0.05 0.00 -4.31 0.00 0.00 34.13 29.15 2wv5 s GLU 20 CO 0.01 0.10 0.16 -0.51 0.01 0.00 0.00 175.26 175.04 2wv5 s LEU 21 N -0.01 3.96 -0.14 1.80 1.43 0.06 0.77 118.68 126.55 2wv5 s LEU 21 Ca 0.01 0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.06 2wv5 s LEU 21 Cb -0.04 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 2wv5 s LEU 21 CO -0.00 -0.00 0.04 -0.63 0.23 0.00 0.00 176.35 175.99 2wv5 s ILE 22 N 1.45 4.62 -0.31 -0.59 -1.09 0.62 0.27 121.20 126.17 2wv5 s ILE 22 Ca 0.07 -0.11 -0.02 0.00 -2.23 0.00 0.00 60.65 58.35 2wv5 s ILE 22 Cb -0.15 -3.02 0.11 0.00 -1.58 0.00 0.00 42.46 37.82 2wv5 s ILE 22 CO 0.07 0.53 0.16 -0.22 -1.23 0.00 0.00 174.94 174.26 2wv5 s LEU 23 N -0.22 0.77 -0.52 2.97 2.96 -0.31 -1.38 118.68 122.95 2wv5 s LEU 23 Ca 0.07 -1.63 -0.01 0.00 -0.22 0.00 0.00 54.13 52.33 2wv5 s LEU 23 Cb -0.12 -0.39 -0.02 0.00 0.50 0.00 0.00 46.19 46.16 2wv5 s LEU 23 CO 0.02 -0.39 0.44 0.47 -1.32 0.00 0.00 176.35 175.57 2wv5 n ASP 24 N 4.79 -3.09 0.00 3.68 8.00 -1.26 -3.37 116.55 125.30 2wv5 n ASP 24 Ca 0.01 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.20 2wv5 n ASP 24 Cb 0.40 -2.66 0.00 0.00 -0.02 0.00 0.00 41.12 38.84 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 -1.22 0.11 3.42 0.44 0.00 -1.26 -4.96 105.19 101.73 2wv5 n GLY 25 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.14 2.77 -0.16 1.61 0.00 -1.22 -5.08 119.74 116.53 2wv5 s LYS 26 Ca 0.00 -0.72 -0.29 0.00 0.00 0.00 0.00 55.97 54.96 2wv5 s LYS 26 Cb 0.00 -2.43 -0.03 0.00 0.00 0.00 0.00 37.83 35.37 2wv5 s LYS 26 CO 0.00 0.47 1.57 0.99 0.00 0.00 0.00 175.35 178.38 2wv5 s THR 27 N -0.34 3.76 -0.40 3.79 2.01 -1.26 -1.16 115.64 122.04 2wv5 s THR 27 Ca 0.03 0.89 0.15 0.00 0.31 0.00 0.00 61.69 63.06 2wv5 s THR 27 Cb -0.13 -3.68 -0.19 0.00 0.01 0.00 0.00 72.50 68.52 2wv5 s THR 27 CO 0.02 -0.20 0.49 1.33 -0.69 0.00 0.00 174.62 175.57 2wv5 n VAL 28 N 5.95 0.00 -3.60 3.82 0.24 0.14 -4.95 118.33 119.92 2wv5 n VAL 28 Ca 0.17 -0.24 -0.16 0.00 -2.04 0.00 0.00 64.34 62.08 2wv5 n VAL 28 Cb 0.44 0.64 -0.07 0.00 -1.47 0.00 0.00 33.84 33.39 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 -2.64 -1.46 -0.02 2.33 0.00 -1.19 -4.95 121.76 113.82 2wv5 s ALA 29 Ca 0.01 1.09 0.02 0.00 0.00 0.00 0.00 51.96 53.08 2wv5 s ALA 29 Cb 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2wv5 s ALA 29 CO 0.60 -0.33 -0.06 0.42 0.00 0.00 0.00 175.76 176.39 2wv5 s ILE 30 N -1.05 0.54 0.00 0.00 1.01 -1.26 -0.76 121.20 119.68 2wv5 s ILE 30 Ca -0.10 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2wv5 s ILE 30 Cb -0.02 -0.49 0.00 0.00 0.01 0.00 0.00 42.46 41.96 2wv5 s ILE 30 CO 0.07 0.17 0.00 0.00 0.00 0.00 0.00 174.94 175.19 2wv5 s ALA 33 N -2.99 0.19 -0.31 0.00 0.00 -0.14 -4.09 121.76 114.41 2wv5 s ALA 33 Ca 0.33 0.24 -0.09 0.00 0.00 0.00 0.00 51.96 52.44 2wv5 s ALA 33 Cb 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.84 2wv5 s ALA 33 CO 0.15 -0.18 0.13 0.99 0.00 0.00 0.00 175.76 176.85 2wv5 s THR 34 N 1.29 4.36 -0.08 0.00 2.01 -0.12 -0.56 115.64 122.54 2wv5 s THR 34 Ca -0.06 -0.59 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 2wv5 s THR 34 Cb -0.13 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.09 2wv5 s THR 34 CO -0.03 0.02 1.14 -0.83 -0.69 0.00 0.00 174.62 174.23 2wv5 s GLY 35 N 1.56 2.16 -0.19 4.40 0.00 -0.79 0.57 107.32 115.02 2wv5 s GLY 35 Ca 0.03 0.53 0.07 0.00 0.00 0.00 0.00 44.72 45.36 2wv5 s GLY 35 CO 0.05 2.13 -0.08 3.33 0.00 0.00 0.00 173.10 178.52 2wv5 n VAL 36 N 4.63 1.18 -3.56 1.40 0.24 -0.81 -4.74 118.33 116.67 2wv5 n VAL 36 Ca 0.10 -0.56 -0.09 0.00 -2.04 0.00 0.00 64.34 61.75 2wv5 n VAL 36 Cb 0.47 -0.96 -0.04 0.00 -1.47 0.00 0.00 33.84 31.84 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 -2.41 -0.33 0.00 6.34 -0.12 -1.23 -0.46 117.98 119.76 2wv5 s PHE 37 Ca -0.20 0.44 0.00 0.00 -0.05 0.00 0.00 56.93 57.12 2wv5 s PHE 37 Cb 0.06 0.48 0.00 0.00 -0.63 0.00 0.00 43.02 42.94 2wv5 s PHE 37 CO 0.57 -0.39 0.00 0.41 -0.05 0.00 0.00 175.22 175.76 2wv5 n GLY 38 N 0.34 2.27 2.07 1.99 0.00 -1.26 -0.52 105.19 110.08 2wv5 n GLY 38 Ca -0.09 0.40 -0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 2.09 -4.29 2.61 -2.24 -1.26 -1.19 114.28 110.00 2wv5 n THR 39 Ca 0.00 -3.68 -0.34 0.00 -2.27 0.00 0.00 64.05 57.76 2wv5 n THR 39 Cb 0.00 -0.36 -0.13 0.00 -2.10 0.00 0.00 70.33 67.74 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 -3.48 2.95 0.13 6.98 0.00 0.32 -0.85 121.76 127.81 2wv5 s ALA 40 Ca 0.43 -0.92 0.10 0.00 0.00 0.00 0.00 51.96 51.58 2wv5 s ALA 40 Cb 0.38 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 2wv5 s ALA 40 CO 0.00 0.04 -0.26 0.71 0.00 0.00 0.00 175.76 176.25 2wv5 s TYR 41 N 0.67 2.21 -0.23 0.00 1.51 0.15 -1.92 117.35 119.75 2wv5 s TYR 41 Ca -0.02 -0.39 -0.16 0.00 -1.01 0.00 0.00 57.07 55.49 2wv5 s TYR 41 Cb -0.14 -1.20 -0.04 0.00 -0.11 0.00 0.00 41.96 40.47 2wv5 s TYR 41 CO 0.02 0.32 0.41 -0.51 -1.11 0.00 0.00 175.55 174.68 2wv5 s LEU 42 N -2.04 4.11 0.10 -1.29 1.43 0.19 0.11 118.68 121.29 2wv5 s LEU 42 Ca 0.13 0.45 0.02 0.00 -1.03 0.00 0.00 54.13 53.70 2wv5 s LEU 42 Cb -0.10 -2.51 -0.04 0.00 0.03 0.00 0.00 46.19 43.57 2wv5 s LEU 42 CO 0.06 -0.14 -0.06 0.68 0.23 0.00 0.00 176.35 177.12 2wv5 s VAL 43 N 1.66 0.68 0.14 -1.59 -7.23 -0.64 -0.95 120.40 112.47 2wv5 s VAL 43 Ca 0.18 -1.92 -0.31 0.00 -1.81 0.00 0.00 61.98 58.12 2wv5 s VAL 43 Cb -0.15 -1.66 -0.10 0.00 0.56 0.00 0.00 36.38 35.03 2wv5 s VAL 43 CO 0.09 -0.87 1.58 -2.84 -0.31 0.00 0.00 175.10 172.75 2wv5 s PRO 44 N -3.81 4.21 0.10 4.82 0.02 -1.26 -1.60 135.00 137.49 2wv5 s PRO 44 Ca 0.11 2.35 -0.17 0.00 0.02 0.00 0.00 61.00 63.32 2wv5 s PRO 44 Cb 0.05 -3.25 -0.06 0.00 0.02 0.00 0.00 34.50 31.26 2wv5 s PRO 44 CO -0.05 -0.63 1.53 -0.09 -0.33 0.00 0.00 177.00 177.43 2wv5 h ARG 45 N 7.14 0.55 0.00 5.54 2.43 -1.29 -2.40 114.38 126.34 2wv5 h ARG 45 Ca -0.43 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.56 2wv5 h ARG 45 Cb 1.20 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 2wv5 h ARG 45 CO 0.92 0.70 0.02 -2.39 -1.51 0.00 0.00 