#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wv4 h LEU 8 N 0.00 0.52 -0.65 -2.12 5.85 -1.99 1.00 115.31 117.91 2wv4 h LEU 8 Ca 0.00 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.77 2wv4 h LEU 8 Cb 0.00 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 40.82 2wv4 h LEU 8 CO 0.00 0.42 0.26 -0.61 -0.34 0.00 0.00 178.44 178.17 2wv4 h GLN 9 N 0.58 0.44 -0.31 1.25 4.15 -2.01 0.11 115.11 119.31 2wv4 h GLN 9 Ca 0.16 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.43 2wv4 h GLN 9 Cb -0.00 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 2wv4 h GLN 9 CO -0.03 0.29 -0.31 0.87 -1.93 0.00 0.00 178.83 177.72 2wv4 h LYS 10 N 0.45 0.65 -0.81 1.69 1.57 -1.86 -2.13 116.57 116.13 2wv4 h LYS 10 Ca 0.33 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2wv4 h LYS 10 Cb 0.42 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 2wv4 h LYS 10 CO -0.32 0.88 0.48 0.52 -0.57 0.00 0.00 179.45 180.45 2wv4 h MET 11 N 0.55 1.11 0.00 3.15 2.86 0.10 -2.21 114.93 120.49 2wv4 h MET 11 Ca 0.06 -0.10 -0.10 0.00 -2.06 0.00 0.00 59.70 57.50 2wv4 h MET 11 Cb 0.81 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 2wv4 h MET 11 CO 0.07 0.78 -0.49 0.28 1.06 0.00 0.00 176.91 178.61 2wv4 h VAL 12 N 1.12 1.29 -0.63 -2.22 2.07 -0.63 -2.90 116.25 114.34 2wv4 h VAL 12 Ca 0.29 -1.73 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 2wv4 h VAL 12 Cb -0.03 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2wv4 h VAL 12 CO -0.05 0.48 0.14 0.24 0.02 0.00 0.00 177.57 178.40 2wv4 h MET 13 N 0.00 1.00 -0.06 1.57 2.86 -0.78 -2.42 114.93 117.10 2wv4 h MET 13 Ca -0.00 -0.23 -0.08 0.00 -2.06 0.00 0.00 59.70 57.33 2wv4 h MET 13 Cb 0.91 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.42 2wv4 h MET 13 CO 0.06 0.90 -0.32 0.78 1.06 0.00 0.00 176.91 179.40 2wv4 h GLY 14 N 1.04 0.13 1.08 8.32 0.00 -1.27 -3.00 103.07 109.36 2wv4 h GLY 14 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2wv4 h GLY 14 CO 0.00 0.09 -0.45 0.70 0.00 0.00 0.00 176.54 176.89 2wv4 n ASN 15 N -4.13 0.46 -4.59 0.19 4.13 -1.09 -4.83 115.26 105.41 2wv4 n ASN 15 Ca -0.02 -0.19 -0.42 0.00 1.68 0.00 0.00 54.58 55.63 2wv4 n ASN 15 Cb 0.38 0.18 -0.05 0.00 -1.54 0.00 0.00 39.78 38.75 2wv4 n ASN 15 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2wv4 s THR 16 N -2.99 4.72 0.06 3.41 2.01 -0.93 -0.51 115.64 121.41 2wv4 s THR 16 Ca 0.12 0.90 0.06 0.00 0.31 0.00 0.00 61.69 63.08 2wv4 s THR 16 Cb 0.18 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 2wv4 s THR 16 CO 0.68 -0.45 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.50 2wv4 s LYS 17 N 3.13 2.17 0.67 4.92 -0.14 -0.19 -4.82 119.74 125.47 2wv4 s LYS 17 Ca 0.32 -0.96 -0.13 0.00 -1.36 0.00 0.00 55.97 53.84 2wv4 s LYS 17 Cb -0.13 -2.29 0.00 0.00 -1.68 0.00 0.00 37.83 33.74 2wv4 s LYS 17 CO 0.17 0.54 1.08 -1.25 -0.76 0.00 0.00 175.35 175.13 2wv4 s PRO 18 N -1.75 2.87 -0.01 -1.68 0.04 -1.07 -1.45 135.00 131.94 2wv4 s PRO 18 Ca 0.18 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2wv4 s PRO 18 Cb -0.11 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.48 2wv4 s PRO 18 CO 0.09 -1.17 0.02 0.08 0.04 0.00 0.00 177.00 176.06 2wv4 s VAL 19 N -2.67 -0.03 -0.00 -0.36 1.01 -0.21 -1.40 120.40 116.74 2wv4 s VAL 19 Ca 0.63 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.75 2wv4 s VAL 19 Cb -0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 36.38 36.15 2wv4 s VAL 19 CO 0.46 0.05 -0.09 -1.61 0.00 0.00 0.00 175.10 173.91 2wv4 s GLU 20 N 0.59 0.74 -0.17 2.72 8.01 -0.79 -2.17 118.70 127.63 2wv4 s GLU 20 Ca -0.05 -0.36 -0.06 0.00 0.01 0.00 0.00 54.97 54.51 2wv4 s GLU 20 Cb -0.07 -0.71 -0.04 0.00 -4.31 0.00 0.00 34.13 29.00 2wv4 s GLU 20 CO -0.02 0.19 0.03 -0.51 0.01 0.00 0.00 175.26 174.97 2wv4 s LEU 21 N -0.30 3.65 -0.15 1.80 1.43 0.17 -1.12 118.68 124.16 2wv4 s LEU 21 Ca 0.03 0.04 -0.00 0.00 -1.03 0.00 0.00 54.13 53.17 2wv4 s LEU 21 Cb -0.04 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2wv4 s LEU 21 CO -0.00 0.20 -0.14 -0.63 0.23 0.00 0.00 176.35 176.01 2wv4 s ILE 22 N 0.23 2.88 -0.20 -0.59 -1.09 -0.18 -0.23 121.20 122.02 2wv4 s ILE 22 Ca 0.02 -0.71 -0.00 0.00 -2.23 0.00 0.00 60.65 57.73 2wv4 s ILE 22 Cb -0.13 -2.22 0.05 0.00 -1.58 0.00 0.00 42.46 38.59 2wv4 s ILE 22 CO 0.01 0.51 -0.03 -0.22 -1.23 0.00 0.00 174.94 173.98 2wv4 s LEU 23 N 0.64 1.94 -1.36 2.97 2.96 0.11 -1.45 118.68 124.47 2wv4 s LEU 23 Ca -0.07 -0.92 -0.07 0.00 -0.22 0.00 0.00 54.13 52.85 2wv4 s LEU 23 Cb -0.16 -0.96 0.03 0.00 0.50 0.00 0.00 46.19 45.60 2wv4 s LEU 23 CO 0.03 -0.23 0.99 0.47 -1.32 0.00 0.00 176.35 176.28 2wv4 n ASP 24 N 4.82 -3.95 0.00 3.68 8.00 -1.26 -1.86 116.55 125.98 2wv4 n ASP 24 Ca -0.11 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.71 2wv4 n ASP 24 Cb 0.46 -4.54 0.00 0.00 -0.02 0.00 0.00 41.12 37.02 2wv4 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wv4 n GLY 25 N -1.65 0.63 3.36 0.44 0.00 -1.26 -5.02 105.19 101.69 2wv4 n GLY 25 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 2wv4 n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wv4 s LYS 26 N -0.18 2.79 -0.47 1.61 2.20 -0.78 -5.07 119.74 119.84 2wv4 s LYS 26 Ca 0.00 -0.77 -0.28 0.00 -0.36 0.00 0.00 55.97 54.55 2wv4 s LYS 26 Cb 0.00 -2.37 0.01 0.00 -1.51 0.00 0.00 37.83 33.96 2wv4 s LYS 26 CO 0.00 0.41 1.40 0.99 -0.36 0.00 0.00 175.35 177.79 2wv4 s THR 27 N -0.18 3.88 -1.32 3.43 2.01 -1.26 0.06 115.64 122.25 2wv4 s THR 27 Ca -0.01 0.85 0.24 0.00 0.31 0.00 0.00 61.69 63.07 2wv4 s THR 27 Cb -0.13 -4.30 -0.01 0.00 0.01 0.00 0.00 72.50 68.06 2wv4 s THR 27 CO 0.03 -0.91 1.24 1.33 -0.69 0.00 0.00 174.62 175.62 2wv4 n VAL 28 N 7.00 0.00 -3.61 3.82 0.24 0.68 -4.96 118.33 121.50 2wv4 n VAL 28 Ca 0.15 -0.07 -0.09 0.00 -2.04 0.00 0.00 64.34 62.29 2wv4 n VAL 28 Cb 0.48 0.67 -0.06 0.00 -1.47 0.00 0.00 33.84 33.46 2wv4 n VAL 28 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wv4 s ALA 29 N -2.81 -1.97 0.03 2.33 0.00 -1.23 -4.97 121.76 113.13 2wv4 s ALA 29 Ca 0.14 1.75 0.05 0.00 0.00 0.00 0.00 51.96 53.90 2wv4 s ALA 29 Cb 0.17 -1.