#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 -0.18 -1.48 -2.12 5.85 -1.98 0.16 115.31 115.57 2wv5 h LEU 8 Ca 0.00 -0.32 0.13 0.00 0.84 0.00 0.00 57.88 58.53 2wv5 h LEU 8 Cb 0.00 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 2wv5 h LEU 8 CO 0.00 0.27 0.51 -0.61 -0.34 0.00 0.00 178.44 178.27 2wv5 h GLN 9 N -0.67 0.51 0.00 1.25 4.15 -1.99 0.79 115.11 119.14 2wv5 h GLN 9 Ca -0.02 -0.03 -0.10 0.00 0.77 0.00 0.00 58.65 59.27 2wv5 h GLN 9 Cb 0.49 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 2wv5 h GLN 9 CO 0.04 0.34 -0.45 0.87 -1.93 0.00 0.00 178.83 177.69 2wv5 h LYS 10 N 0.53 0.00 0.01 1.69 1.57 -1.97 -2.42 116.57 115.97 2wv5 h LYS 10 Ca 0.38 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 59.01 2wv5 h LYS 10 Cb 0.73 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.05 2wv5 h LYS 10 CO -0.14 0.45 -0.57 1.98 -0.57 0.00 0.00 179.45 180.61 2wv5 h MET 11 N 0.00 0.37 -0.09 3.15 1.85 0.33 -3.12 114.93 117.43 2wv5 h MET 11 Ca -0.00 -0.41 -0.17 0.00 -0.61 0.00 0.00 59.70 58.50 2wv5 h MET 11 Cb 1.20 0.12 -0.01 0.00 0.43 0.00 0.00 31.60 33.34 2wv5 h MET 11 CO 0.06 1.09 -0.68 0.28 -0.40 0.00 0.00 176.91 177.26 2wv5 h VAL 12 N -0.17 1.37 -0.04 -5.77 2.07 -0.10 -2.75 116.25 110.87 2wv5 h VAL 12 Ca -0.07 -2.06 -0.04 0.00 0.82 0.00 0.00 66.70 65.34 2wv5 h VAL 12 Cb 1.29 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 2wv5 h VAL 12 CO 0.11 0.62 -0.18 -0.03 0.02 0.00 0.00 177.57 178.11 2wv5 h MET 13 N 0.28 0.06 0.00 1.57 -1.53 -1.54 -0.41 114.93 113.36 2wv5 h MET 13 Ca -0.02 -0.01 -0.10 0.00 -3.44 0.00 0.00 59.70 56.13 2wv5 h MET 13 Cb 1.23 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 32.26 2wv5 h MET 13 CO 0.12 0.24 -0.47 0.78 0.14 0.00 0.00 176.91 177.72 2wv5 h GLY 14 N 0.63 0.00 1.13 1.39 0.00 -1.42 -2.75 103.07 102.04 2wv5 h GLY 14 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2wv5 h GLY 14 CO 0.02 0.00 -0.39 0.70 0.00 0.00 0.00 176.54 176.87 2wv5 n ASN 15 N -3.83 0.44 -4.63 0.19 4.13 -0.28 -4.85 115.26 106.44 2wv5 n ASN 15 Ca -0.01 -0.17 -0.42 0.00 1.68 0.00 0.00 54.58 55.67 2wv5 n ASN 15 Cb 0.52 0.11 -0.05 0.00 -1.54 0.00 0.00 39.78 38.82 2wv5 n ASN 15 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2wv5 s THR 16 N -2.96 4.84 0.13 3.41 2.01 -0.53 -1.35 115.64 121.19 2wv5 s THR 16 Ca 0.13 1.38 0.10 0.00 0.31 0.00 0.00 61.69 63.60 2wv5 s THR 16 Cb 0.18 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.54 2wv5 s THR 16 CO 0.66 -0.12 -0.20 -0.54 -0.69 0.00 0.00 174.62 173.72 2wv5 s LYS 17 N 2.85 1.70 0.20 4.92 -0.14 0.08 -4.83 119.74 124.51 2wv5 s LYS 17 Ca 0.33 -1.24 -0.30 0.00 -1.36 0.00 0.00 55.97 53.39 2wv5 s LYS 17 Cb -0.15 -2.05 -0.08 0.00 -1.68 0.00 0.00 37.83 33.87 2wv5 s LYS 