179.97 177.71 2wv5 n HIS 46 N -4.54 0.00 -0.08 2.20 1.44 -1.26 -1.42 115.22 111.56 2wv5 n HIS 46 Ca -0.03 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.55 2wv5 n HIS 46 Cb 0.27 -0.08 -0.05 0.00 0.12 0.00 0.00 29.99 30.25 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 0.58 0.00 2.39 5.85 -1.81 -2.84 115.31 119.48 2wv5 h LEU 47 Ca 0.00 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2wv5 h LEU 47 Cb 0.04 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.90 2wv5 h LEU 47 CO 0.00 0.92 0.00 0.49 -0.34 0.00 0.00 178.44 179.51 2wv5 n PHE 48 N -4.41 0.00 0.56 1.25 3.01 -0.50 -1.58 117.46 115.79 2wv5 n PHE 48 Ca -0.05 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.54 2wv5 n PHE 48 Cb 0.41 -0.04 0.30 0.00 -0.01 0.00 0.00 39.48 40.14 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 3.11 0.84 -2.25 4.37 0.00 -1.64 -3.45 119.26 120.23 2wv5 h ALA 49 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 2wv5 h ALA 49 Cb 0.02 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wv5 h ALA 49 CO 0.00 0.00 0.28 -1.21 0.00 0.00 0.00 179.25 178.32 2wv5 s GLU 50 N -3.14 3.86 -0.29 0.00 0.41 -0.61 -5.03 118.70 113.90 2wv5 s GLU 50 Ca 0.09 0.76 -0.19 0.00 -0.41 0.00 0.00 54.97 55.22 2wv5 s GLU 50 Cb 0.12 -2.23 -0.02 0.00 -1.78 0.00 0.00 34.13 30.23 2wv5 s GLU 50 CO 0.65 -0.20 0.56 0.21 -0.49 0.00 0.00 175.26 175.99 2wv5 s LYS 51 N -4.06 3.93 0.26 1.61 2.20 -1.26 -5.02 119.74 117.40 2wv5 s LYS 51 Ca 0.56 0.23 -0.02 0.00 -0.36 0.00 0.00 55.97 56.38 2wv5 s LYS 51 Cb -0.10 -3.71 -0.02 0.00 -1.51 0.00 0.00 37.83 32.49 2wv5 s LYS 51 CO 0.33 -0.49 0.30 1.52 -0.36 0.00 0.00 175.35 176.65 2wv5 s TYR 52 N 2.44 1.07 0.00 4.03 -0.85 -1.26 -4.83 117.35 117.94 2wv5 s TYR 52 Ca 0.22 -1.27 0.00 0.00 -0.52 0.00 0.00 57.07 55.51 2wv5 s TYR 52 Cb -0.15 -0.33 0.00 0.00 0.38 0.00 0.00 41.96 41.86 2wv5 s TYR 52 CO 0.11 -0.86 0.09 -0.40 -1.52 0.00 0.00 175.55 172.97 2wv5 n ASP 53 N -0.74 0.16 -3.65 -0.18 3.85 -0.48 -4.99 116.55 110.52 2wv5 n ASP 53 Ca 0.02 -1.00 -0.08 0.00 -0.71 0.00 0.00 54.79 53.01 2wv5 n ASP 53 Cb 0.64 0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 40.33 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 -0.00 0.69 -0.24 0.11 1.02 -1.03 -4.81 119.74 115.47 2wv5 s LYS 54 Ca 0.00 1.14 -0.05 0.00 0.02 0.00 0.00 55.97 57.08 2wv5 s LYS 54 Cb 0.00 0.16 -0.01 0.00 -0.52 0.00 0.00 37.83 37.46 2wv5 s LYS 54 CO 0.00 -0.14 -0.01 0.42 -0.92 0.00 0.00 175.35 174.70 2wv5 s ILE 55 N 1.42 3.57 -0.32 2.17 1.01 0.21 -0.27 121.20 128.99 2wv5 s ILE 55 Ca -0.08 -0.53 -0.21 0.00 0.00 0.00 0.00 60.65 59.83 2wv5 s ILE 55 Cb -0.05 -2.69 -0.00 0.00 0.01 0.00 0.00 42.46 39.72 2wv5 s ILE 55 CO -0.16 0.33 0.67 -0.04 0.00 0.00 0.00 174.94 175.73 2wv5 s MET 56 N 1.49 3.87 -0.23 2.79 -1.94 0.23 -1.69 119.30 123.81 2wv5 s MET 56 Ca 0.05 0.31 0.02 0.00 -1.71 0.00 0.00 55.69 54.35 2wv5 s MET 56 Cb -0.15 -3.74 0.05 0.00 2.01 0.00 0.00 34.83 33.00 2wv5 s MET 56 CO -0.01 -0.63 -0.10 -1.17 -0.01 0.00 0.00 175.02 173.10 2wv5 s LEU 57 N 2.71 2.87 -1.46 -0.03 2.96 -0.36 -0.47 118.68 124.90 2wv5 s LEU 57 Ca 0.27 -1.18 -0.09 0.00 -0.22 0.00 0.00 54.13 52.91 2wv5 s LEU 57 Cb -0.15 -1.38 0.04 0.00 0.50 0.00 0.00 46.19 45.21 2wv5 s LEU 57 CO 0.13 -0.18 0.78 -0.67 -1.32 0.00 0.00 176.35 175.09 2wv5 n ASP 58 N 4.56 -5.27 0.00 3.68 2.03 0.33 -1.49 116.55 120.38 2wv5 n ASP 58 Ca -0.14 -0.48 0.00 0.00 0.52 0.00 0.00 54.79 54.68 2wv5 n ASP 58 Cb 0.44 -4.24 0.00 0.00 -0.72 0.00 0.00 41.12 36.60 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 -1.57 0.99 3.70 0.27 0.00 -1.26 -5.00 105.19 102.31 2wv5 n GLY 59 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.42 4.02 -0.00 1.61 3.52 -0.56 -5.08 118.95 122.03 2wv5 s ARG 60 Ca 0.00 -0.27 -0.18 0.00 -0.13 0.00 0.00 55.73 55.15 2wv5 s ARG 60 Cb 0.00 -3.30 -0.06 0.00 -1.56 0.00 0.00 34.95 30.04 2wv5 s ARG 60 CO 0.00 0.33 0.51 0.00 -0.81 0.00 0.00 175.30 175.33 2wv5 s ALA 61 N 0.24 3.58 0.05 6.12 0.00 -1.26 -1.23 121.76 129.25 2wv5 s ALA 61 Ca 0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 51.96 51.92 2wv5 s ALA 61 Cb -0.12 -2.59 -0.03 0.00 0.00 0.00 0.00 23.12 20.38 2wv5 s ALA 61 CO -0.01 0.29 -0.00 -1.64 0.00 0.00 0.00 175.76 174.41 2wv5 s MET 62 N -0.55 0.57 0.27 0.00 1.00 -0.68 -4.97 119.30 114.94 2wv5 s MET 62 Ca 0.27 -1.03 0.12 0.00 0.00 0.00 0.00 55.69 55.05 2wv5 s MET 62 Cb -0.18 0.20 -0.05 0.00 0.00 0.00 0.00 34.83 34.81 2wv5 s MET 62 CO 0.15 -0.11 -0.20 0.95 0.00 0.00 0.00 175.02 175.81 2wv5 s THR 63 N -3.30 2.42 0.50 2.05 -4.23 -1.26 -0.62 115.64 111.20 2wv5 s THR 63 Ca 0.01 -2.39 0.41 0.00 -1.18 0.00 0.00 61.69 58.53 2wv5 s THR 63 Cb 0.03 -2.28 0.62 0.00 1.34 0.00 0.00 72.50 72.21 2wv5 s THR 63 CO -0.08 -0.42 1.59 0.44 -0.54 0.00 0.00 174.62 175.61 2wv5 h ASP 64 N 2.29 0.11 0.00 3.99 3.32 -1.93 0.31 116.42 124.51 2wv5 h ASP 64 Ca -0.40 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.73 2wv5 h ASP 64 Cb 1.26 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2wv5 h ASP 64 CO 0.60 -0.13 0.00 -1.54 -1.72 0.00 0.00 179.24 176.46 2wv5 n SER 65 N -4.35 0.00 -0.24 6.45 3.41 -1.26 -3.29 113.62 114.35 2wv5 n SER 65 Ca 0.42 -1.42 0.11 0.00 -0.26 0.00 0.00 58.87 57.71 2wv5 n SER 65 Cb 1.76 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.70 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 -0.72 1.42 -3.22 4.04 10.43 0.11 -4.98 116.55 123.62 2wv5 n ASP 66 Ca 0.10 -1.17 -0.10 0.00 2.57 0.00 0.00 54.79 56.19 2wv5 n ASP 66 Cb 0.05 0.66 -0.00 0.00 1.84 0.00 0.00 41.12 43.66 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 -2.74 0.29 0.17 1.24 -0.85 -1.21 -1.52 117.35 112.74 2wv5 s TYR 67 Ca 0.14 -0.82 0.08 0.00 -0.52 0.00 0.00 57.07 55.95 2wv5 s TYR 67 Cb 0.17 0.57 -0.04 0.00 0.38 0.00 0.00 41.96 43.04 2wv5 s TYR 67 CO 0.70 -1.38 -0.16 1.03 -1.52 0.00 0.00 175.55 174.22 2wv5 s ARG 68 N -2.85 1.25 -0.26 -3.49 3.00 0.34 -4.95 118.95 111.99 2wv5 s ARG 68 Ca 0.19 -1.44 -0.01 0.00 0.00 0.00 0.00 55.73 54.46 2wv5 s ARG 68 Cb -0.04 -1.18 0.08 0.00 0.00 0.00 0.00 