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 2wv4 s ALA 29 CO 0.69 -0.26 -0.14 0.42 0.00 0.00 0.00 175.76 176.48 2wv4 s ILE 30 N -0.33 1.08 0.03 0.00 1.01 -1.26 -0.65 121.20 121.07 2wv4 s ILE 30 Ca 0.01 -0.87 -0.10 0.00 0.00 0.00 0.00 60.65 59.69 2wv4 s ILE 30 Cb -0.03 -0.96 0.03 0.00 0.01 0.00 0.00 42.46 41.52 2wv4 s ILE 30 CO -0.03 0.08 0.47 0.00 0.00 0.00 0.00 174.94 175.45 2wv4 s ALA 33 N -2.68 -0.17 -0.31 0.00 0.00 -0.53 -4.25 121.76 113.82 2wv4 s ALA 33 Ca 0.34 0.41 -0.08 0.00 0.00 0.00 0.00 51.96 52.63 2wv4 s ALA 33 Cb 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.89 2wv4 s ALA 33 CO 0.19 -0.10 0.12 0.99 0.00 0.00 0.00 175.76 176.96 2wv4 s THR 34 N 0.65 4.30 0.27 0.00 2.01 -0.57 -1.03 115.64 121.27 2wv4 s THR 34 Ca -0.05 -0.58 -0.29 0.00 0.31 0.00 0.00 61.69 61.08 2wv4 s THR 34 Cb -0.07 -3.21 -0.10 0.00 0.01 0.00 0.00 72.50 69.13 2wv4 s THR 34 CO -0.03 0.06 1.27 -0.83 -0.69 0.00 0.00 174.62 174.40 2wv4 s GLY 35 N 1.56 2.78 -0.02 4.40 0.00 0.33 -0.92 107.32 115.45 2wv4 s GLY 35 Ca 0.03 1.14 0.02 0.00 0.00 0.00 0.00 44.72 45.91 2wv4 s GLY 35 CO 0.04 1.91 0.01 3.33 0.00 0.00 0.00 173.10 178.39 2wv4 n VAL 36 N 1.63 0.17 -3.61 1.40 0.24 -0.16 -4.81 118.33 113.18 2wv4 n VAL 36 Ca 0.02 -0.10 -0.05 0.00 -2.04 0.00 0.00 64.34 62.17 2wv4 n VAL 36 Cb 0.43 -0.92 -0.04 0.00 -1.47 0.00 0.00 33.84 31.84 2wv4 n VAL 36 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2wv4 s PHE 37 N -2.06 -0.16 0.00 6.34 -0.12 -1.24 -0.64 117.98 120.11 2wv4 s PHE 37 Ca -0.01 0.22 0.00 0.00 -0.05 0.00 0.00 56.93 57.09 2wv4 s PHE 37 Cb 0.01 0.49 0.00 0.00 -0.63 0.00 0.00 43.02 42.89 2wv4 s PHE 37 CO 0.10 -0.17 0.00 0.41 -0.05 0.00 0.00 175.22 175.50 2wv4 n GLY 38 N 0.38 2.84 1.62 1.99 0.00 -1.26 0.29 105.19 111.06 2wv4 n GLY 38 Ca -0.03 0.28 -0.16 0.00 0.00 0.00 0.00 46.02 46.12 2wv4 n GLY 38 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wv4 n THR 39 N 0.00 2.49 -3.97 2.61 -2.24 -1.26 -0.76 114.28 111.14 2wv4 n THR 39 Ca 0.00 -3.84 -0.35 0.00 -2.27 0.00 0.00 64.05 57.59 2wv4 n THR 39 Cb 0.00 -0.86 -0.09 0.00 -2.10 0.00 0.00 70.33 67.28 2wv4 n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wv4 s ALA 40 N -3.50 3.49 -0.02 6.98 0.00 0.14 -1.76 121.76 127.10 2wv4 s ALA 40 Ca 0.48 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.74 2wv4 s ALA 40 Cb 0.40 -1.94 -0.00 0.00 0.00 0.00 0.00 23.12 21.58 2wv4 s ALA 40 CO 0.01 0.25 -0.10 0.71 0.00 0.00 0.00 175.76 176.62 2wv4 s TYR 41 N 0.15 1.00 -0.01 0.00 1.51 -0.32 -0.99 117.35 118.70 2wv4 s TYR 41 Ca 0.06 -0.23 -0.22 0.00 -1.01 0.00 0.00 57.07 55.67 2wv4 s TYR 41 Cb -0.12 -0.68 -0.05 0.00 -0.11 0.00 0.00 41.96 41.00 2wv4 s TYR 41 CO 0.00 -0.07 0.64 -0.51 -1.11 0.00 0.00 175.55 174.50 2wv4 s LEU 42 N -0.02 4.40 0.15 -1.29 1.43 -0.09 0.79 118.68 124.05 2wv4 s LEU 42 Ca 0.00 1.20 -0.04 0.00 -1.03 0.00 0.00 54.13 54.26 2wv4 s LEU 42 Cb -0.07 -2.99 -0.03 0.00 0.03 0.00 0.00 46.19 43.13 2wv4 s LEU 42 CO 0.00 0.05 0.15 0.68 0.23 0.00 0.00 176.35 177.46 2wv4 s VAL 43 N 0.00 0.08 0.11 -1.59 -7.23 -0.11 -1.51 120.40 110.15 2wv4 s VAL 43 Ca 0.33 -1.72 -0.31 0.00 -1.81 0.00 0.00 61.98 58.47 2wv4 s VAL 43 Cb -0.18 -2.01 -0.07 0.00 0.56 0.00 0.00 36.38 34.68 2wv4 s VAL 43 CO 0.18 -0.36 1.25 -2.84 -0.31 0.00 0.00 175.10 173.01 2wv4 s PRO 44 N -4.03 4.42 0.19 4.82 0.02 -1.26 -1.00 135.00 138.16 2wv4 s PRO 44 Ca 0.23 1.88 -0.05 0.00 0.02 0.00 0.00 61.00 63.07 2wv4 s PRO 44 Cb 0.06 -3.29 0.10 0.00 0.02 0.00 0.00 34.50 31.39 2wv4 s PRO 44 CO 0.02 -0.26 1.53 -0.09 -0.33 0.00 0.00 177.00 177.87 2wv4 h ARG 45 N 6.35 0.71 0.00 5.54 2.43 -0.17 -2.64 114.38 126.61 2wv4 h ARG 45 Ca -0.43 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.36 2wv4 h ARG 45 Cb 1.21 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2wv4 h ARG 45 CO 0.81 1.00 0.00 -2.39 -1.51 0.00 0.00 179.97 177.87 2wv4 n HIS 46 N -4.03 0.00 -0.19 2.20 1.44 -1.26 -1.76 115.22 111.61 2wv4 n HIS 46 Ca -0.02 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.60 2wv4 n HIS 46 Cb 0.55 -0.19 0.05 0.00 0.12 0.00 0.00 29.99 30.51 2wv4 n HIS 46 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2wv4 h LEU 47 N 0.00 1.01 0.00 2.39 5.85 -1.85 -2.88 115.31 119.83 2wv4 h LEU 47 Ca 0.00 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.43 2wv4 h LEU 47 Cb 0.04 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.80 2wv4 h LEU 47 CO 0.00 1.07 0.00 0.49 -0.34 0.00 0.00 178.44 179.66 2wv4 n PHE 48 N -4.18 0.00 0.82 1.25 3.01 -0.73 -2.49 117.46 115.15 2wv4 n PHE 48 Ca 0.03 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.61 2wv4 n PHE 48 Cb 0.35 -0.21 0.52 0.00 -0.01 0.00 0.00 39.48 40.13 2wv4 n PHE 48 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wv4 n ALA 49 N -1.21 2.16 -2.03 4.37 0.00 -1.09 -4.79 120.51 117.93 2wv4 n ALA 49 Ca 0.12 -0.07 -0.33 0.00 0.00 0.00 0.00 53.44 53.16 2wv4 n ALA 49 Cb 0.14 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 2wv4 n ALA 49 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2wv4 s GLU 50 N -3.03 4.08 -0.23 0.00 0.41 -1.04 -5.05 118.70 113.84 2wv4 s GLU 50 Ca 0.12 0.82 -0.18 0.00 -0.41 0.00 0.00 54.97 55.32 2wv4 s GLU 50 Cb 0.16 -2.34 -0.03 0.00 -1.78 0.00 0.00 34.13 30.14 2wv4 s GLU 50 CO 0.48 0.09 0.51 0.21 -0.49 0.00 0.00 175.26 176.06 2wv4 s LYS 51 N -3.07 4.12 0.31 1.61 2.20 -1.26 -5.03 119.74 118.63 2wv4 s LYS 51 Ca 0.57 0.36 -0.09 0.00 -0.36 0.00 0.00 55.97 56.45 2wv4 s LYS 51 Cb -0.10 -3.61 0.01 0.00 -1.51 0.00 0.00 37.83 32.62 2wv4 s LYS 51 CO 0.16 -0.26 0.54 1.52 -0.36 0.00 0.00 175.35 176.95 2wv4 s TYR 52 N 1.99 0.61 0.00 4.03 -0.85 -1.26 -4.73 117.35 117.14 2wv4 s TYR 52 Ca 0.22 -0.97 0.00 0.00 -0.52 0.00 0.00 57.07 55.80 2wv4 s TYR 52 Cb -0.15 0.20 0.00 0.00 0.38 0.00 0.00 41.96 42.38 2wv4 s TYR 52 CO 0.09 -1.16 0.00 -0.40 -1.52 0.00 0.00 175.55 172.56 2wv4 n ASP 53 N -1.00 0.03 -3.78 -0.18 3.85 -0.53 -4.96 116.55 109.98 2wv4 n ASP 53 Ca -0.02 -0.12 -0.13 0.00 -0.71 0.00 0.00 54.79 53.82 2wv4 n ASP 53 Cb 0.61 0.24 -0.12 0.00 -1.35 0.00 0.00 41.12 40.50 2wv4 n ASP 53 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 2wv4 s LYS 54 N -0.25 0.22 -0.11 0.11 1.02 -1.04 -4.68 119.74 115.01 2wv4 s LYS 54 Ca 0.00 0.35 0.03 0.00 0.02 0.00 0.00 55.97 56.38 2wv4 s LYS 54 Cb 0.00 0.03 -0.00 0.00 -0.52 0.00 0.00 37.83 37.34 2wv4 s LYS 54 CO 0.00 -0.07 -0.22 -1.50 -0.92 0.00 0.00 175.35 172.64 2wv4 s ILE 55 N 0.49 2.27 -0.24 2.17 -1.16 0.17 -1.01 121.20 123.89 2wv4 s ILE 55 Ca -0.03 -0.94 -0.08 0.00 -0.51 0.00 0.00 60.65 59.09 2wv4 s ILE 55 Cb -0.05 -1.89 -0.03 0.00 0.61 0.00 0.00 42.46 41.10 2wv4 s ILE 55 CO -0.02 0.55 0.08 -0.04 -2.81 0.00 0.00 174.94 172.69 2wv4 s MET 56 N 0.38 3.74 -0.26 3.50 -1.94 -0.28 -0.21 119.30 124.24 2wv4 s MET 56 Ca -0.16 -0.44 0.03 0.00 -1.71 0.00 0.00 55.69 53.40 2wv4 s MET 56 Cb -0.17 -3.32 0.06 0.00 2.01 0.00 0.00 34.83 33.41 2wv4 s MET 56 CO 0.07 -0.08 -0.09 -0.51 -0.01 0.00 0.00 175.02 174.40 2wv4 s LEU 57 N 1.35 3.33 -0.57 -0.03 1.43 0.75 -1.89 118.68 123.06 2wv4 s LEU 57 Ca 0.05 -1.39 -0.21 0.00 -1.03 0.00 0.00 54.13 51.55 2wv4 s LEU 57 Cb -0.15 -1.49 0.03 0.00 0.03 0.00 0.00 46.19 44.62 2wv4 s LEU 57 CO 0.04 -0.20 0.64 -0.90 0.23 0.00 0.00 176.35 176.16 2wv4 n ASP 58 N 4.47 -6.09 0.00 2.29 5.75 -0.49 -1.92 116.55 120.55 2wv4 n ASP 58 Ca -0.13 -0.20 0.00 0.00 -0.01 0.00 0.00 54.79 54.45 2wv4 n ASP 58 Cb 0.42 -2.81 0.00 0.00 -1.03 0.00 0.00 41.12 37.70 2wv4 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wv4 n GLY 59 N -0.72 0.63 3.72 6.12 0.00 -1.26 -4.92 105.19 108.76 2wv4 n GLY 59 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 2wv4 n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wv4 s ARG 60 N 0.00 4.61 -0.07 1.61 3.52 -0.81 -5.04 118.95 122.78 2wv4 s ARG 60 Ca 0.00 1.54 -0.07 0.00 -0.13 0.00 0.00 55.73 57.07 2wv4 s ARG 60 Cb 0.00 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.98 2wv4 s ARG 60 CO 0.00 0.07 0.20 0.00 -0.81 0.00 0.00 175.30 174.76 2wv4 s ALA 61 N 0.30 3.86 0.20 6.12 0.00 -1.26 -0.18 121.76 130.80 2wv4 s ALA 61 Ca 0.50 -0.59 -0.13 0.00 0.00 0.00 0.00 51.96 51.74 2wv4 s ALA 61 Cb -0.25 -2.03 0.01 0.00 0.00 0.00 0.00 23.12 20.85 2wv4 s ALA 61 CO 0.30 0.62 0.42 -1.64 0.00 0.00 0.00 175.76 175.46 2wv4 s MET 62 N -1.27 1.33 0.39 0.00 1.00 0.70 -4.96 119.30 116.50 2wv4 s MET 62 Ca 0.20 -1.08 0.06 0.00 0.00 0.00 0.00 55.69 54.87 2wv4 s MET 62 Cb -0.13 0.45 -0.08 0.00 0.00 0.00 0.00 34.83 35.08 2wv4 s MET 62 CO 0.09 -0.53 0.01 0.95 0.00 0.00 0.00 175.02 175.54 2wv4 s THR 63 N -3.95 1.84 -1.52 2.05 -4.23 -1.26 0.45 115.64 109.02 2wv4 s THR 63 Ca 0.16 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 2wv4 s THR 63 Cb 0.01 -2.93 0.00 0.00 1.34 0.00 0.00 72.50 70.92 2wv4 s THR 63 CO 0.01 -0.01 0.66 0.47 -0.54 0.00 0.00 174.62 175.21 2wv4 n ASP 64 N -0.90 0.00 -0.15 3.99 8.00 -1.26 -1.43 116.55 124.80 2wv4 n ASP 64 Ca -0.04 0.18 0.12 0.00 0.71 0.00 0.00 54.79 55.75 2wv4 n ASP 64 Cb 0.67 -0.18 0.16 0.00 -0.02 0.00 0.00 41.12 41.75 2wv4 n ASP 64 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2wv4 n SER 65 N -1.16 1.01 -1.30 -2.24 3.41 -1.26 -4.13 113.62 107.96 2wv4 n SER 65 Ca 0.00 -0.81 0.08 0.00 -0.26 0.00 0.00 58.87 57.89 2wv4 n SER 65 Cb 0.01 0.42 0.29 0.00 -0.26 0.00 0.00 64.21 64.68 2wv4 n SER 65 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2wv4 n ASP 66 N -1.02 3.81 -3.64 4.04 9.92 -0.51 -4.97 116.55 124.18 2wv4 n ASP 66 Ca 0.08 -2.26 0.00 0.00 -0.53 0.00 0.00 54.79 52.08 2wv4 n ASP 66 Cb 0.36 -0.49 -0.01 0.00 -0.64 0.00 0.00 41.12 40.34 2wv4 n ASP 66 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 2wv4 s TYR 67 N -1.61 -0.07 0.13 1.24 -0.85 -1.26 -2.00 117.35 112.94 2wv4 s TYR 67 Ca 0.42 -0.07 0.09 0.00 -0.52 0.00 0.00 57.07 56.99 2wv4 s TYR 67 Cb 0.26 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 43.12 2wv4 s TYR 67 CO 0.23 -0.37 -0.20 1.03 -1.52 0.00 0.00 175.55 174.71 2wv4 s ARG 68 N -2.58 1.23 -0.13 -3.49 3.00 -0.76 -4.95 118.95 111.27 2wv4 s ARG 68 Ca 0.13 -1.29 0.02 0.00 0.00 0.00 0.00 55.73 54.59 2wv4 s ARG 68 Cb 0.03 -1.43 0.01 0.00 0.00 0.00 0.00 34.95 33.57 2wv4 s ARG 68 CO -0.03 0.32 -0.18 0.08 0.00 0.00 0.00 175.30 175.49 2wv4 s VAL 69 N -1.53 1.75 -0.15 3.52 1.01 -1.26 -1.01 120.40 122.73 2wv4 s VAL 69 Ca 0.11 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 2wv4 s VAL 69 Cb -0.08 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 2wv4 s VAL 69 CO 0.06 0.49 0.00 -0.36 0.00 0.00 0.00 175.10 175.29 2wv4 s PHE 70 N 1.00 3.13 0.44 5.22 0.40 0.73 -4.96 117.98 123.94 2wv4 s PHE 70 Ca -0.05 -0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.20 2wv4 s PHE 70 Cb -0.15 -1.97 -0.01 0.00 0.51 0.00 0.00 43.02 41.40 2wv4 s PHE 70 CO -0.03 0.12 0.66 -1.83 0.70 0.00 0.00 175.22 174.84 2wv4 s GLU 71 N 0.14 3.16 -0.16 0.44 1.03 -1.26 -0.74 118.70 121.30 2wv4 s GLU 71 Ca 0.01 -0.42 0.00 0.00 0.03 0.00 0.00 54.97 54.59 2wv4 s GLU 71 Cb -0.13 -2.56 0.00 0.00 -0.80 0.00 0.00 34.13 30.64 2wv4 s GLU 71 CO 0.02 -0.20 -0.15 -0.06 -1.33 0.00 0.00 175.26 173.54 2wv4 s PHE 72 N -2.53 2.79 -0.25 4.83 0.40 -1.26 -4.93 117.98 117.03 2wv4 s PHE 72 Ca 0.47 -1.11 -0.12 0.00 -0.60 0.00 0.00 56.93 55.57 2wv4 s PHE 72 Cb -0.10 -1.91 -0.05 0.00 0.51 0.00 0.00 43.02 41.48 2wv4 s PHE 72 CO 0.38 -0.52 0.24 -1.83 0.70 0.00 0.00 175.22 174.20 2wv4 s GLU 73 N 0.92 4.04 0.06 0.44 1.03 -1.26 -0.59 118.70 123.34 2wv4 s GLU 73 Ca -0.03 -0.15 0.09 0.00 0.03 0.00 0.00 54.97 54.90 2wv4 s GLU 73 Cb -0.15 -3.59 -0.03 0.00 -0.80 0.00 0.00 34.13 29.56 2wv4 s GLU 73 CO -0.02 -0.09 -0.24 0.96 -1.33 0.00 0.00 175.26 174.55 2wv4 s ILE 74 N 1.48 1.94 -0.57 1.83 -4.36 0.17 -4.89 121.20 116.80 2wv4 s ILE 74 Ca 0.10 -1.39 -0.27 0.00 -0.26 0.00 0.00 60.65 58.84 2wv4 s ILE 74 Cb -0.15 -1.69 -0.01 0.00 1.25 0.00 0.00 42.46 41.87 2wv4 s ILE 74 CO 0.08 0.23 1.69 -1.59 0.24 0.00 0.00 174.94 175.58 2wv4 s LYS 75 N -1.40 2.94 -0.60 0.37 0.00 -1.25 -0.17 119.74 119.63 2wv4 s LYS 75 Ca 0.10 0.61 -0.16 0.00 0.00 0.00 0.00 55.97 56.52 2wv4 s LYS 75 Cb -0.10 -4.28 0.14 0.00 0.00 0.00 0.00 37.83 33.60 2wv4 s LYS 75 CO 0.03 -2.36 0.60 0.54 0.00 0.00 0.00 175.35 174.15 2wv4 s VAL 76 N 7.73 5.19 -2.03 1.79 0.11 0.26 -4.41 120.40 129.04 2wv4 s VAL 76 Ca 0.62 -1.55 0.00 0.00 -2.93 0.00 0.00 61.98 58.12 2wv4 s VAL 76 Cb -0.13 -4.40 0.00 0.00 -1.53 0.00 0.00 36.38 30.32 2wv4 s VAL 76 CO 0.23 -0.96 0.00 2.29 -3.33 0.00 0.00 175.10 173.33 2wv4 n LYS 77 N 5.29 -1.53 0.00 1.54 0.00 -1.26 -2.33 118.16 119.87 2wv4 n LYS 77 Ca -0.08 1.14 0.00 0.00 -0.00 0.00 0.00 58.31 59.37 2wv4 n LYS 77 Cb 0.42 -5.60 0.00 0.00 -0.00 0.00 0.00 35.03 29.85 2wv4 n LYS 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wv4 n GLY 78 N -0.56 3.46 3.65 2.58 0.00 -1.26 -5.09 105.19 107.97 2wv4 n GLY 78 Ca -0.21 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 2wv4 n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wv4 s GLN 79 N 0.00 -1.03 -0.21 1.61 1.11 -0.98 -4.88 119.66 115.28 2wv4 s GLN 79 Ca 0.00 -0.19 0.02 0.00 0.01 0.00 0.00 55.36 55.20 2wv4 s GLN 79 Cb 0.00 -1.63 0.04 0.00 -1.01 0.00 0.00 33.01 30.41 2wv4 s GLN 79 CO 0.00 -3.56 -0.15 0.16 0.01 0.00 0.00 175.29 171.75 2wv4 s ASP 80 N -4.13 3.57 0.40 5.90 -4.77 -1.26 0.89 116.67 117.27 2wv4 s ASP 80 Ca 0.72 -0.92 0.08 0.00 -3.30 0.00 0.00 52.55 49.13 2wv4 s ASP 80 Cb -0.08 -1.46 -0.05 0.00 -1.09 0.00 0.00 42.92 40.24 2wv4 s ASP 80 CO 0.55 -0.08 0.15 -0.04 0.70 0.00 0.00 175.17 176.45 2wv4 s MET 81 N 1.25 2.20 -0.22 2.11 1.00 0.76 -4.84 119.30 121.57 2wv4 s MET 81 Ca -0.00 -1.82 -0.15 0.00 0.00 0.00 0.00 55.69 53.71 2wv4 s MET 81 Cb -0.16 -1.97 -0.04 0.00 0.00 0.00 0.00 34.83 32.66 2wv4 s MET 81 CO -0.10 -0.06 0.36 -0.51 0.00 0.00 0.00 175.02 174.70 2wv4 s LEU 82 N -3.87 4.13 0.53 -0.03 1.02 -1.26 0.44 118.68 119.66 2wv4 s LEU 82 Ca 0.40 0.42 -0.20 0.00 0.02 0.00 0.00 54.13 54.77 2wv4 s LEU 82 Cb 0.03 -2.43 -0.06 0.00 0.02 0.00 0.00 46.19 43.74 2wv4 s LEU 82 CO 0.22 -0.07 1.11 -0.55 0.02 0.00 0.00 176.35 177.09 2wv4 s SER 83 N 1.11 5.83 