34.95 33.81 2wv5 s ARG 68 CO 0.12 0.22 0.05 0.08 0.00 0.00 0.00 175.30 175.78 2wv5 s VAL 69 N -2.39 0.89 0.17 3.52 1.01 -1.26 -0.92 120.40 121.43 2wv5 s VAL 69 Ca 0.17 -1.11 -0.15 0.00 0.00 0.00 0.00 61.98 60.89 2wv5 s VAL 69 Cb -0.04 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.77 2wv5 s VAL 69 CO 0.06 -0.43 0.58 -0.36 0.00 0.00 0.00 175.10 174.96 2wv5 s PHE 70 N 1.65 3.58 0.11 5.22 0.40 -0.53 -4.91 117.98 123.49 2wv5 s PHE 70 Ca 0.04 1.10 0.07 0.00 -0.60 0.00 0.00 56.93 57.53 2wv5 s PHE 70 Cb -0.17 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.91 2wv5 s PHE 70 CO -0.16 0.38 -0.11 -1.21 0.70 0.00 0.00 175.22 174.82 2wv5 s GLU 71 N -2.10 2.08 -0.14 0.44 2.02 -1.26 -1.47 118.70 118.27 2wv5 s GLU 71 Ca 0.40 -1.05 -0.07 0.00 0.02 0.00 0.00 54.97 54.28 2wv5 s GLU 71 Cb -0.15 -2.28 -0.04 0.00 0.10 0.00 0.00 34.13 31.76 2wv5 s GLU 71 CO 0.20 0.50 0.10 -0.06 0.02 0.00 0.00 175.26 176.02 2wv5 s PHE 72 N -1.21 3.43 -0.20 1.61 0.40 -1.26 -5.01 117.98 115.74 2wv5 s PHE 72 Ca 0.21 0.36 -0.02 0.00 -0.60 0.00 0.00 56.93 56.88 2wv5 s PHE 72 Cb -0.11 -1.98 0.00 0.00 0.51 0.00 0.00 43.02 41.44 2wv5 s PHE 72 CO 0.13 0.51 -0.10 -2.00 0.70 0.00 0.00 175.22 174.46 2wv5 s GLU 73 N -0.51 3.25 -0.10 0.44 2.12 -1.26 -0.75 118.70 121.90 2wv5 s GLU 73 Ca 0.11 -0.70 0.01 0.00 0.36 0.00 0.00 54.97 54.76 2wv5 s GLU 73 Cb -0.12 -2.84 -0.02 0.00 0.26 0.00 0.00 34.13 31.41 2wv5 s GLU 73 CO 0.02 -0.17 -0.12 0.96 -0.54 0.00 0.00 175.26 175.41 2wv5 s ILE 74 N 1.34 3.24 -0.08 -3.70 -4.36 0.99 -4.84 121.20 113.78 2wv5 s ILE 74 Ca 0.04 -0.62 -0.30 0.00 -0.26 0.00 0.00 60.65 59.51 2wv5 s ILE 74 Cb -0.14 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.20 2wv5 s ILE 74 CO -0.06 0.55 1.42 -1.59 0.24 0.00 0.00 174.94 175.51 2wv5 s LYS 75 N -0.18 4.24 -0.23 0.37 0.00 -1.26 -0.57 119.74 122.10 2wv5 s LYS 75 Ca 0.01 1.91 -0.03 0.00 0.00 0.00 0.00 55.97 57.86 2wv5 s LYS 75 Cb -0.13 -3.77 0.08 0.00 0.00 0.00 0.00 37.83 34.00 2wv5 s LYS 75 CO 0.03 -0.70 0.08 0.54 0.00 0.00 0.00 175.35 175.30 2wv5 s VAL 76 N 3.30 0.34 -1.12 1.79 0.11 -0.18 -4.86 120.40 119.78 2wv5 s VAL 76 Ca 0.63 -0.70 -0.02 0.00 -2.93 0.00 0.00 61.98 58.97 2wv5 s VAL 76 Cb -0.28 -1.06 -0.02 0.00 -1.53 0.00 0.00 36.38 33.49 2wv5 s VAL 76 CO 0.23 -0.44 0.95 2.29 -3.33 0.00 0.00 175.10 174.80 2wv5 n LYS 77 N 5.10 -5.24 0.00 1.54 0.00 -1.26 -3.78 118.16 114.52 2wv5 n LYS 77 Ca -0.07 0.83 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 2wv5 n LYS 77 Cb 0.45 -5.74 0.00 0.00 -0.00 0.00 0.00 35.03 29.74 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 -1.16 2.16 3.74 2.58 0.00 -1.26 -4.97 105.19 106.28 2wv5 n GLY 78 Ca -0.22 -0.28 -0.36 0.00 0.00 0.00 0.00 46.02 45.15 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 2.69 -0.01 1.61 -2.07 -1.25 -4.90 119.66 115.73 2wv5 s GLN 79 Ca 0.00 1.93 -0.12 0.00 -1.82 0.00 0.00 55.36 55.34 2wv5 s GLN 79 Cb 0.00 -1.88 -0.05 0.00 -1.09 0.00 0.00 33.01 29.99 2wv5 s GLN 79 CO 0.00 -1.46 0.35 -0.51 -1.32 0.00 0.00 175.29 172.35 2wv5 s ASP 80 N -1.56 6.70 0.24 12.60 1.01 -1.26 -1.01 116.67 133.39 2wv5 s ASP 80 Ca 0.79 0.83 0.08 0.00 0.71 0.00 0.00 52.55 54.97 2wv5 s ASP 80 Cb -0.33 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 2wv5 s ASP 80 CO 0.37 0.32 -0.13 -0.04 0.21 0.00 0.00 175.17 175.91 2wv5 s MET 81 N -1.20 1.46 -0.33 8.23 -1.94 0.26 -4.90 119.30 120.89 2wv5 s MET 81 Ca 0.23 -1.68 -0.22 0.00 -1.71 0.00 0.00 55.69 52.31 2wv5 s MET 81 Cb -0.15 -1.25 0.00 0.00 2.01 0.00 0.00 34.83 35.44 2wv5 s MET 81 CO 0.12 0.17 0.72 -1.17 -0.01 0.00 0.00 175.02 174.85 2wv5 s LEU 82 N -3.39 4.14 0.60 -0.03 2.96 -1.26 -0.01 118.68 121.69 2wv5 s LEU 82 Ca 0.26 0.45 -0.19 0.00 -0.22 0.00 0.00 54.13 54.43 2wv5 s LEU 82 Cb -0.00 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 43.71 2wv5 s LEU 82 CO 0.10 -0.60 1.22 -0.55 -1.32 0.00 0.00 176.35 175.20 2wv5 s SER 83 N 1.70 5.08 0.00 3.68 0.15 0.07 -4.32 113.70 120.06 2wv5 s SER 83 Ca 0.29 2.44 0.21 0.00 0.70 0.00 0.00 55.95 59.59 2wv5 s SER 83 Cb -0.14 -2.60 1.23 0.00 -1.71 0.00 0.00 66.02 62.79 2wv5 s SER 83 CO 0.14 -1.67 1.80 -0.67 1.20 0.00 0.00 173.24 174.03 2wv5 n ASP 84 N -1.64 0.14 -4.44 5.45 2.03 -1.26 -4.54 116.55 112.28 2wv5 n ASP 84 Ca 0.14 -1.36 -0.43 0.00 0.52 0.00 0.00 54.79 53.65 2wv5 n ASP 84 Cb 0.49 -0.01 -0.09 0.00 -0.72 0.00 0.00 41.12 40.80 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 -1.99 3.49 0.31 -1.67 0.00 -1.26 -0.83 121.76 119.81 2wv5 s ALA 85 Ca 0.32 -1.80 0.07 0.00 0.00 0.00 0.00 51.96 50.55 2wv5 s ALA 85 Cb 0.15 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.24 2wv5 s ALA 85 CO 0.25 -1.60 0.32 0.00 0.00 0.00 0.00 175.76 174.73 2wv5 s ALA 86 N 1.80 3.88 -0.20 0.00 0.00 -0.62 -4.11 121.76 122.51 2wv5 s ALA 86 Ca 0.07 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.52 2wv5 s ALA 86 Cb -0.20 -1.37 0.03 0.00 0.00 0.00 0.00 23.12 21.58 2wv5 s ALA 86 CO 0.10 0.07 -0.17 -1.17 0.00 0.00 0.00 175.76 174.60 2wv5 s LEU 87 N -4.00 2.50 -0.38 0.00 2.96 -0.54 -1.63 118.68 117.59 2wv5 s LEU 87 Ca 0.39 -0.87 -0.15 0.00 -0.22 0.00 0.00 54.13 53.28 2wv5 s LEU 87 Cb -0.07 -1.48 0.01 0.00 0.50 0.00 0.00 46.19 45.15 2wv5 s LEU 87 CO 0.27 -0.06 0.31 -0.32 -1.32 0.00 0.00 176.35 175.23 2wv5 s MET 88 N 1.25 3.21 -0.32 1.98 -2.45 0.30 -1.46 119.30 121.81 2wv5 s MET 88 Ca 0.01 -0.80 -0.07 0.00 -1.25 0.00 0.00 55.69 53.58 2wv5 s MET 88 Cb -0.15 -3.91 0.03 0.00 1.25 0.00 0.00 34.83 32.05 2wv5 s MET 88 CO -0.10 -0.65 0.10 0.08 1.05 0.00 0.00 175.02 175.50 2wv5 s VAL 89 N 1.80 3.92 0.34 10.11 1.01 -0.09 0.34 120.40 137.82 2wv5 s VAL 89 Ca 0.07 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 60.85 2wv5 s VAL 89 Cb -0.18 -3.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.97 2wv5 s VAL 89 CO 0.11 -0.08 1.01 -0.76 0.00 0.00 0.00 175.10 175.38 2wv5 s LEU 90 N 1.45 4.33 -0.02 3.92 1.43 -0.03 -0.51 118.68 129.26 2wv5 s LEU 90 Ca 0.00 2.00 -0.24 0.00 -1.03 0.00 0.00 54.13 54.87 2wv5 s LEU 90 Cb -0.19 -3.97 -0.19 0.00 0.03 0.00 0.00 46.19 41.87 2wv5 s LEU 90 CO 0.03 -0.22 1.21 0.45 0.23 0.00 0.00 176.35 178.05 2wv5 h HIS 91 N 3.13 0.20 -4.44 0.29 3.86 -1.61 -3.45 115.15 113.15 2wv5 h HIS 91 Ca -0.47 -0.08 -0.62 0.00 -1.16 0.00 0.00 60.37 58.04 2wv5 h HIS 91 Cb 1.20 -0.04 -0.30 0.00 1.06 0.00 0.00 27.41 29.34 2wv5 h HIS 91 CO 0.60 0.71 -0.86 1.03 0.86 0.00 0.00 177.93 180.27 2wv5 s ARG 92 N -3.88 1.79 0.00 2.45 3.00 -1.26 -5.09 118.95 115.96 2wv5 s ARG 92 Ca -0.15 -0.78 0.00 0.00 0.00 0.00 0.00 55.73 54.80 2wv5 s ARG 92 Cb 0.02 -1.72 0.00 0.00 0.00 0.00 0.00 34.95 33.26 2wv5 s ARG 92 CO 0.72 0.46 0.00 0.41 0.00 0.00 0.00 175.30 176.89 2wv5 n GLY 93 N 2.57 1.05 3.66 -3.53 0.00 -1.26 -5.10 105.19 102.58 2wv5 n GLY 93 Ca -0.15 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 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 7.08 0.67 1.61 0.01 -1.26 -4.93 114.94 118.11 2wv5 s ASN 94 Ca 0.00 1.35 -0.17 0.00 -0.71 0.00 0.00 52.86 53.33 2wv5 s ASN 94 Cb 0.00 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 39.09 2wv5 s ASN 94 CO 0.00 -0.66 0.77 2.29 -1.51 0.00 0.00 177.10 177.99 2wv5 n LYS 95 N 6.30 0.55 -4.04 -0.60 2.85 -1.26 -4.83 118.16 117.13 2wv5 n LYS 95 Ca 0.12 0.23 -0.24 0.00 -1.05 0.00 0.00 58.31 57.36 2wv5 n LYS 95 Cb 0.46 -2.02 -0.06 0.00 -0.65 0.00 0.00 35.03 32.76 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 -1.74 2.32 -0.27 0.58 -7.23 -0.34 -5.00 120.40 108.72 2wv5 s VAL 96 Ca 0.71 -1.64 -0.29 0.00 -1.81 0.00 0.00 61.98 58.96 2wv5 s VAL 96 Cb -0.38 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.60 2wv5 s VAL 96 CO 0.52 0.00 1.25 0.00 -0.31 0.00 0.00 175.10 176.56 2wv5 s ARG 97 N -3.95 4.01 -0.38 4.82 3.03 -1.26 -4.19 118.95 121.03 2wv5 s ARG 97 Ca 0.41 1.31 -0.31 0.00 2.03 0.00 0.00 55.73 59.18 2wv5 s ARG 97 Cb 0.03 -3.83 -0.09 0.00 -1.03 0.00 0.00 34.95 30.03 2wv5 s ARG 97 CO 0.23 -0.99 2.28 -3.47 -1.13 0.00 0.00 175.30 172.23 2wv5 n ASP 98 N 7.27 2.39 -0.44 -2.89 -0.08 -1.26 -4.56 116.55 116.98 2wv5 n ASP 98 Ca 0.14 0.14 0.07 0.00 -1.51 0.00 0.00 54.79 53.63 2wv5 n ASP 98 Cb 0.46 -1.40 0.16 0.00 2.34 0.00 0.00 41.12 42.69 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 7.56 1.71 0.16 5.18 -5.35 0.39 -4.73 119.36 124.28 2wv5 n ILE 99 Ca 0.39 -1.69 0.07 0.00 -0.27 0.00 0.00 62.75 61.26 2wv5 n ILE 99 Cb 0.35 0.02 0.57 0.00 -1.74 0.00 0.00 39.64 38.84 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 0.98 1.02 0.00 7.28 1.35 -1.86 -1.74 112.91 119.94 2wv5 h THR 100 Ca 0.00 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2wv5 h THR 100 Cb 1.02 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 2wv5 h THR 100 CO 0.08 0.03 0.00 2.29 -0.25 0.00 0.00 175.52 177.67 2wv5 n LYS 101 N -4.51 0.16 -0.24 4.72 2.85 -1.26 -1.83 118.16 118.04 2wv5 n LYS 101 Ca -0.00 0.17 0.12 0.00 -1.05 0.00 0.00 58.31 57.54 2wv5 n LYS 101 Cb 0.11 -1.50 0.26 0.00 -0.65 0.00 0.00 35.03 33.25 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 -1.24 0.64 -3.06 5.58 8.25 -0.65 -4.91 115.22 119.83 2wv5 n HIS 102 Ca 0.05 -0.32 -0.18 0.00 -0.26 0.00 0.00 57.72 57.01 2wv5 n HIS 102 Cb 0.07 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.19 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 -1.36 2.86 0.31 4.41 0.40 -0.76 -1.68 117.98 122.16 2wv5 s PHE 103 Ca 0.41 -0.34 0.03 0.00 -0.60 0.00 0.00 56.93 56.43 2wv5 s PHE 103 Cb 0.23 -2.34 -0.04 0.00 0.51 0.00 0.00 43.02 41.38 2wv5 s PHE 103 CO 0.31 -0.38 0.14 1.03 0.70 0.00 0.00 175.22 177.02 2wv5 s ARG 104 N -4.35 1.62 -0.08 0.44 0.52 -1.26 -4.64 118.95 111.19 2wv5 s ARG 104 Ca 0.54 -1.92 -0.04 0.00 -0.52 0.00 0.00 55.73 53.79 2wv5 s ARG 104 Cb -0.10 -0.26 -0.03 0.00 0.52 0.00 0.00 34.95 35.08 2wv5 s ARG 104 CO 0.33 -0.41 -0.10 -0.25 0.02 0.00 0.00 175.30 174.89 2wv5 n ASP 105 N -0.89 0.70 0.00 0.23 8.00 -1.26 -0.88 116.55 122.45 2wv5 n ASP 105 Ca -0.00 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.59 2wv5 n ASP 105 Cb 0.65 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 2wv5 n ASP 105 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2wv5 n THR 106 N -3.32 0.00 -2.99 -3.53 -2.24 -1.26 -4.95 114.28 95.99 2wv5 n THR 106 Ca -0.15 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2wv5 n THR 106 Cb 0.61 -0.08 -0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2wv5 n THR 106 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wv5 n ALA 107 N -3.00 -2.50 -3.92 6.98 0.00 -1.26 -4.97 120.51 111.83 2wv5 n ALA 107 Ca 0.00 0.33 -0.31 0.00 0.00 0.00 0.00 53.44 53.46 2wv5 n ALA 107 Cb 0.00 -0.96 -0.16 0.00 0.00 0.00 0.00 19.45 18.33 2wv5 n ALA 107 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2wv5 s ARG 108 N -1.08 2.66 0.00 0.00 0.52 -1.26 -5.03 118.95 114.76 2wv5 s ARG 108 Ca -0.02 -0.71 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2wv5 s ARG 108 Cb 0.00 -2.29 0.00 0.00 0.52 0.00 0.00 34.95 33.18 2wv5 s ARG 108 CO 0.31 -0.15 0.00 -1.33 0.02 0.00 0.00 175.30 174.15 2wv5 n MET 109 N 4.49 0.00 -3.99 3.54 2.81 -1.26 -4.95 117.12 117.76 2wv5 n MET 109 Ca -0.19 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.36 2wv5 n MET 109 Cb 0.51 0.00 -0.15 0.00 -0.71 0.00 0.00 33.22 32.87 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 0.00 2.88 0.22 0.03 0.00 -1.26 -5.08 119.74 116.53 2wv5 s LYS 110 Ca 0.00 -0.94 -0.11 0.00 0.00 0.00 0.00 55.97 54.92 2wv5 s LYS 110 Cb 0.00 -2.91 -0.08 0.00 0.00 0.00 0.00 37.83 34.84 2wv5 s LYS 110 CO 0.00 -0.36 0.04 1.17 0.00 0.00 0.00 175.35 176.20 2wv5 n LYS 111 N 4.66 0.00 0.00 1.78 4.81 -1.26 -2.12 118.16 126.03 2wv5 n LYS 111 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.27 2wv5 n LYS 111 Cb 0.48 -0.54 0.00 0.00 0.02 0.00 0.00 35.03 34.99 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 1.27 2.43 3.36 3.14 0.00 0.13 -4.91 105.19 110.60 2wv5 n GLY 112 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2wv5 n GLY 112 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wv5 n THR 113 N -1.85 0.00 -2.01 2.61 -2.24 -0.90 -3.86 114.28 106.02 2wv5 n THR 113 Ca 0.00 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.06 2wv5 n THR 113 Cb 0.00 -0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 67.49 2wv5 n THR 113 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2wv5 s PRO 114 N -3.73 4.26 -0.04 -0.78 0.02 -1.26 0.28 135.00 133.75 2wv5 s PRO 114 Ca 0.59 2.28 -0.02 0.00 0.02 0.00 0.00 61.00 63.88 2wv5 s PRO 114 Cb -0.17 -3.15 0.03 0.00 0.02 0.00 0.00 34.50 31.24 2wv5 s PRO 114 CO 0.66 -0.49 0.06 0.08 -0.33 0.00 0.00 177.00 176.98 2wv5 s VAL 115 N 0.59 -0.11 -0.21 3.83 1.01 0.57 -2.63 120.40 123.45 2wv5 s VAL 115 Ca 0.64 0.39 -0.03 0.00 0.00 0.00 0.00 61.98 62.98 2wv5 s VAL 115 Cb -0.42 -0.