0.00 2.29 0.15 0.25 -4.33 113.70 119.00 2wv4 s SER 83 Ca 0.17 2.13 0.22 0.00 0.70 0.00 0.00 55.95 59.17 2wv4 s SER 83 Cb -0.15 -2.58 1.12 0.00 -1.71 0.00 0.00 66.02 62.71 2wv4 s SER 83 CO 0.08 -1.14 1.75 -0.67 1.20 0.00 0.00 173.24 174.45 2wv4 n ASP 84 N -1.24 0.58 -4.55 5.45 2.03 -1.26 -4.59 116.55 112.96 2wv4 n ASP 84 Ca 0.11 -1.44 -0.37 0.00 0.52 0.00 0.00 54.79 53.61 2wv4 n ASP 84 Cb 0.51 -0.03 -0.11 0.00 -0.72 0.00 0.00 41.12 40.77 2wv4 n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wv4 s ALA 85 N -1.94 3.37 0.20 -1.67 0.00 -1.26 0.59 121.76 121.05 2wv4 s ALA 85 Ca 0.33 -1.01 0.10 0.00 0.00 0.00 0.00 51.96 51.38 2wv4 s ALA 85 Cb 0.16 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 2wv4 s ALA 85 CO 0.26 -0.34 -0.21 0.00 0.00 0.00 0.00 175.76 175.47 2wv4 s ALA 86 N 1.35 2.36 -0.26 0.00 0.00 -0.17 -4.16 121.76 120.89 2wv4 s ALA 86 Ca 0.06 -1.63 -0.08 0.00 0.00 0.00 0.00 51.96 50.32 2wv4 s ALA 86 Cb -0.15 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 2wv4 s ALA 86 CO 0.05 0.32 0.08 -1.17 0.00 0.00 0.00 175.76 175.05 2wv4 s LEU 87 N -2.83 3.52 -0.33 0.00 2.96 0.08 -0.94 118.68 121.14 2wv4 s LEU 87 Ca 0.21 -0.25 -0.11 0.00 -0.22 0.00 0.00 54.13 53.76 2wv4 s LEU 87 Cb -0.06 -1.93 -0.00 0.00 0.50 0.00 0.00 46.19 44.69 2wv4 s LEU 87 CO 0.09 -0.05 0.19 -0.32 -1.32 0.00 0.00 176.35 174.94 2wv4 s MET 88 N 1.61 3.28 -0.29 1.98 -2.45 0.24 -0.19 119.30 123.48 2wv4 s MET 88 Ca 0.06 -0.77 -0.07 0.00 -1.25 0.00 0.00 55.69 53.66 2wv4 s MET 88 Cb -0.15 -3.66 0.00 0.00 1.25 0.00 0.00 34.83 32.26 2wv4 s MET 88 CO 0.04 -0.48 0.09 0.08 1.05 0.00 0.00 175.02 175.80 2wv4 s VAL 89 N 1.63 4.10 0.08 10.11 1.01 -0.18 -1.17 120.40 135.97 2wv4 s VAL 89 Ca 0.05 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 2wv4 s VAL 89 Cb -0.18 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 2wv4 s VAL 89 CO 0.07 0.12 1.08 -0.76 0.00 0.00 0.00 175.10 175.61 2wv4 s LEU 90 N 1.53 4.42 0.32 3.92 1.43 -0.72 -1.82 118.68 127.75 2wv4 s LEU 90 Ca 0.03 1.91 0.07 0.00 -1.03 0.00 0.00 54.13 55.11 2wv4 s LEU 90 Cb -0.17 -3.58 0.74 0.00 0.03 0.00 0.00 46.19 43.21 2wv4 s LEU 90 CO 0.03 -0.30 1.82 0.45 0.23 0.00 0.00 176.35 178.58 2wv4 h HIS 91 N 6.23 0.99 -3.17 0.29 3.86 -1.75 -3.43 115.15 118.16 2wv4 h HIS 91 Ca -0.42 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 58.69 2wv4 h HIS 91 Cb 1.21 -0.30 -0.21 0.00 1.06 0.00 0.00 27.41 29.17 2wv4 h HIS 91 CO 0.66 0.30 -0.35 1.03 0.86 0.00 0.00 177.93 180.43 2wv4 s ARG 92 N -5.80 0.58 0.00 2.45 3.00 -1.26 -5.11 118.95 112.81 2wv4 s ARG 92 Ca -0.11 -0.20 0.00 0.00 0.00 0.00 0.00 55.73 55.42 2wv4 s ARG 92 Cb 0.23 0.26 0.00 0.00 0.00 0.00 0.00 34.95 35.44 2wv4 s ARG 92 CO 0.80 -0.15 0.00 0.41 0.00 0.00 0.00 175.30 176.36 2wv4 n GLY 93 N 1.48 1.78 3.77 -3.53 0.00 -1.26 -5.11 105.19 102.32 2wv4 n GLY 93 Ca -0.21 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.31 2wv4 n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wv4 s ASN 94 N 0.00 6.59 0.70 1.61 0.01 -1.26 -4.89 114.94 117.70 2wv4 s ASN 94 Ca 0.00 2.83 -0.11 0.00 -0.71 0.00 0.00 52.86 54.87 2wv4 s ASN 94 Cb 0.00 -2.65 0.01 0.00 0.41 0.00 0.00 41.25 39.02 2wv4 s ASN 94 CO 0.00 -0.68 1.09 -1.59 -1.51 0.00 0.00 177.10 174.41 2wv4 s LYS 95 N -1.77 2.89 0.39 -0.60 -2.85 -1.26 -4.74 119.74 111.80 2wv4 s LYS 95 Ca 0.51 0.47 0.08 0.00 -1.00 0.00 0.00 55.97 56.04 2wv4 s LYS 95 Cb -0.43 -2.02 -0.06 0.00 -2.06 0.00 0.00 37.83 33.26 2wv4 s LYS 95 CO 0.56 -1.02 0.07 0.14 0.10 0.00 0.00 175.35 175.20 2wv4 s VAL 96 N -3.35 2.27 0.01 1.79 -7.23 0.06 -4.98 120.40 108.96 2wv4 s VAL 96 Ca 0.58 -1.90 -0.30 0.00 -1.81 0.00 0.00 61.98 58.55 2wv4 s VAL 96 Cb -0.11 -2.93 -0.07 0.00 0.56 0.00 0.00 36.38 33.83 2wv4 s VAL 96 CO 0.52 -0.06 1.60 0.00 -0.31 0.00 0.00 175.10 176.85 2wv4 s ARG 97 N -3.78 4.21 -0.19 4.82 3.03 -1.26 -3.99 118.95 121.80 2wv4 s ARG 97 Ca 0.37 2.20 -0.29 0.00 2.03 0.00 0.00 55.73 60.04 2wv4 s ARG 97 Cb 0.05 -3.73 -0.04 0.00 -1.03 0.00 0.00 34.95 30.19 2wv4 s ARG 97 CO 0.20 -0.74 1.85 0.34 -1.13 0.00 0.00 175.30 175.82 2wv4 s ASP 98 N 2.63 6.10 -0.09 -2.89 -1.08 -1.26 -4.37 116.67 115.70 2wv4 s ASP 98 Ca 0.71 1.84 0.13 0.00 -0.52 0.00 0.00 52.55 54.71 2wv4 s ASP 98 Cb -0.36 -2.53 0.21 0.00 -1.46 0.00 0.00 42.92 38.79 2wv4 s ASP 98 CO 0.30 -1.46 1.10 2.30 0.52 0.00 0.00 175.17 177.93 2wv4 n ILE 99 N 6.72 1.56 -0.22 4.11 -5.35 0.19 -4.80 119.36 121.58 2wv4 n ILE 99 Ca 0.22 -1.83 0.03 0.00 -0.27 0.00 0.00 62.75 60.90 2wv4 n ILE 99 Cb 0.45 -0.02 0.28 0.00 -1.74 0.00 0.00 39.64 38.61 2wv4 n ILE 99 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 2wv4 h THR 100 N 0.41 1.11 0.00 7.28 1.35 -1.88 -2.09 112.91 119.08 2wv4 h THR 100 Ca 0.00 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2wv4 h THR 100 Cb 0.91 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.43 2wv4 h THR 100 CO 0.00 0.17 0.00 2.29 -0.25 0.00 0.00 175.52 177.73 2wv4 n LYS 101 N -4.45 0.08 -0.30 4.72 2.85 -1.26 -1.58 118.16 118.21 2wv4 n LYS 101 Ca 0.10 0.58 0.06 0.00 -1.05 0.00 0.00 58.31 58.00 2wv4 n LYS 101 Cb 0.13 -1.76 0.20 0.00 -0.65 0.00 0.00 35.03 32.94 2wv4 n LYS 101 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2wv4 n HIS 102 N -1.93 0.75 -3.49 5.58 8.25 -0.79 -4.83 115.22 118.75 2wv4 n HIS 102 Ca -0.01 -0.32 -0.23 0.00 -0.26 0.00 0.00 57.72 56.90 2wv4 n HIS 102 Cb 0.02 -0.10 0.02 0.00 1.12 0.00 0.00 29.99 31.05 2wv4 n HIS 102 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wv4 s PHE 103 N -1.61 1.64 0.36 4.41 0.40 -0.61 0.80 117.98 123.37 2wv4 s PHE 103 Ca 0.29 -0.76 0.07 0.00 -0.60 0.00 0.00 56.93 55.93 2wv4 s PHE 103 Cb 0.17 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.61 2wv4 s PHE 103 CO 0.16 -0.73 0.25 1.03 0.70 0.00 0.00 175.22 176.63 2wv4 s ARG 104 N -4.43 1.86 -0.00 0.44 1.81 -1.26 -4.77 118.95 112.60 2wv4 s ARG 104 Ca 0.47 -2.10 0.08 0.00 -1.72 0.00 0.00 55.73 52.46 2wv4 s ARG 104 Cb -0.04 0.09 -0.09 0.00 -0.45 0.00 0.00 34.95 34.46 2wv4 s ARG 104 CO 0.29 -0.64 0.30 -0.25 -0.68 0.00 0.00 175.30 174.33 2wv4 n ASP 105 N -1.60 0.90 -4.06 0.23 8.00 -1.26 -0.79 116.55 117.97 2wv4 n ASP 105 Ca 0.04 -0.55 -0.08 0.00 0.71 0.00 0.00 54.79 54.91 2wv4 n ASP 105 Cb 0.63 1.07 -0.09 0.00 -0.02 0.00 0.00 41.12 42.70 2wv4 n ASP 105 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2wv4 s THR 106 N -1.89 0.18 0.27 -3.53 -4.23 -1.26 -4.96 115.64 100.22 2wv4 s THR 106 Ca 0.02 -1.72 -0.31 0.00 -1.18 0.00 0.00 61.69 58.51 2wv4 s THR 106 Cb 0.06 -1.59 -0.12 0.00 1.34 0.00 0.00 72.50 72.19 2wv4 s THR 106 CO 0.32 -0.83 1.60 0.00 -0.54 0.00 0.00 174.62 175.17 2wv4 n ALA 107 N 0.04 2.46 0.00 3.99 0.00 -1.26 -4.89 120.51 120.85 2wv4 n ALA 107 Ca -0.12 