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 2wv5 s VAL 115 CO 0.37 0.16 -0.05 -0.69 0.00 0.00 0.00 175.10 174.89 2wv5 s VAL 116 N 1.99 3.35 -0.12 2.92 1.01 0.12 0.19 120.40 129.85 2wv5 s VAL 116 Ca 0.03 -0.51 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 2wv5 s VAL 116 Cb -0.12 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 2wv5 s VAL 116 CO -0.03 0.44 0.18 -0.83 0.00 0.00 0.00 175.10 174.86 2wv5 s GLY 117 N 1.34 2.19 -0.16 4.51 0.00 0.91 0.20 107.32 116.31 2wv5 s GLY 117 Ca 0.04 -0.58 -0.01 0.00 0.00 0.00 0.00 44.72 44.17 2wv5 s GLY 117 CO -0.03 -0.19 -0.12 0.14 0.00 0.00 0.00 173.10 172.91 2wv5 s VAL 118 N -0.76 3.02 0.03 1.40 1.01 0.75 -1.83 120.40 124.02 2wv5 s VAL 118 Ca 0.15 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.51 2wv5 s VAL 118 Cb -0.13 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 2wv5 s VAL 118 CO 0.04 0.50 -0.09 -0.69 0.00 0.00 0.00 175.10 174.86 2wv5 s VAL 119 N 0.76 0.68 -0.23 2.92 1.01 -0.12 -2.29 120.40 123.12 2wv5 s VAL 119 Ca -0.05 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 2wv5 s VAL 119 Cb -0.15 -0.68 0.12 0.00 0.00 0.00 0.00 36.38 35.68 2wv5 s VAL 119 CO 0.01 -0.19 0.36 0.21 0.00 0.00 0.00 175.10 175.49 2wv5 s ASN 120 N -1.21 0.32 -0.05 3.32 2.47 -1.24 -0.94 114.94 117.61 2wv5 s ASN 120 Ca -0.05 0.26 -0.26 0.00 0.42 0.00 0.00 52.86 53.23 2wv5 s ASN 120 Cb -0.08 1.05 0.06 0.00 -1.45 0.00 0.00 41.25 40.82 2wv5 s ASN 120 CO 0.01 -0.29 0.58 0.54 -3.72 0.00 0.00 177.10 174.22 2wv5 s ASN 121 N 2.52 -0.54 0.59 -4.21 2.20 -0.86 -3.59 114.94 111.06 2wv5 s ASN 121 Ca 0.10 0.58 0.31 0.00 -0.94 0.00 0.00 52.86 52.92 2wv5 s ASN 121 Cb -0.15 0.51 1.24 0.00 -2.00 0.00 0.00 41.25 40.85 2wv5 s ASN 121 CO -0.15 -0.55 1.55 0.00 -2.94 0.00 0.00 177.10 175.01 2wv5 h ALA 122 N 3.31 2.87 0.30 3.54 0.00 -1.87 0.15 119.26 127.56 2wv5 h ALA 122 Ca -0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2wv5 h ALA 122 Cb 1.15 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2wv5 h ALA 122 CO 0.38 -1.52 -0.14 0.22 0.00 0.00 0.00 179.25 178.19 2wv5 h ASP 123 N 0.00 -0.34 -0.01 0.00 3.58 -1.95 -3.40 116.42 114.29 2wv5 h ASP 123 Ca 0.47 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.94 2wv5 h ASP 123 Cb 2.48 0.09 0.00 0.00 1.72 0.00 0.00 39.33 43.62 2wv5 h ASP 123 CO -0.00 0.04 -0.15 1.33 -2.88 0.00 0.00 179.24 177.58 2wv5 n VAL 124 N -4.65 0.00 -3.58 2.25 0.24 -1.01 -5.10 118.33 106.47 2wv5 n VAL 124 Ca -0.05 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 2wv5 n VAL 124 Cb 0.16 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.70 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 0.84 0.23 3.53 7.63 0.00 0.48 -4.64 105.19 113.26 2wv5 n GLY 125 Ca 0.05 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 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 3.38 0.04 1.61 0.52 -1.26 -2.02 118.95 121.22 2wv5 s ARG 126 Ca 0.00 -0.19 0.06 0.00 -0.52 0.00 0.00 55.73 55.08 2wv5 s ARG 126 Cb 0.00 -3.94 -0.02 0.00 0.52 0.00 0.00 34.95 31.51 2wv5 s ARG 126 CO 0.00 -1.06 -0.17 -1.17 0.02 0.00 0.00 175.30 172.92 2wv5 s LEU 127 N 3.09 2.18 -0.14 2.53 0.20 -0.11 -5.00 118.68 121.42 2wv5 s LEU 127 Ca 0.27 -0.50 0.00 0.00 0.69 0.00 0.00 54.13 54.60 2wv5 s LEU 127 Cb -0.13 -0.77 0.02 0.00 -0.43 0.00 0.00 46.19 44.88 2wv5 s LEU 127 CO 0.21 0.09 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.59 2wv5 s ILE 128 N -0.84 1.53 -0.02 6.68 -1.09 -1.26 -0.95 121.20 125.24 2wv5 s ILE 128 Ca 0.04 -0.61 0.03 0.00 -2.23 0.00 0.00 60.65 57.89 2wv5 s ILE 128 Cb -0.08 -1.44 -0.03 0.00 -1.58 0.00 0.00 42.46 39.33 2wv5 s ILE 128 CO 0.02 0.45 -0.10 0.72 -1.23 0.00 0.00 174.94 174.79 2wv5 s PHE 129 N 1.45 2.80 0.12 3.97 -0.12 -0.76 -4.94 117.98 120.50 2wv5 s PHE 129 Ca 0.04 -0.09 0.02 0.00 -0.05 0.00 0.00 56.93 56.85 2wv5 s PHE 129 Cb -0.13 -1.61 -0.04 0.00 -0.63 0.00 0.00 43.02 40.61 2wv5 s PHE 129 CO -0.10 0.30 0.25 -1.54 -0.05 0.00 0.00 175.22 174.08 2wv5 s SER 130 N -1.12 6.31 -0.05 1.98 1.04 -1.26 -0.06 113.70 120.54 2wv5 s SER 130 Ca 0.14 0.19 -0.30 0.00 0.48 0.00 0.00 55.95 56.47 2wv5 s SER 130 Cb -0.11 -1.90 0.09 0.00 0.10 0.00 0.00 66.02 64.19 2wv5 s SER 130 CO 0.04 0.10 0.77 -0.83 0.98 0.00 0.00 173.24 174.29 2wv5 s GLY 131 N -2.96 -0.50 0.09 7.32 0.00 0.13 -4.58 107.32 106.82 2wv5 s GLY 131 Ca 0.34 1.37 -0.21 0.00 0.00 0.00 0.00 44.72 46.23 2wv5 s GLY 131 CO 0.28 0.82 0.62 -0.54 0.00 0.00 0.00 173.10 174.28 2wv5 s GLU 132 N -1.66 4.29 0.79 2.90 2.02 -0.93 -0.32 118.70 125.79 2wv5 s GLU 132 Ca -0.06 0.83 -0.11 0.00 0.02 0.00 0.00 54.97 55.66 2wv5 s GLU 132 Cb -0.00 -3.25 0.07 0.00 0.10 0.00 0.00 34.13 31.05 2wv5 s GLU 132 CO 0.03 0.62 1.09 0.00 0.02 0.00 0.00 175.26 177.02 2wv5 s ALA 133 N -1.10 2.16 0.00 5.21 0.00 0.14 -1.00 121.76 127.17 2wv5 s ALA 133 Ca 0.31 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.37 2wv5 s ALA 133 Cb -0.20 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2wv5 s ALA 133 CO 0.21 -1.81 0.00 1.28 0.00 0.00 0.00 175.76 175.44 2wv5 n LEU 134 N -3.53 0.00 -3.71 0.00 4.77 -1.16 -0.69 117.00 112.68 2wv5 n LEU 134 Ca 0.08 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.92 2wv5 n LEU 134 Cb 0.54 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.55 2wv5 n LEU 134 CO 0.55 0.00 0.11 0.42 -1.33 0.00 0.00 177.39 177.13 2wv5 s THR 135 N 0.41 0.05 0.93 -5.08 -4.23 -1.25 -4.14 115.64 102.33 2wv5 s THR 135 Ca 0.00 -0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 59.98 2wv5 s THR 135 Cb 0.00 -0.74 0.15 0.00 1.34 0.00 0.00 72.50 73.25 2wv5 s THR 135 CO 0.00 -0.22 1.09 -0.47 -0.54 0.00 0.00 174.62 174.48 2wv5 s TYR 136 N -1.53 2.23 -0.02 3.99 5.04 -1.26 -1.92 117.35 123.88 2wv5 s TYR 136 Ca -0.12 1.17 -0.03 0.00 -2.44 0.00 0.00 57.07 55.66 2wv5 s TYR 136 Cb -0.03 -3.20 0.01 0.00 0.35 0.00 0.00 41.96 39.08 2wv5 s TYR 136 CO 0.04 -2.59 0.07 0.15 -1.34 0.00 0.00 175.55 171.88 2wv5 s LYS 137 N -4.94 0.11 -0.06 4.97 -0.14 0.23 -4.83 119.74 115.09 2wv5 s LYS 137 Ca 0.64 0.05 -0.26 0.00 -1.36 0.00 0.00 55.97 55.04 2wv5 s LYS 137 Cb -0.18 0.05 -0.22 0.00 -1.68 0.00 0.00 37.83 35.80 2wv5 s LYS 137 CO 0.57 -0.02 1.09 -0.44 -0.76 0.00 0.00 175.35 175.80 2wv5 h ASP 138 N 5.90 0.06 -4.25 2.83 3.45 -1.94 -2.42 116.42 120.04 2wv5 h ASP 138 Ca -0.25 -0.68 -0.13 0.00 0.43 0.00 0.00 57.03 56.40 2wv5 h ASP 138 Cb 1.20 -0.02 -0.23 0.00 -0.56 0.00 0.00 39.33 39.73 2wv5 h ASP 138 CO 0.46 0.73 -0.29 -0.63 -1.57 0.00 0.00 179.24 177.94 2wv5 s ILE 139 N -3.49 0.02 -0.06 0.35 1.01 -1.26 -1.95 121.20 115.81 2wv5 s ILE 139 Ca -0.17 -0.16 0.05 0.00 0.00 0.00 0.00 60.65 60.37 2wv5 s ILE 139 Cb 0.00 -0.54 -0.00 0.00 0.01 0.00 0.00 42.46 41.93 2wv5 s ILE 139 CO 0.69 -0.09 -0.22 -0.69 0.00 0.00 0.00 174.94 174.64 2wv5 s VAL 140 N -0.33 1.82 -0.24 2.92 1.01 -0.83 -4.99 120.40 119.75 2wv5 s VAL 140 Ca -0.05 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.91 2wv5 s VAL 140 Cb -0.03 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 2wv5 s VAL 140 CO 0.02 0.51 0.18 -0.69 0.00 0.00 0.00 175.10 175.12 2wv5 s VAL 141 N 0.07 5.34 0.66 2.92 1.01 -1.26 -2.06 120.40 127.08 2wv5 s VAL 141 Ca -0.08 0.21 -0.09 0.00 0.00 0.00 0.00 61.98 62.02 2wv5 s VAL 141 Cb -0.14 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.73 2wv5 s VAL 141 CO 0.05 0.33 1.02 -0.76 0.00 0.00 0.00 175.10 175.73 2wv5 s LEU 142 N 1.16 3.04 0.38 3.92 1.43 0.16 -4.89 118.68 123.88 2wv5 s LEU 142 Ca 0.08 0.97 0.05 0.00 -1.03 0.00 0.00 54.13 54.20 2wv5 s LEU 142 Cb -0.14 -3.78 0.75 0.00 0.03 0.00 0.00 46.19 43.05 2wv5 s LEU 142 CO 0.05 -1.23 2.02 -0.03 0.23 0.00 0.00 176.35 177.40 2wv5 h MET 143 N -0.46 0.65 -0.95 1.70 1.85 -1.98 0.32 114.93 116.06 2wv5 h MET 143 Ca -0.45 -0.05 -0.02 0.00 -0.61 0.00 0.00 59.70 58.57 2wv5 h MET 143 Cb 1.25 -0.14 -0.01 0.00 0.43 0.00 0.00 31.60 33.13 2wv5 h MET 143 CO 0.63 0.45 0.03 -0.40 -0.40 0.00 0.00 176.91 177.22 2wv5 n ASP 144 N -4.44 2.13 -1.92 1.39 5.75 -1.26 -4.82 116.55 113.37 2wv5 n ASP 144 Ca 0.04 -2.17 -0.17 0.00 -0.01 0.00 0.00 54.79 52.48 2wv5 n ASP 144 Cb 0.07 -0.54 -0.04 0.00 -1.03 0.00 0.00 41.12 39.58 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 0.14 0.65 3.95 6.12 0.00 0.11 -4.97 105.19 111.19 2wv5 n GLY 145 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 2wv5 n GLY 145 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wv5 s ASP 146 N -2.26 5.97 -0.12 1.61 -1.08 -1.24 -4.75 116.67 114.80 2wv5 s ASP 146 Ca 0.00 0.38 0.02 0.00 -0.52 0.00 0.00 52.55 52.43 2wv5 s ASP 146 Cb 0.00 -1.71 -0.01 0.00 -1.46 0.00 0.00 42.92 39.75 2wv5 s ASP 146 CO 0.00 -0.60 -0.18 -0.89 0.52 0.00 0.00 175.17 174.02 2wv5 s THR 147 N -2.52 2.60 -0.14 1.71 2.01 -1.26 0.40 115.64 118.44 2wv5 s THR 147 Ca 0.46 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.65 2wv5 s THR 147 Cb -0.10 -2.06 0.02 0.00 0.01 0.00 0.00 72.50 70.38 2wv5 s THR 147 CO 0.38 0.54 -0.13 -0.04 -0.69 0.00 0.00 174.62 174.68 2wv5 s MET 148 N 0.42 2.14 0.34 4.92 -1.94 -0.88 -5.00 119.30 119.30 2wv5 s MET 148 Ca -0.13 -0.50 -0.07 0.00 -1.71 0.00 0.00 55.69 53.27 2wv5 s MET 148 Cb -0.17 -1.97 -0.06 0.00 2.01 0.00 0.00 34.83 34.64 2wv5 s MET 148 CO 0.06 -0.22 0.65 -1.25 -0.01 0.00 0.00 175.02 174.25 2wv5 s PRO 149 N 1.45 3.70 -0.80 2.03 0.04 -1.26 -1.96 135.00 138.20 2wv5 s PRO 149 Ca 0.03 0.21 -0.01 0.00 0.04 0.00 0.00 61.00 61.27 2wv5 s PRO 149 Cb -0.13 -2.54 -0.00 0.00 0.04 0.00 0.00 34.50 31.87 2wv5 s PRO 149 CO -0.09 0.11 0.70 0.41 0.04 0.00 0.00 177.00 178.17 2wv5 n GLY 150 N -1.08 -1.24 3.48 0.56 0.00 -0.82 -4.48 105.19 101.62 2wv5 n GLY 150 Ca 0.00 0.51 -0.27 0.00 0.00 0.00 0.00 46.02 46.26 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 -4.43 2.65 -0.22 0.99 1.43 -0.91 -1.51 118.68 116.68 2wv5 s LEU 151 Ca 0.05 -0.76 -0.01 0.00 -1.03 0.00 0.00 54.13 52.38 2wv5 s LEU 151 Cb -0.01 -1.35 0.02 0.00 0.03 0.00 0.00 46.19 44.87 2wv5 s LEU 151 CO 0.79 0.11 -0.10 0.12 0.23 0.00 0.00 176.35 177.49 2wv5 s PHE 152 N -1.73 2.95 0.56 0.29 5.36 -0.53 0.75 117.98 125.63 2wv5 s PHE 152 Ca 0.23 -1.45 -0.06 0.00 -0.96 0.00 0.00 56.93 54.69 2wv5 s PHE 152 Cb -0.08 -2.02 -0.01 0.00 -0.34 0.00 0.00 43.02 40.57 2wv5 s PHE 152 CO 0.12 -0.71 0.87 0.00 -1.46 0.00 0.00 175.22 174.04 2wv5 s ALA 153 N 1.35 3.31 -0.24 11.12 0.00 -0.81 -2.43 121.76 134.06 2wv5 s ALA 153 Ca 0.03 -0.57 -0.27 0.00 0.00 0.00 0.00 51.96 51.15 2wv5 s ALA 153 Cb -0.15 -2.64 0.13 0.00 0.00 0.00 0.00 23.12 20.46 2wv5 s ALA 153 CO -0.07 -0.64 1.08 1.52 0.00 0.00 0.00 175.76 177.65 2wv5 s TYR 154 N -2.93 -0.37 -0.11 0.00 -0.85 -0.49 -2.99 117.35 109.61 2wv5 s TYR 154 Ca 0.52 0.82 -0.30 0.00 -0.52 0.00 0.00 57.07 57.59 2wv5 s TYR 154 Cb -0.10 0.41 -0.03 0.00 0.38 0.00 0.00 41.96 42.62 2wv5 s TYR 154 CO 0.46 -0.24 1.34 0.15 -1.52 0.00 0.00 175.55 175.74 2wv5 s LYS 155 N -0.30 4.25 -0.17 -3.49 3.01 -0.17 0.03 119.74 122.89 2wv5 s LYS 155 Ca 0.02 1.80 -0.31 0.00 -1.01 0.00 0.00 55.97 56.47 2wv5 s LYS 155 Cb -0.03 -3.74 0.14 0.00 -1.01 0.00 0.00 37.83 33.18 2wv5 s LYS 155 CO -0.05 -0.67 1.11 0.00 0.51 0.00 0.00 175.35 176.25 2wv5 s ALA 156 N 3.23 -1.99 -0.45 5.17 0.00 -0.72 -2.19 121.76 124.82 2wv5 s ALA 156 Ca 0.59 1.57 -0.21 0.00 0.00 0.00 0.00 51.96 53.91 2wv5 s ALA 156 Cb -0.25 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.33 2wv5 s ALA 156 CO 0.20 -0.42 0.68 0.00 0.00 0.00 0.00 175.76 176.22 2wv5 s ALA 157 N -1.71 3.33 0.04 0.00 0.00 -1.26 -3.81 121.76 118.35 2wv5 s ALA 157 Ca 0.04 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 50.83 2wv5 s ALA 157 Cb -0.01 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 2wv5 s ALA 157 CO -0.03 -1.85 -0.09 0.95 0.00 0.00 0.00 175.76 174.73 2wv5 s THR 158 N 2.95 0.69 0.50 0.00 -4.23 -1.26 -4.95 115.64 109.34 2wv5 s THR 158 Ca 0.24 -1.