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2wv4 n ALA 107 Cb 0.62 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.61 2wv4 n ALA 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wv4 n ARG 108 N 2.45 1.92 -2.45 0.00 5.12 -1.26 -5.07 116.66 117.38 2wv4 n ARG 108 Ca 0.10 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.61 2wv4 n ARG 108 Cb 0.36 -0.90 -0.04 0.00 -1.16 0.00 0.00 32.46 30.73 2wv4 n ARG 108 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2wv4 s MET 109 N -1.79 4.55 0.19 5.56 0.23 -1.24 -4.63 119.30 122.16 2wv4 s MET 109 Ca 0.00 1.79 -0.21 0.00 -1.03 0.00 0.00 55.69 56.24 2wv4 s MET 109 Cb 0.00 -3.26 -0.08 0.00 -1.53 0.00 0.00 34.83 29.96 2wv4 s MET 109 CO 0.00 0.00 0.72 0.21 -2.03 0.00 0.00 175.02 173.93 2wv4 s LYS 110 N -0.34 4.33 0.25 3.16 2.20 -1.26 -5.01 119.74 123.07 2wv4 s LYS 110 Ca 0.51 0.94 -0.31 0.00 -0.36 0.00 0.00 55.97 56.74 2wv4 s LYS 110 Cb -0.31 -3.02 -0.13 0.00 -1.51 0.00 0.00 37.83 32.87 2wv4 s LYS 110 CO 0.36 0.47 1.54 1.17 -0.36 0.00 0.00 175.35 178.52 2wv4 n LYS 111 N 1.05 2.41 0.00 4.03 4.81 -1.26 -2.25 118.16 126.95 2wv4 n LYS 111 Ca -0.04 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 2wv4 n LYS 111 Cb 0.50 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.95 2wv4 n LYS 111 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wv4 n GLY 112 N 2.46 0.21 3.91 3.14 0.00 0.30 -4.98 105.19 110.24 2wv4 n GLY 112 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 2wv4 n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wv4 s THR 113 N -2.00 3.82 0.25 2.61 -4.23 -0.96 -4.65 115.64 110.48 2wv4 s THR 113 Ca 0.00 0.11 -0.30 0.00 -1.18 0.00 0.00 61.69 60.32 2wv4 s THR 113 Cb 0.00 -3.52 -0.09 0.00 1.34 0.00 0.00 72.50 70.23 2wv4 s THR 113 CO 0.00 -0.55 1.28 -2.84 -0.54 0.00 0.00 174.62 171.97 2wv4 s PRO 114 N -5.01 4.41 0.01 3.99 0.02 -1.26 0.46 135.00 137.63 2wv4 s PRO 114 Ca 0.54 2.07 0.07 0.00 0.02 0.00 0.00 61.00 63.69 2wv4 s PRO 114 Cb -0.11 -3.16 -0.02 0.00 0.02 0.00 0.00 34.50 31.24 2wv4 s PRO 114 CO 0.46 -0.17 -0.21 0.08 -0.33 0.00 0.00 177.00 176.83 2wv4 s VAL 115 N -0.44 1.68 -0.08 3.83 1.01 0.12 -3.97 120.40 122.56 2wv4 s VAL 115 Ca 0.53 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2wv4 s VAL 115 Cb -0.37 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.60 2wv4 s VAL 115 CO 0.43 0.36 -0.12 -0.69 0.00 0.00 0.00 175.10 175.08 2wv4 s VAL 116 N -0.63 1.18 -0.16 2.92 1.01 -0.75 0.18 120.40 124.15 2wv4 s VAL 116 Ca 0.08 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 2wv4 s VAL 116 Cb -0.08 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 2wv4 s VAL 116 CO 0.00 0.37 0.02 -0.83 0.00 0.00 0.00 175.10 174.66 2wv4 s GLY 117 N 0.82 1.83 -0.36 4.51 0.00 0.21 -0.56 107.32 113.77 2wv4 s GLY 117 Ca -0.11 -0.78 -0.08 0.00 0.00 0.00 0.00 44.72 43.75 2wv4 s GLY 117 CO 0.02 -0.04 0.15 0.14 0.00 0.00 0.00 173.10 173.37 2wv4 s VAL 118 N 0.27 4.04 0.00 1.40 1.01 0.36 -1.57 120.40 125.92 2wv4 s VAL 118 Ca 0.01 -1.10 0.06 0.00 0.00 0.00 0.00 61.98 60.95 2wv4 s VAL 118 Cb -0.13 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 2wv4 s VAL 118 CO 0.01 -0.24 -0.19 -0.69 0.00 0.00 0.00 175.10 174.00 2wv4 s VAL 119 N 1.44 2.67 -0.40 2.92 1.01 0.06 -2.32 120.40 125.78 2wv4 s VAL 119 Ca -0.00 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 60.96 2wv4 s VAL 119 Cb -0.20 -2.06 0.16 0.00 0.00 0.00 0.00 36.38 34.29 2wv4 s VAL 119 CO 0.04 0.46 0.41 0.21 0.00 0.00 0.00 175.10 176.22 2wv4 s ASN 120 N -1.06 0.89 0.19 3.32 3.84 -1.26 0.08 114.94 120.94 2wv4 s ASN 120 Ca 0.13 -1.86 0.03 0.00 0.21 0.00 0.00 52.86 51.37 2wv4 s ASN 120 Cb -0.10 0.55 -0.05 0.00 -0.55 0.00 0.00 41.25 41.10 2wv4 s ASN 120 CO 0.02 -0.22 -0.04 0.54 -2.79 0.00 0.00 177.10 174.62 2wv4 s ASN 121 N 1.12 1.68 0.19 -4.21 2.20 -1.21 -2.61 114.94 112.10 2wv4 s ASN 121 Ca 0.21 -1.13 0.11 0.00 -0.94 0.00 0.00 52.86 51.11 2wv4 s ASN 121 Cb -0.11 0.03 0.61 0.00 -2.00 0.00 0.00 41.25 39.78 2wv4 s ASN 121 CO -0.05 -0.46 1.31 0.00 -2.94 0.00 0.00 177.10 174.95 2wv4 n ALA 122 N -0.30 0.91 -0.02 3.54 0.00 -1.26 -0.04 120.51 123.34 2wv4 n ALA 122 Ca -0.07 0.11 -0.03 0.00 0.00 0.00 0.00 53.44 53.45 2wv4 n ALA 122 Cb 0.63 -1.06 -0.12 0.00 0.00 0.00 0.00 19.45 18.90 2wv4 n ALA 122 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2wv4 n ASP 123 N -1.89 0.52 0.00 0.00 2.03 -1.26 -4.61 116.55 111.34 2wv4 n ASP 123 Ca -0.01 0.23 0.00 0.00 0.52 0.00 0.00 54.79 55.53 2wv4 n ASP 123 Cb 0.09 0.59 0.00 0.00 -0.72 0.00 0.00 41.12 41.08 2wv4 n ASP 123 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2wv4 n VAL 124 N -2.79 0.00 -4.13 5.18 0.24 -1.09 -5.14 118.33 110.59 2wv4 n VAL 124 Ca -0.16 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 2wv4 n VAL 124 Cb 0.92 0.82 0.00 0.00 -1.47 0.00 0.00 33.84 34.12 2wv4 n VAL 124 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wv4 n GLY 125 N 0.79 -1.41 3.69 7.63 0.00 0.94 -4.68 105.19 112.15 2wv4 n GLY 125 Ca 0.00 -1.28 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 2wv4 n GLY 125 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wv4 s ARG 126 N 0.00 4.22 -0.01 1.61 3.03 -1.26 -3.34 118.95 123.20 2wv4 s ARG 126 Ca 0.00 2.24 -0.02 0.00 2.03 0.00 0.00 55.73 59.98 2wv4 s ARG 126 Cb 0.00 -3.61 0.00 0.00 -1.03 0.00 0.00 34.95 30.31 2wv4 s ARG 126 CO 0.00 -0.70 0.04 -1.17 -1.13 0.00 0.00 175.30 172.33 2wv4 s LEU 127 N 2.65 1.88 -0.13 -1.89 0.20 0.11 -4.99 118.68 116.52 2wv4 s LEU 127 Ca 0.71 -0.01 0.01 0.00 0.69 0.00 0.00 54.13 55.54 2wv4 s LEU 127 Cb -0.37 0.16 0.02 0.00 -0.43 0.00 0.00 46.19 45.56 2wv4 s LEU 127 CO 0.31 -0.07 -0.17 -0.63 -0.29 0.00 0.00 176.35 175.50 2wv4 s ILE 128 N -0.25 1.68 0.10 6.68 -1.09 -1.26 -0.76 121.20 126.29 2wv4 s ILE 128 Ca -0.03 -0.74 0.07 0.00 -2.23 0.00 0.00 60.65 57.73 2wv4 s ILE 128 Cb -0.02 -1.53 -0.04 0.00 -1.58 0.00 0.00 42.46 39.29 2wv4 s ILE 128 CO -0.00 0.48 -0.13 0.72 -1.23 0.00 0.00 174.94 174.78 2wv4 s PHE 129 N 1.09 2.67 0.21 3.97 -0.12 -0.61 -4.95 117.98 120.24 2wv4 s PHE 129 Ca -0.03 -0.19 0.05 0.00 -0.05 0.00 0.00 56.93 56.71 2wv4 s PHE 129 Cb -0.14 -1.42 -0.03 0.00 -0.63 0.00 0.00 43.02 40.80 2wv4 s PHE 129 CO -0.05 0.39 0.27 -1.54 -0.05 0.00 0.00 175.22 174.24 2wv4 s SER 130 N -2.07 6.00 0.29 1.98 1.04 -1.26 0.65 113.70 120.33 2wv4 s SER 130 Ca 0.19 -0.02 -0.15 0.00 0.48 0.00 0.00 55.95 56.45 2wv4 s SER 130 Cb -0.11 -1.69 0.02 0.00 0.10 0.00 0.00 66.02 64.33 2wv4 s SER 130 CO 0.11 -0.01 0.62 -0.83 0.98 0.00 0.00 173.24 174.11 2wv4 s GLY 131 N -3.64 0.37 -0.11 7.32 0.00 0.13 -4.60 107.32 106.79 2wv4 s GLY 131 Ca 0.33 -0.71 0.03 0.00 0.00 0.00 0.00 44.72 44.37 2wv4 s GLY 131 CO 0.27 -0.41 -0.19 1.85 0.00 0.00 0.00 173.10 174.62 2wv4 s GLU 132 N -3.59 2.61 0.35 2.90 2.12 -0.52 0.16 118.70 122.74 2wv4 s GLU 132 Ca 0.18 -0.71 -0.28 0.00 0.36 0.00 0.00 54.97 54.51 2wv4 s GLU 132 Cb -0.03 -2.10 -0.11 0.00 0.26 0.00 0.00 34.13 32.15 2wv4 s GLU 132 CO 0.10 0.03 1.44 0.00 -0.54 0.00 0.00 175.26 176.28 2wv4 s ALA 133 N 0.73 3.56 0.00 6.30 0.00 0.17 -0.08 121.76 132.44 2wv4 s ALA 133 Ca -0.11 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.33 2wv4 s ALA 133 Cb -0.16 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.39 2wv4 s ALA 133 CO 0.02 -0.92 0.00 1.28 0.00 0.00 0.00 175.76 176.14 2wv4 n LEU 134 N 0.71 0.00 -4.17 0.00 4.77 -0.70 -0.54 117.00 117.07 2wv4 n LEU 134 Ca 0.01 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.89 2wv4 n LEU 134 Cb 0.40 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 2wv4 n LEU 134 CO 0.62 0.00 -0.35 0.42 -1.33 0.00 0.00 177.39 176.75 2wv4 s THR 135 N 2.76 0.54 0.60 -5.08 -4.23 -1.25 -4.07 115.64 104.91 2wv4 s THR 135 Ca 0.00 -1.92 -0.19 0.00 -1.18 0.00 0.00 61.69 58.40 2wv4 s THR 135 Cb 0.00 -1.82 -0.03 0.00 1.34 0.00 0.00 72.50 71.99 2wv4 s THR 135 CO 0.00 -0.73 1.23 -0.47 -0.54 0.00 0.00 174.62 174.10 2wv4 s TYR 136 N -3.74 2.32 -0.05 3.99 5.04 -1.26 -2.25 117.35 121.41 2wv4 s TYR 136 Ca 0.16 1.51 0.02 0.00 -2.44 0.00 0.00 57.07 56.32 2wv4 s TYR 136 Cb 0.06 -3.53 0.01 0.00 0.35 0.00 0.00 41.96 38.86 2wv4 s TYR 136 CO -0.02 -2.36 -0.11 0.15 -1.34 0.00 0.00 175.55 171.86 2wv4 s LYS 137 N -3.34 1.44 -0.01 4.97 -0.14 0.16 -4.90 119.74 117.91 2wv4 s LYS 137 Ca 0.78 -0.37 -0.24 0.00 -1.36 0.00 0.00 55.97 54.79 2wv4 s LYS 137 Cb -0.32 -1.24 -0.19 0.00 -1.68 0.00 0.00 37.83 34.40 2wv4 s LYS 137 CO 0.34 0.05 1.23 -0.44 -0.76 0.00 0.00 175.35 175.78 2wv4 h ASP 138 N 6.79 0.16 -4.21 2.83 3.45 -1.93 0.85 116.42 124.36 2wv4 h ASP 138 Ca -0.33 -0.56 -0.18 0.00 0.43 0.00 0.00 57.03 56.40 2wv4 h ASP 138 Cb 1.18 -0.05 -0.24 0.00 -0.56 0.00 0.00 39.33 39.66 2wv4 h ASP 138 CO 0.48 0.69 -0.54 -0.51 -1.57 0.00 0.00 179.24 177.78 2wv4 s ILE 139 N -3.99 0.03 -0.08 0.35 2.07 -1.26 -1.03 121.20 117.29 2wv4 s ILE 139 Ca -0.15 -0.26 -0.01 0.00 -1.41 0.00 0.00 60.65 58.82 2wv4 s ILE 139 Cb 0.02 -0.28 0.03 0.00 0.13 0.00 0.00 42.46 42.36 2wv4 s ILE 139 CO 0.71 -0.14 -0.02 -0.69 -1.91 0.00 0.00 174.94 172.89 2wv4 s VAL 140 N -0.45 0.58 0.02 4.00 1.01 -0.48 -5.00 120.40 120.08 2wv4 s VAL 140 Ca -0.05 -0.01 -0.25 0.00 0.00 0.00 0.00 61.98 61.67 2wv4 s VAL 140 Cb -0.03 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 2wv4 s VAL 140 CO 0.01 0.29 0.77 -0.69 0.00 0.00 0.00 175.10 175.48 2wv4 s VAL 141 N 1.87 4.81 0.67 2.92 1.01 -1.26 -2.03 120.40 128.39 2wv4 s VAL 141 Ca 0.05 1.64 -0.01 0.00 0.00 0.00 0.00 61.98 63.65 2wv4 s VAL 141 Cb -0.12 -4.12 0.09 0.00 0.00 0.00 0.00 36.38 32.23 2wv4 s VAL 141 CO -0.06 0.32 0.94 -0.76 0.00 0.00 0.00 175.10 175.54 2wv4 s LEU 142 N 0.24 3.04 0.20 3.92 1.43 0.13 -4.96 118.68 122.68 2wv4 s LEU 142 Ca 0.40 -0.14 -0.10 0.00 -1.03 0.00 0.00 54.13 53.26 2wv4 s LEU 142 Cb -0.20 -2.40 0.22 0.00 0.03 0.00 0.00 46.19 43.84 2wv4 s LEU 142 CO 0.22 -1.63 1.80 -0.03 0.23 0.00 0.00 176.35 176.94 2wv4 h MET 143 N -0.38 0.60 -0.03 1.70 1.85 -1.97 -1.21 114.93 115.49 2wv4 h MET 143 Ca -0.39 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 58.66 2wv4 h MET 143 Cb 1.28 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 33.18 2wv4 h MET 143 CO 0.46 0.40 0.00 -0.40 -0.40 0.00 0.00 176.91 176.97 2wv4 n ASP 144 N -4.83 0.29 0.00 1.39 5.75 -1.26 -4.87 116.55 113.03 2wv4 n ASP 144 Ca 0.08 -1.58 0.00 0.00 -0.01 0.00 0.00 54.79 53.28 2wv4 n ASP 144 Cb 0.18 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 2wv4 n ASP 144 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wv4 n GLY 145 N 0.80 0.91 3.84 6.12 0.00 -0.46 -5.06 105.19 111.35 2wv4 n GLY 145 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2wv4 n GLY 145 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wv4 s ASP 146 N -2.99 5.39 0.04 1.61 -1.08 -1.26 -4.68 116.67 113.70 2wv4 s ASP 146 Ca 0.00 1.40 0.08 0.00 -0.52 0.00 0.00 52.55 53.51 2wv4 s ASP 146 Cb 0.00 -2.26 -0.03 0.00 -1.46 0.00 0.00 42.92 39.17 2wv4 s ASP 146 CO 0.00 -1.41 -0.23 -0.89 0.52 0.00 0.00 175.17 173.16 2wv4 s THR 147 N -3.17 2.40 -0.03 1.71 2.01 -1.26 0.19 115.64 117.48 2wv4 s THR 147 Ca 0.58 -1.31 0.02 0.00 0.31 0.00 0.00 61.69 61.28 2wv4 s THR 147 Cb -0.13 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.43 2wv4 s THR 147 CO 0.54 0.36 -0.06 -0.04 -0.69 0.00 0.00 174.62 174.72 2wv4 s MET 148 N -1.32 0.87 0.33 4.92 -1.94 -0.86 -4.99 119.30 116.31 2wv4 s MET 148 Ca 0.13 -0.19 0.03 0.00 -1.71 0.00 0.00 55.69 53.94 2wv4 s MET 148 Cb -0.10 -0.83 -0.02 0.00 2.01 0.00 0.00 34.83 35.88 2wv4 s MET 148 CO 0.03 0.01 0.50 -1.25 -0.01 0.00 0.00 175.02 174.30 2wv4 s PRO 149 N 0.55 3.33 -0.97 2.03 0.04 -1.26 -1.38 135.00 137.34 2wv4 s PRO 149 Ca -0.08 -0.61 -0.12 0.00 0.04 0.00 0.00 61.00 60.24 2wv4 s PRO 149 Cb -0.11 -2.74 0.00 0.00 0.04 0.00 0.00 34.50 31.69 2wv4 s PRO 149 CO 0.01 0.14 0.70 0.41 0.04 0.00 0.00 177.00 178.29 2wv4 n GLY 150 N -1.71 -1.13 3.85 0.56 0.00 -0.20 -4.69 105.19 101.87 2wv4 n GLY 150 Ca -0.04 0.50 -0.22 0.00 0.00 0.00 0.00 46.02 46.26 2wv4 n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wv4 s LEU 151 N -5.61 3.85 -0.12 0.99 1.43 0.29 -0.76 118.68 118.75 2wv4 s LEU 151 Ca 0.23 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2wv4 s LEU 151 Cb -0.09 -2.40 0.02 0.00 0.03 0.00 0.00 46.19 43.75 2wv4 s LEU 151 CO 0.86 -0.08 -0.13 0.12 0.23 0.00 0.00 176.35 177.35 2wv4 s PHE 152 N -2.14 1.86 0.27 0.29 5.36 -0.59 0.36 117.98 123.39 2wv4 s PHE 152 Ca 0.34 -0.93 0.00 0.00 -0.96 0.00 0.00 56.93 55.38 2wv4 s PHE 152 Cb -0.08 -1.39 -0.04 0.00 -0.34 0.00 0.00 43.02 41.17 2wv4 s PHE 152 CO 0.26 -0.53 0.45 0.00 -1.46 0.00 0.00 175.22 173.94 2wv4 s ALA 153 N 1.30 3.78 -0.12 11.12 0.00 -0.95 -2.10 121.76 134.80 2wv4 s ALA 153 Ca -0.01 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.75 2wv4 s ALA 153 Cb -0.14 -2.01 0.07 0.00 0.00 0.00 0.00 23.12 21.04 2wv4 s ALA 153 CO -0.06 0.22 0.69 1.52 0.00 0.00 0.00 175.76 178.13 2wv4 s TYR 154 N -2.07 -0.69 -0.21 0.00 -0.85 -0.58 -1.73 117.35 111.23 2wv4 s TYR 154 Ca 0.39 1.36 -0.29 0.00 -0.52 0.00 0.00 57.07 58.01 2wv4 s TYR 154 Cb -0.10 0.36 0.00 0.00 0.38 0.00 0.00 41.96 42.60 2wv4 s TYR 154 CO 0.32 -0.53 1.07 0.15 -1.52 0.00 0.00 175.55 175.03 2wv4 s LYS 155 N -0.70 4.27 -0.10 -3.49 3.01 0.88 0.29 119.74 123.91 2wv4 s LYS 155 Ca -0.08 1.41 -0.32 0.00 -1.01 0.00 0.00 55.97 55.97 2wv4 s LYS 155 Cb -0.02 -3.65 0.12 0.00 -1.01 0.00 0.00 37.83 33.28 2wv4 s LYS 155 CO 0.07 -0.62 1.07 0.00 0.51 0.00 0.00 