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.77 2wv5 s THR 158 Cb -0.14 -0.70 -0.02 0.00 1.34 0.00 0.00 72.50 72.98 2wv5 s THR 158 CO 0.19 -0.24 0.04 -0.13 -0.54 0.00 0.00 174.62 173.94 2wv5 s ARG 159 N -1.37 2.18 0.32 3.99 0.52 -1.26 -4.85 118.95 118.49 2wv5 s ARG 159 Ca -0.06 -2.34 -0.28 0.00 -0.52 0.00 0.00 55.73 52.54 2wv5 s ARG 159 Cb -0.09 -1.59 -0.09 0.00 0.52 0.00 0.00 34.95 33.70 2wv5 s ARG 159 CO 0.01 -0.35 1.11 0.00 0.02 0.00 0.00 175.30 176.09 2wv5 s ALA 160 N -2.85 3.31 0.00 2.13 0.00 -1.26 -2.83 121.76 120.26 2wv5 s ALA 160 Ca 0.11 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.95 2wv5 s ALA 160 Cb 0.02 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.81 2wv5 s ALA 160 CO 0.06 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2wv5 n GLY 161 N 0.91 2.33 0.27 0.00 0.00 -1.26 -4.92 105.19 102.51 2wv5 n GLY 161 Ca 0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.42 1.61 -1.99 -1.83 -3.28 116.97 109.06 2wv5 h TYR 162 Ca 0.00 0.00 -0.61 0.00 2.00 0.00 0.00 58.73 60.12 2wv5 h TYR 162 Cb 0.00 0.00 0.11 0.00 2.00 0.00 0.00 36.73 38.84 2wv5 h TYR 162 CO 0.00 0.02 0.14 0.00 -0.00 0.00 0.00 178.16 178.32 2wv5 n ALA 163 N -2.11 -0.27 -0.05 3.88 0.00 -1.26 -1.23 120.51 119.47 2wv5 n ALA 163 Ca 0.01 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2wv5 n ALA 163 Cb 0.34 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 1.30 0.97 3.83 0.00 0.00 -0.18 0.15 105.19 111.26 2wv5 n GLY 164 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.90 2.26 0.09 -0.02 0.00 -0.36 -3.27 107.32 104.12 2wv5 s GLY 165 Ca 0.00 0.34 -0.17 0.00 0.00 0.00 0.00 44.72 44.89 2wv5 s GLY 165 CO 0.00 0.62 0.54 0.00 0.00 0.00 0.00 173.10 174.26 2wv5 s ALA 166 N -2.35 3.60 -0.17 3.20 0.00 -0.97 0.68 121.76 125.75 2wv5 s ALA 166 Ca 0.61 -0.05 -0.05 0.00 0.00 0.00 0.00 51.96 52.47 2wv5 s ALA 166 Cb -0.10 -2.57 -0.03 0.00 0.00 0.00 0.00 23.12 20.42 2wv5 s ALA 166 CO 0.22 0.43 -0.01 0.08 0.00 0.00 0.00 175.76 176.48 2wv5 s VAL 167 N -1.23 4.17 -0.15 0.00 1.01 -0.52 -0.18 120.40 123.51 2wv5 s VAL 167 Ca 0.31 -0.26 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 2wv5 s VAL 167 Cb -0.18 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 2wv5 s VAL 167 CO 0.18 0.48 0.10 -0.76 0.00 0.00 0.00 175.10 175.11 2wv5 s LEU 168 N 0.38 4.13 0.02 3.92 1.43 0.54 -1.70 118.68 127.40 2wv5 s LEU 168 Ca -0.02 0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 2wv5 s LEU 168 Cb -0.14 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 2wv5 s LEU 168 CO 0.02 0.30 -0.06 0.00 0.23 0.00 0.00 176.35 176.84 2wv5 s ALA 169 N -0.39 0.48 -0.27 4.21 0.00 -0.40 0.14 121.76 125.53 2wv5 s ALA 169 Ca 0.11 -0.54 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 2wv5 s ALA 169 Cb -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.00 2wv5 s ALA 169 CO 0.02 0.02 1.19 0.15 0.00 0.00 0.00 175.76 177.13 2wv5 s LYS 170 N -1.01 4.07 -0.80 0.00 -0.14 -1.08 -1.44 119.74 119.34 2wv5 s LYS 170 Ca -0.06 1.30 0.02 0.00 -1.36 0.00 0.00 55.97 55.87 2wv5 s LYS 170 Cb -0.07 -3.78 0.27 0.00 -1.68 0.00 0.00 37.83 32.57 2wv5 s LYS 170 CO 0.00 -0.90 1.03 -3.47 -0.76 0.00 0.00 175.35 171.25 2wv5 n ASP 171 N 7.01 4.79 0.00 2.83 2.03 -0.25 -4.72 116.55 128.24 2wv5 n ASP 171 Ca 0.13 -3.45 0.00 0.00 0.52 0.00 0.00 54.79 52.00 2wv5 n ASP 171 Cb 0.46 -0.89 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 2wv5 n ASP 171 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wv5 n GLY 172 N 0.97 -1.50 0.24 0.27 0.00 -1.26 -3.40 105.19 100.50 2wv5 n GLY 172 Ca 0.29 -1.32 -0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 0.79 -1.92 4.61 0.00 -2.01 -3.38 119.26 117.35 2wv5 h ALA 173 Ca 0.00 0.07 -0.58 0.00 0.00 0.00 0.00 54.91 54.41 2wv5 h ALA 173 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2wv5 h ALA 173 CO 0.00 -0.16 1.45 0.16 0.00 0.00 0.00 179.25 180.69 2wv5 s ASP 174 N -5.41 5.49 0.57 0.00 1.47 -1.22 -4.99 116.67 112.57 2wv5 s ASP 174 Ca -0.13 1.66 -0.05 0.00 1.18 0.00 0.00 52.55 55.21 2wv5 s ASP 174 Cb 0.17 -2.51 0.00 0.00 -0.34 0.00 0.00 42.92 40.23 2wv5 s ASP 174 CO 0.75 -1.97 0.87 -0.89 0.68 0.00 0.00 175.17 174.61 2wv5 s THR 175 N 8.23 3.88 0.18 2.11 2.01 -1.26 -1.09 115.64 129.70 2wv5 s THR 175 Ca 0.95 0.02 -0.08 0.00 0.31 0.00 0.00 61.69 62.89 2wv5 s THR 175 Cb -0.29 -3.52 0.03 0.00 0.01 0.00 0.00 72.50 68.73 2wv5 s THR 175 CO 0.34 -0.53 0.40 2.22 -0.69 0.00 0.00 174.62 176.36 2wv5 n PHE 176 N -2.51 -1.56 -3.65 4.92 1.16 -0.52 -4.84 117.46 110.46 2wv5 n PHE 176 Ca 0.04 -0.86 -0.39 0.00 -1.87 0.00 0.00 57.45 54.36 2wv5 n PHE 176 Cb 0.57 0.43 -0.11 0.00 -1.61 0.00 0.00 39.48 38.76 2wv5 n PHE 176 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2wv5 s ILE 177 N -2.53 4.21 0.32 1.97 1.01 -0.68 -1.27 121.20 124.23 2wv5 s ILE 177 Ca 0.08 -1.09 0.10 0.00 0.00 0.00 0.00 60.65 59.74 2wv5 s ILE 177 Cb -0.02 -3.42 0.04 0.00 0.01 0.00 0.00 42.46 39.07 2wv5 s ILE 177 CO 0.05 -0.28 1.72 0.58 0.00 0.00 0.00 174.94 177.01 2wv5 h VAL 178 N 6.03 1.33 0.00 2.92 2.07 -1.65 -3.40 116.25 123.55 2wv5 h VAL 178 Ca -0.24 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.68 2wv5 h VAL 178 Cb 1.09 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 2wv5 h VAL 178 CO 0.67 0.46 0.00 0.61 0.02 0.00 0.00 177.57 179.33 2wv5 n GLY 179 N -0.17 -0.29 3.07 2.17 0.00 -1.26 -2.13 105.19 106.58 2wv5 n GLY 179 Ca -0.02 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.74 1.21 0.14 2.61 -4.23 -0.95 -1.44 115.64 109.24 2wv5 s THR 180 Ca 0.00 -0.56 -0.34 0.00 -1.18 0.00 0.00 61.69 59.61 2wv5 s THR 180 Cb 0.00 -1.07 -0.16 0.00 1.34 0.00 0.00 72.50 72.60 2wv5 s THR 180 CO 0.00 0.36 1.17 1.57 -0.54 0.00 0.00 174.62 177.18 2wv5 n HIS 181 N 3.47 1.21 0.00 3.99 -0.00 0.21 -1.81 115.22 