175.35 176.38 2wv4 s ALA 156 N 3.15 -1.96 -0.53 5.17 0.00 0.00 -1.43 121.76 126.15 2wv4 s ALA 156 Ca 0.46 1.28 -0.16 0.00 0.00 0.00 0.00 51.96 53.53 2wv4 s ALA 156 Cb -0.16 0.15 0.12 0.00 0.00 0.00 0.00 23.12 23.22 2wv4 s ALA 156 CO 0.08 -0.66 0.51 0.00 0.00 0.00 0.00 175.76 175.68 2wv4 s ALA 157 N -2.74 3.60 0.22 0.00 0.00 -1.26 -3.36 121.76 118.23 2wv4 s ALA 157 Ca 0.08 -2.42 0.09 0.00 0.00 0.00 0.00 51.96 49.70 2wv4 s ALA 157 Cb -0.01 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 2wv4 s ALA 157 CO -0.06 -2.01 -0.01 0.95 0.00 0.00 0.00 175.76 174.62 2wv4 s THR 158 N 1.75 3.51 0.33 0.00 -4.23 -1.26 -4.99 115.64 110.75 2wv4 s THR 158 Ca 0.04 -1.70 0.03 0.00 -1.18 0.00 0.00 61.69 58.89 2wv4 s THR 158 Cb -0.28 -2.82 -0.05 0.00 1.34 0.00 0.00 72.50 70.69 2wv4 s THR 158 CO 0.04 -0.24 0.10 -0.13 -0.54 0.00 0.00 174.62 173.85 2wv4 s ARG 159 N -3.29 1.66 0.20 3.99 0.52 -1.26 -4.79 118.95 115.97 2wv4 s ARG 159 Ca 0.29 -1.95 -0.31 0.00 -0.52 0.00 0.00 55.73 53.24 2wv4 s ARG 159 Cb -0.08 -0.55 -0.09 0.00 0.52 0.00 0.00 34.95 34.75 2wv4 s ARG 159 CO 0.19 -0.33 1.42 0.00 0.02 0.00 0.00 175.30 176.60 2wv4 s ALA 160 N -3.43 3.62 0.00 2.13 0.00 -1.26 -2.73 121.76 120.10 2wv4 s ALA 160 Ca 0.33 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.54 2wv4 s ALA 160 Cb 0.06 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2wv4 s ALA 160 CO 0.15 -0.68 0.00 0.41 0.00 0.00 0.00 175.76 175.65 2wv4 n GLY 161 N 2.76 1.94 0.23 0.00 0.00 -1.26 -4.96 105.19 103.90 2wv4 n GLY 161 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 2wv4 n GLY 161 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2wv4 h TYR 162 N 0.00 0.00 -2.80 1.61 -1.99 -1.83 -3.35 116.97 108.61 2wv4 h TYR 162 Ca 0.00 0.00 -0.55 0.00 2.00 0.00 0.00 58.73 60.18 2wv4 h TYR 162 Cb 0.00 0.00 0.07 0.00 2.00 0.00 0.00 36.73 38.80 2wv4 h TYR 162 CO 0.00 0.00 0.87 0.00 -0.00 0.00 0.00 178.16 179.03 2wv4 n ALA 163 N -2.07 2.24 0.00 3.88 0.00 -1.26 -1.39 120.51 121.91 2wv4 n ALA 163 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2wv4 n ALA 163 Cb 0.44 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.46 2wv4 n ALA 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wv4 n GLY 164 N 3.00 2.19 3.76 0.00 0.00 -0.13 -1.48 105.19 112.53 2wv4 n GLY 164 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2wv4 n GLY 164 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wv4 s GLY 165 N -2.46 3.02 0.18 -0.02 0.00 -0.48 -3.70 107.32 103.85 2wv4 s GLY 165 Ca 0.00 1.04 -0.30 0.00 0.00 0.00 0.00 44.72 45.46 2wv4 s GLY 165 CO 0.00 1.66 1.15 0.00 0.00 0.00 0.00 173.10 175.90 2wv4 s ALA 166 N -1.18 3.40 -0.18 3.20 0.00 -0.98 0.14 121.76 126.15 2wv4 s ALA 166 Ca 0.47 0.88 -0.05 0.00 0.00 0.00 0.00 51.96 53.27 2wv4 s ALA 166 Cb -0.35 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.36 2wv4 s ALA 166 CO 0.45 -0.29 -0.01 0.08 0.00 0.00 0.00 175.76 175.99 2wv4 s VAL 167 N -0.10 3.95 0.03 0.00 1.01 0.76 -0.49 120.40 125.56 2wv4 s VAL 167 Ca 0.51 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.20 2wv4 s VAL 167 Cb -0.31 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2wv4 s VAL 167 CO 0.35 0.46 -0.04 -0.76 0.00 0.00 0.00 175.10 175.11 2wv4 s LEU 168 N 0.73 3.30 0.20 3.92 1.43 0.28 -0.50 118.68 128.04 2wv4 s LEU 168 Ca -0.01 -0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2wv4 s LEU 168 Cb -0.14 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 2wv4 s LEU 168 CO 0.02 0.25 0.13 0.00 0.23 0.00 0.00 176.35 176.98 2wv4 s ALA 169 N -1.11 1.18 -0.13 4.21 0.00 0.36 -1.80 121.76 124.47 2wv4 s ALA 169 Ca 0.20 -1.70 -0.21 0.00 0.00 0.00 0.00 51.96 50.25 2wv4 s ALA 169 Cb -0.11 1.37 -0.03 0.00 0.00 0.00 0.00 23.12 24.34 2wv4 s ALA 169 CO 0.11 -0.58 0.61 0.15 0.00 0.00 0.00 175.76 176.04 2wv4 s LYS 170 N -4.15 4.33 -0.66 0.00 -0.14 -1.26 -0.36 119.74 117.50 2wv4 s LYS 170 Ca 0.39 0.66 -0.04 0.00 -1.36 0.00 0.00 55.97 55.62 2wv4 s LYS 170 Cb 0.07 -3.49 0.17 0.00 -1.68 0.00 0.00 37.83 32.90 2wv4 s LYS 170 CO 0.12 -0.01 0.48 0.16 -0.76 0.00 0.00 175.35 175.34 2wv4 s ASP 171 N 0.88 5.37 1.59 2.83 3.84 0.75 -3.68 116.67 128.25 2wv4 s ASP 171 Ca 0.31 -2.90 0.00 0.00 -0.00 0.00 0.00 52.55 49.96 2wv4 s ASP 171 Cb -0.16 -1.88 0.00 0.00 -1.38 0.00 0.00 42.92 39.50 2wv4 s ASP 171 CO 0.13 -0.37 0.00 0.61 -0.00 0.00 0.00 175.17 175.54 2wv4 n GLY 172 N 3.44 2.39 0.08 2.12 0.00 -1.26 -1.26 105.19 110.71 2wv4 n GLY 172 Ca 0.09 0.03 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 2wv4 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wv4 n ALA 173 N 9.95 1.83 -2.13 4.61 0.00 -1.26 -4.95 120.51 128.57 2wv4 n ALA 173 Ca 0.00 -0.85 -0.30 0.00 0.00 0.00 0.00 53.44 52.29 2wv4 n ALA 173 Cb 0.00 -0.64 -0.02 0.00 0.00 0.00 0.00 19.45 18.79 2wv4 n ALA 173 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2wv4 s ASP 174 N -5.56 6.40 0.15 0.00 1.47 -0.39 -5.06 116.67 113.68 2wv4 s ASP 174 Ca -0.06 1.16 0.03 0.00 1.18 0.00 0.00 52.55 54.86 2wv4 s ASP 174 Cb 0.08 -2.34 -0.04 0.00 -0.34 0.00 0.00 42.92 40.29 2wv4 s ASP 174 CO 0.83 -0.55 0.21 -0.89 0.68 0.00 0.00 175.17 175.45 2wv4 s THR 175 N -2.65 4.95 0.21 2.11 2.01 -1.26 0.27 115.64 121.28 2wv4 s THR 175 Ca 0.51 -0.84 -0.12 0.00 0.31 0.00 0.00 61.69 61.55 2wv4 s THR 175 Cb -0.10 -3.53 -0.00 0.00 0.01 0.00 0.00 72.50 68.88 2wv4 s THR 175 CO 0.39 -0.08 0.42 0.72 -0.69 0.00 0.00 174.62 175.38 2wv4 s PHE 176 N -1.72 0.33 -0.22 4.92 -0.12 0.51 -4.78 117.98 116.89 2wv4 s PHE 176 Ca 0.33 -0.68 -0.16 0.00 -0.05 0.00 0.00 56.93 56.37 2wv4 s PHE 176 Cb -0.11 0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.37 2wv4 s PHE 176 CO 0.26 -0.89 0.39 0.42 -0.05 0.00 0.00 175.22 175.35 2wv4 s ILE 177 N -3.99 5.19 -0.12 -4.49 1.01 0.24 -0.49 121.20 118.56 2wv4 s ILE 177 Ca 0.20 0.66 -0.09 0.00 0.00 0.00 0.00 60.65 61.41 2wv4 s ILE 177 Cb 0.01 -3.72 -0.08 0.00 0.01 0.00 0.00 42.46 38.68 2wv4 s ILE 177 CO 0.05 0.23 0.20 0.58 0.00 0.00 0.00 174.94 175.99 2wv4 h VAL 178 N 5.12 0.52 0.00 2.92 2.07 -1.09 -3.38 116.25 122.40 2wv4 h VAL 178 Ca -0.35 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 65.76 2wv4 h VAL 178 Cb 1.16 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 2wv4 h VAL 178 CO 0.70 0.18 0.00 0.61 0.02 0.00 0.00 177.57 179.07 2wv4 n GLY 179 N 1.71 -0.62 3.74 2.17 0.00 -1.23 -1.78 105.19 109.17 2wv4 n GLY 179 Ca -0.05 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 2wv4 n GLY 179 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wv4 s THR 180 N -3.42 4.73 0.41 2.61 -4.23 -1.18 -0.17 115.64 114.39 2wv4 s THR 180 Ca 0.00 -0.09 -0.26 0.00 -1.18 0.00 0.00 61.69 60.16 2wv4 s THR 180 Cb 0.00 -3.03 -0.10 0.00 1.34 0.00 0.00 72.50 70.71 2wv4 s THR 180 CO 0.00 0.59 1.39 1.57 -0.54 0.00 0.00 174.62 177.63 2wv4 n HIS 181 N 2.26 2.58 0.00 3.99 -0.00 0.12 -1.35 115.22 122.82 2wv4 n HIS 181 Ca -0.19 0.47 0.00 0.00 0.46 0.00 0.00 57.72 58.46 2wv4 n HIS 181 Cb 0.54 -2.45 0.00 0.00 -0.12 0.00 0.00 29.99 27.96 2wv4 n HIS 181 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2wv4 n SER 182 N 0.18 1.99 -3.89 0.26 7.64 -0.04 -0.96 113.62 118.79 2wv4 n SER 182 Ca 0.04 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.83 2wv4 n SER 182 Cb 0.40 0.09 -0.06 0.00 -1.01 0.00 0.00 64.21 63.62 2wv4 n SER 182 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wv4 s ALA 183 N -1.45 -0.28 0.05 -0.43 0.00 -0.60 -4.83 121.76 114.22 2wv4 s ALA 183 Ca 0.00 -0.68 -0.28 0.00 0.00 0.00 0.00 51.96 51.00 2wv4 s ALA 183 Cb 0.00 0.84 0.09 0.00 0.00 0.00 0.00 23.12 24.05 2wv4 s ALA 183 CO 0.00 -0.68 0.97 0.20 0.00 0.00 0.00 175.76 176.25 2wv4 s GLY 184 N -2.93 -0.36 0.00 0.00 0.00 -1.26 -0.56 107.32 102.21 2wv4 s GLY 184 Ca 0.14 0.67 0.00 0.00 0.00 0.00 0.00 44.72 45.53 2wv4 s GLY 184 CO -0.01 0.20 0.00 0.61 0.00 0.00 0.00 173.10 173.89 2wv4 n GLY 185 N -0.35 4.03 3.64 0.20 0.00 -0.82 -5.02 105.19 106.87 2wv4 n GLY 185 Ca -0.07 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 2wv4 n GLY 185 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wv4 n ASN 186 N 0.00 -5.60 0.00 1.61 5.15 -1.26 -2.85 115.26 112.31 2wv4 n ASN 186 Ca 0.00 -0.59 0.00 0.00 -0.60 0.00 0.00 54.58 53.39 2wv4 n ASN 186 Cb 0.00 -4.83 0.00 0.00 -0.53 0.00 0.00 39.78 34.42 2wv4 n ASN 186 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wv4 n GLY 187 N -1.87 0.85 3.02 8.20 0.00 -1.26 -5.04 105.19 109.09 2wv4 n GLY 187 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 2wv4 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wv4 s VAL 188 N -3.38 0.85 0.15 1.61 0.11 -1.13 -0.82 120.40 117.79 2wv4 s VAL 188 Ca 0.00 -0.41 0.05 0.00 -2.93 0.00 0.00 61.98 58.69 2wv4 s VAL 188 Cb 0.00 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.07 2wv4 s VAL 188 CO 0.00 0.26 0.10 -0.83 -3.33 0.00 0.00 175.10 171.30 2wv4 s GLY 189 N 0.05 1.76 -0.05 6.54 0.00 0.15 -1.95 107.32 113.82 2wv4 s GLY 189 Ca -0.01 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 43.49 2wv4 s GLY 189 CO 0.00 -1.23 -0.02 -0.19 0.00 0.00 0.00 173.10 171.67 2wv4 s TYR 190 N -1.69 0.58 0.07 1.90 1.51 0.28 -1.52 117.35 118.48 2wv4 s TYR 190 Ca 0.30 -0.12 0.10 0.00 -1.01 0.00 0.00 57.07 56.33 2wv4 s TYR 190 Cb -0.10 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.11 2wv4 s TYR 190 CO 0.22 -0.20 -0.26 0.00 -1.11 0.00 0.00 175.55 174.20 2wv4 s SER 192 N -1.52 7.04 0.24 0.00 0.01 -0.46 -1.55 113.70 117.47 2wv4 s SER 192 Ca 0.12 1.84 -0.30 0.00 1.31 0.00 0.00 55.95 58.92 2wv4 s SER 192 Cb -0.10 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.48 2wv4 s SER 192 CO 0.03 -0.58 1.22 0.00 0.41 0.00 0.00 173.24 174.32 2wv4 s VAL 194 N -0.55 1.61 -0.01 0.00 1.01 -0.73 -4.97 120.40 116.76 2wv4 s VAL 194 Ca 0.51 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.46 2wv4 s VAL 194 Cb -0.35 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2wv4 s VAL 194 CO 0.42 0.46 1.02 -0.55 0.00 0.00 0.00 175.10 176.45 2wv4 s SER 195 N 0.77 7.30 0.29 3.32 0.15 -1.26 -4.47 113.70 119.80 2wv4 s SER 195 Ca -0.11 1.70 -0.03 0.00 0.70 0.00 0.00 55.95 58.22 2wv4 s SER 195 Cb -0.16 -2.57 0.42 0.00 -1.71 0.00 0.00 66.02 62.00 2wv4 s SER 195 CO 0.02 -0.33 1.96 -0.09 1.20 0.00 0.00 173.24 176.00 2wv4 h ARG 196 N 6.86 1.12 -0.14 5.44 2.43 -1.26 -1.76 114.38 127.06 2wv4 h ARG 196 Ca -0.40 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 58.60 2wv4 h ARG 196 Cb 1.21 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 2wv4 h ARG 196 CO 0.78 0.74 -0.37 0.77 -1.51 0.00 0.00 179.97 180.38 2wv4 h SER 197 N 1.15 0.30 -0.28 -3.80 0.02 -1.93 -0.45 113.55 108.57 2wv4 h SER 197 Ca 0.31 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 61.01 2wv4 h SER 197 Cb -0.12 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 2wv4 h SER 197 CO -0.07 0.66 -0.28 0.24 -1.14 0.00 0.00 176.83 176.24 2wv4 h MET 198 N 0.25 0.78 -0.31 3.45 2.86 -1.76 -1.41 114.93 118.79 2wv4 h MET 198 Ca 0.03 -0.35 -0.14 0.00 -2.06 0.00 0.00 59.70 57.18 2wv4 h MET 198 Cb 0.78 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 2wv4 h MET 198 CO 0.06 0.97 -0.37 -0.07 1.06 0.00 0.00 176.91 178.56 2wv4 h LEU 199 N 0.67 0.86 -0.92 1.22 3.38 -0.98 -1.30 115.31 118.24 2wv4 h LEU 199 Ca 0.08 -0.49 -0.04 0.00 0.09 0.00 0.00 57.88 57.53 2wv4 h LEU 199 Cb 0.81 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2wv4 h LEU 199 CO 0.07 1.18 0.32 1.56 0.09 0.00 0.00 178.44 181.66 2wv4 h GLN 200 N 0.57 1.11 -0.22 1.13 4.20 -0.97 -0.53 115.11 120.41 2wv4 h GLN 200 Ca 0.04 -0.18 -0.13 0.00 0.06 0.00 0.00 58.65 58.44 2wv4 h GLN 200 Cb 0.96 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.55 2wv4 h GLN 200 CO 0.09 0.88 -0.39 1.57 -0.67 0.00 0.00 178.83 180.31 2wv4 h LYS 201 N 1.09 0.64 0.00 1.46 -0.00 -1.22 -2.90 116.57 115.65 2wv4 h LYS 201 Ca 0.26 -0.40 -0.01 0.00 -0.00 0.00 0.00 60.65 60.49 2wv4 h LYS 201 Cb 0.17 0.05 -0.00 0.00 -0.00 0.00 0.00 32.23 32.45 2wv4 h LYS 201 CO -0.03 1.02 -0.05 1.98 -0.00 0.00 0.00 179.45 182.38 2wv4 h MET 202 N 0.34 0.00 0.04 0.07 -1.53 -0.93 -1.84 114.93 111.08 2wv4 h MET 202 Ca 0.01 0.00 -0.26 0.00 -3.44 0.00 0.00 59.70 56.01 2wv4 h MET 202 Cb 0.98 0.00 0.01 0.00 -0.55 0.00 0.00 31.60 32.05 2wv4 h MET 202 CO 0.09 0.05 -1.07 -0.22 0.14 0.00 0.00 176.91 175.89 2wv4 h LYS 203 N 0.00 0.52 -0.07 0.39 3.64 -0.90 -2.84 116.57 117.30 2wv4 h LYS 203 Ca -0.00 -0.62 -0.02 0.00 -1.27 0.00 0.00 60.65 58.74 2wv4 h LYS 203 Cb 0.24 0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2wv4 h LYS 203 CO 0.01 1.24 -0.04 0.00 -2.27 0.00 0.00 179.45 178.39 2wv4 h ALA 204 N 0.53 0.10 -0.09 5.00 0.00 -1.21 -3.04 119.26 120.55 2wv4 h ALA 204 Ca -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2wv4 h ALA 204 Cb 1.73 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 2wv4 h ALA 204 CO 0.20 -0.14 0.03 1.25 0.00 0.00 0.00 179.25 180.58 2wv4 h HIS 205 N -0.23 0.12 0.00 0.00 -0.00 -1.46 -3.41 115.15 110.17 2wv4 h HIS 205 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 2wv4 h HIS 205 Cb 0.49 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.86 2wv4 h HIS 205 CO 0.07 0.11 0.00 0.28 -0.00 0.00 0.00 177.93 178.39 2wv4 n VAL 206 N -4.49 0.00 0.00 5.26 0.31 -1.07 -5.10 118.33 113.24 2wv4 n VAL 206 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2wv4 n VAL 206 Cb 0.11 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 2wv4 n VAL 206 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98