122.28 2wv5 n HIS 181 Ca -0.20 0.72 0.00 0.00 0.46 0.00 0.00 57.72 58.70 2wv5 n HIS 181 Cb 0.53 -2.26 0.00 0.00 -0.12 0.00 0.00 29.99 28.14 2wv5 n HIS 181 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2wv5 n SER 182 N 2.09 0.05 -4.10 0.26 7.64 -0.66 -1.01 113.62 117.89 2wv5 n SER 182 Ca 0.16 0.01 -0.08 0.00 1.01 0.00 0.00 58.87 59.97 2wv5 n SER 182 Cb 0.22 -0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.30 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 -2.00 0.59 0.22 -0.43 0.00 -1.00 -4.78 121.76 114.35 2wv5 s ALA 183 Ca 0.00 -1.18 -0.17 0.00 0.00 0.00 0.00 51.96 50.60 2wv5 s ALA 183 Cb 0.00 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.37 2wv5 s ALA 183 CO 0.00 -0.32 0.55 0.20 0.00 0.00 0.00 175.76 176.20 2wv5 s GLY 184 N -2.80 -0.00 0.00 0.00 0.00 -1.26 -0.47 107.32 102.78 2wv5 s GLY 184 Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.45 2wv5 s GLY 184 CO -0.08 -0.28 0.00 0.61 0.00 0.00 0.00 173.10 173.35 2wv5 n GLY 185 N -0.37 2.88 3.85 0.20 0.00 -0.54 -5.02 105.19 106.20 2wv5 n GLY 185 Ca -0.08 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.29 0.00 1.61 5.15 -1.26 -1.94 115.26 116.53 2wv5 n ASN 186 Ca 0.00 -0.86 0.00 0.00 -0.60 0.00 0.00 54.58 53.12 2wv5 n ASN 186 Cb 0.00 -3.72 0.00 0.00 -0.53 0.00 0.00 39.78 35.53 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 -1.68 1.28 3.46 8.20 0.00 -1.26 -5.01 105.19 110.17 2wv5 n GLY 187 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.67 2.50 0.16 1.61 0.11 -0.82 -1.76 120.40 118.53 2wv5 s VAL 188 Ca 0.00 -2.19 0.06 0.00 -2.93 0.00 0.00 61.98 56.92 2wv5 s VAL 188 Cb 0.00 -2.26 -0.04 0.00 -1.53 0.00 0.00 36.38 32.55 2wv5 s VAL 188 CO 0.00 -0.26 -0.12 -0.83 -3.33 0.00 0.00 175.10 170.55 2wv5 s GLY 189 N -3.12 1.18 -0.04 6.54 0.00 0.10 -1.46 107.32 110.53 2wv5 s GLY 189 Ca 0.26 -1.49 -0.04 0.00 0.00 0.00 0.00 44.72 43.45 2wv5 s GLY 189 CO 0.13 -1.58 0.11 -0.19 0.00 0.00 0.00 173.10 171.56 2wv5 s TYR 190 N -2.91 -0.10 0.04 1.90 1.51 0.38 -1.40 117.35 116.76 2wv5 s TYR 190 Ca 0.17 0.25 0.03 0.00 -1.01 0.00 0.00 57.07 56.50 2wv5 s TYR 190 Cb -0.00 0.03 -0.02 0.00 -0.11 0.00 0.00 41.96 41.85 2wv5 s TYR 190 CO 0.03 -0.07 -0.08 0.00 -1.11 0.00 0.00 175.55 174.31 2wv5 s SER 192 N -1.30 6.94 0.17 0.00 0.01 -0.75 -1.45 113.70 117.32 2wv5 s SER 192 Ca -0.06 2.06 -0.30 0.00 1.31 0.00 0.00 55.95 58.96 2wv5 s SER 192 Cb -0.08 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.51 2wv5 s SER 192 CO 0.01 -0.62 0.96 0.00 0.41 0.00 0.00 173.24 174.00 2wv5 s VAL 194 N -0.51 1.69 0.60 0.00 1.01 -0.91 -4.96 120.40 117.33 2wv5 s VAL 194 Ca 0.45 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.53 2wv5 s VAL 194 Cb -0.25 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2wv5 s VAL 194 CO 0.31 0.48 1.08 -0.55 0.00 0.00 0.00 175.10 176.42 2wv5 s SER 195 N 1.12 5.60 0.02 3.32 0.15 -1.26 -4.41 113.70 118.24 2wv5 s SER 195 Ca -0.02 1.91 -0.20 0.00 0.70 0.00 0.00 55.95 58.33 2wv5 s SER 195 Cb -0.14 -2.54 -0.17 0.00 -1.71 0.00 0.00 66.02 61.45 2wv5 s SER 195 CO -0.05 -1.30 1.24 -0.09 1.20 0.00 0.00 173.24 174.24 2wv5 h ARG 196 N 0.42 0.37 -0.41 5.44 2.43 -1.27 -2.67 114.38 118.69 2wv5 h ARG 196 Ca -0.47 -0.26 0.05 0.00 -0.81 0.00 0.00 59.98 58.49 2wv5 h ARG 196 Cb 1.23 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.78 2wv5 h ARG 196 CO 0.56 0.88 0.13 0.77 -1.51 0.00 0.00 179.97 180.80 2wv5 h SER 197 N -0.08 0.12 -0.98 -3.80 0.02 -1.93 0.26 113.55 107.16 2wv5 h SER 197 Ca -0.01 0.05 0.34 0.00 -0.84 0.00 0.00 61.79 61.33 2wv5 h SER 197 Cb 0.89 0.04 -0.16 0.00 0.14 0.00 0.00 62.40 63.31 2wv5 h SER 197 CO 0.06 0.10 0.45 0.24 -1.14 0.00 0.00 176.83 176.54 2wv5 h MET 198 N 0.28 0.16 0.05 3.45 2.86 -1.88 0.32 114.93 120.18 2wv5 h MET 198 Ca 0.19 -0.01 -0.29 0.00 -2.06 0.00 0.00 59.70 57.53 2wv5 h MET 198 Cb 0.19 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 2wv5 h MET 198 CO -0.21 0.10 -1.54 -0.07 1.06 0.00 0.00 176.91 176.26 2wv5 h LEU 199 N 0.16 0.18 -0.70 1.22 3.38 -0.59 -3.17 115.31 115.78 2wv5 h LEU 199 Ca 0.73 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 58.46 2wv5 h LEU 199 Cb 1.73 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 42.38 2wv5 h LEU 199 CO -0.70 1.24 0.42 1.56 0.09 0.00 0.00 178.44 181.05 2wv5 h GLN 200 N 0.03 0.77 0.05 1.13 1.08 0.28 0.65 115.11 119.09 2wv5 h GLN 200 Ca -0.23 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2wv5 h GLN 200 Cb 1.97 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 29.23 2wv5 h GLN 200 CO 0.12 0.51 -0.02 0.87 -0.95 0.00 0.00 178.83 179.35 2wv5 h LYS 201 N 0.79 -0.06 0.00 1.46 6.56 -1.21 -2.57 116.57 121.54 2wv5 h LYS 201 Ca 0.30 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.88 2wv5 h LYS 201 Cb 0.12 0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 31.79 2wv5 h LYS 201 CO -0.15 0.36 -0.09 1.98 -2.06 0.00 0.00 179.45 179.49 2wv5 h MET 202 N -0.50 0.00 0.06 3.15 1.85 -1.50 -2.59 114.93 115.40 2wv5 h MET 202 Ca -0.01 0.00 -0.24 0.00 -0.61 0.00 0.00 59.70 58.85 2wv5 h MET 202 Cb 0.45 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.48 2wv5 h MET 202 CO 0.01 0.09 -1.06 -0.22 -0.40 0.00 0.00 176.91 175.33 2wv5 h LYS 203 N 0.00 0.26 -0.28 0.39 3.64 -0.80 -3.19 116.57 116.60 2wv5 h LYS 203 Ca -0.00 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2wv5 h LYS 203 Cb 0.22 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2wv5 h LYS 203 CO 0.01 1.11 0.00 0.00 -2.27 0.00 0.00 179.45 178.30 2wv5 n ALA 204 N -2.50 2.48 0.88 5.00 0.00 -0.98 -3.03 120.51 122.36 2wv5 n ALA 204 Ca -0.06 -0.64 0.10 0.00 0.00 0.00 0.00 53.44 52.85 2wv5 n ALA 204 Cb 0.92 -1.02 0.06 0.00 0.00 0.00 0.00 19.45 19.41 2wv5 n ALA 204 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2wv5 n HIS 205 N 0.57 0.00 -0.95 0.00 -0.00 -1.01 -5.08 115.22 108.74 2wv5 n HIS 205 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.87 2wv5 n HIS 205 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.35 2wv5 n HIS 205 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62