17 CO 0.09 0.47 0.98 -1.25 -0.76 0.00 0.00 175.35 174.88 2wv5 s PRO 18 N -2.21 4.76 -0.07 -1.68 0.04 -0.97 -1.36 135.00 133.51 2wv5 s PRO 18 Ca 0.18 1.54 0.05 0.00 0.04 0.00 0.00 61.00 62.81 2wv5 s PRO 18 Cb -0.10 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.14 2wv5 s PRO 18 CO 0.10 0.35 -0.23 0.08 0.04 0.00 0.00 177.00 177.33 2wv5 s VAL 19 N -0.73 1.93 -0.02 -0.36 1.01 -0.75 -0.96 120.40 120.52 2wv5 s VAL 19 Ca 0.44 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.48 2wv5 s VAL 19 Cb -0.26 -1.65 -0.00 0.00 0.00 0.00 0.00 36.38 34.46 2wv5 s VAL 19 CO 0.33 0.54 -0.10 -1.61 0.00 0.00 0.00 175.10 174.25 2wv5 s GLU 20 N 0.10 0.90 -0.23 2.72 8.01 -0.08 -1.56 118.70 128.56 2wv5 s GLU 20 Ca -0.10 -0.34 -0.11 0.00 0.01 0.00 0.00 54.97 54.43 2wv5 s GLU 20 Cb -0.15 -0.85 -0.05 0.00 -4.31 0.00 0.00 34.13 28.76 2wv5 s GLU 20 CO 0.06 0.17 0.18 -0.51 0.01 0.00 0.00 175.26 175.17 2wv5 s LEU 21 N -0.05 4.12 -0.14 1.80 1.43 0.44 0.42 118.68 126.70 2wv5 s LEU 21 Ca 0.01 0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.22 2wv5 s LEU 21 Cb -0.06 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 2wv5 s LEU 21 CO 0.00 0.06 0.02 -0.63 0.23 0.00 0.00 176.35 176.02 2wv5 s ILE 22 N 1.05 4.43 -0.29 -0.59 -1.09 0.80 -0.38 121.20 125.12 2wv5 s ILE 22 Ca 0.09 -0.18 -0.03 0.00 -2.23 0.00 0.00 60.65 58.29 2wv5 s ILE 22 Cb -0.13 -2.93 0.11 0.00 -1.58 0.00 0.00 42.46 37.92 2wv5 s ILE 22 CO 0.05 0.53 0.16 -0.22 -1.23 0.00 0.00 174.94 174.22 2wv5 s LEU 23 N -0.13 0.44 -0.61 2.97 2.96 -0.08 -1.09 118.68 123.13 2wv5 s LEU 23 Ca 0.05 -1.23 -0.00 0.00 -0.22 0.00 0.00 54.13 52.73 2wv5 s LEU 23 Cb -0.12 -0.23 -0.00 0.00 0.50 0.00 0.00 46.19 46.33 2wv5 s LEU 23 CO 0.02 -0.43 0.51 0.47 -1.32 0.00 0.00 176.35 175.60 2wv5 n ASP 24 N 5.24 -2.22 0.00 3.68 8.00 -1.26 -3.28 116.55 126.71 2wv5 n ASP 24 Ca -0.05 -0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.13 2wv5 n ASP 24 Cb 0.43 -2.89 0.00 0.00 -0.02 0.00 0.00 41.12 38.63 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 -1.09 0.54 3.63 0.44 0.00 -1.26 -4.97 105.19 102.48 2wv5 n GLY 25 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 2wv5 n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wv5 s LYS 26 N -0.49 2.34 -0.48 1.61 0.00 -1.21 -5.08 119.74 116.43 2wv5 s LYS 26 Ca 0.00 -0.93 -0.27 0.00 0.00 0.00 0.00 55.97 54.77 2wv5 s LYS 26 Cb 0.00 -2.42 0.03 0.00 0.00 0.00 0.00 37.83 35.44 2wv5 s LYS 26 CO 0.00 0.53 1.06 0.99 0.00 0.00 0.00 175.35 177.92 2wv5 s THR 27 N -1.26 4.29 -0.07 3.79 2.01 -1.26 -0.90 115.64 122.24 2wv5 s THR 27 Ca 0.23 0.99 0.21 0.00 0.31 0.00 0.00 61.69 63.44 2wv5 s THR 27 Cb -0.11 -4.55 -0.30 0.00 0.01 0.00 0.00 72.50 67.54 2wv5 s THR 27 CO 0.16 -0.98 0.47 1.33 -0.69 0.00 0.00 174.62 174.91 2wv5 n VAL 28 N 6.67 0.23 -3.82 3.82 0.24 0.49 -4.98 118.33 120.98 2wv5 n VAL 28 Ca 0.09 -0.55 -0.12 0.00 -2.04 0.00 0.00 64.34 61.72 2wv5 n VAL 28 Cb 0.49 -0.09 -0.11 0.00 -1.47 0.00 0.00 33.84 32.66 2wv5 n VAL 28 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wv5 s ALA 29 N -3.37 -0.47 -0.03 2.33 0.00 -1.17 -4.95 121.76 114.10 2wv5 s ALA 29 Ca -0.08 0.31 0.02 0.00 0.00 0.00 0.00 51.96 52.21 2wv5 s ALA 29 Cb 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.11 2wv5 s ALA 29 CO 0.89 -0.15 -0.09 0.42 0.00 0.00 0.00 175.76 176.83 2wv5 s ILE 30 N -0.54 0.82 0.00 0.00 1.01 -1.26 -0.42 121.20 120.81 2wv5 s ILE 30 Ca -0.06 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.22 2wv5 s ILE 30 Cb -0.04 -0.73 0.00 0.00 0.01 0.00 0.00 42.46 41.70 2wv5 s ILE 30 CO 0.01 0.26 0.00 0.00 0.00 0.00 0.00 174.94 175.21 2wv5 s ALA 33 N -2.81 -0.96 -0.33 0.00 0.00 -0.46 -4.49 121.76 112.71 2wv5 s ALA 33 Ca 0.18 1.41 -0.03 0.00 0.00 0.00 0.00 51.96 53.52 2wv5 s ALA 33 Cb 0.02 -0.86 0.06 0.00 0.00 0.00 0.00 23.12 22.34 2wv5 s ALA 33 CO 0.10 -0.25 0.06 0.99 0.00 0.00 0.00 175.76 176.66 2wv5 s THR 34 N 1.31 3.18 0.11 0.00 2.01 -0.43 -0.75 115.64 121.08 2wv5 s THR 34 Ca -0.09 -1.49 -0.31 0.00 0.31 0.00 0.00 61.69 60.11 2wv5 s THR 34 Cb -0.08 -2.90 -0.07 0.00 0.01 0.00 0.00 72.50 69.45 2wv5 s THR 34 CO -0.11 -0.24 1.29 -0.83 -0.69 0.00 0.00 174.62 174.03 2wv5 s GLY 35 N 1.39 2.27 -0.16 4.40 0.00 -0.46 -0.02 107.32 114.76 2wv5 s GLY 35 Ca -0.02 1.00 0.07 0.00 0.00 0.00 0.00 44.72 45.77 2wv5 s GLY 35 CO -0.01 2.14 -0.06 3.33 0.00 0.00 0.00 173.10 178.50 2wv5 n VAL 36 N 3.60 0.97 -3.55 1.40 0.24 -0.76 -4.78 118.33 115.45 2wv5 n VAL 36 Ca 0.09 -0.48 -0.06 0.00 -2.04 0.00 0.00 64.34 61.85 2wv5 n VAL 36 Cb 0.44 -0.88 -0.02 0.00 -1.47 0.00 0.00 33.84 31.91 2wv5 n VAL 36 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2wv5 s PHE 37 N -2.34 -0.25 0.00 6.34 -0.12 -1.21 -0.23 117.98 120.17 2wv5 s PHE 37 Ca -0.15 0.13 0.00 0.00 -0.05 0.00 0.00 56.93 56.86 2wv5 s PHE 37 Cb 0.05 0.54 0.00 0.00 -0.63 0.00 0.00 43.02 42.98 2wv5 s PHE 37 CO 0.48 -0.43 0.00 0.41 -0.05 0.00 0.00 175.22 175.62 2wv5 n GLY 38 N -0.21 2.20 2.12 1.99 0.00 -1.26 0.49 105.19 110.51 2wv5 n GLY 38 Ca -0.05 0.42 -0.11 0.00 0.00 0.00 0.00 46.02 46.28 2wv5 n GLY 38 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wv5 n THR 39 N 0.00 1.89 -4.40 2.61 -2.24 -1.26 -1.15 114.28 109.72 2wv5 n THR 39 Ca 0.00 -3.45 -0.34 0.00 -2.27 0.00 0.00 64.05 57.99 2wv5 n THR 39 Cb 0.00 -0.06 -0.12 0.00 -2.10 0.00 0.00 70.33 68.05 2wv5 n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wv5 s ALA 40 N -3.38 3.05 0.06 6.98 0.00 0.18 -0.54 121.76 128.11 2wv5 s ALA 40 Ca 0.40 -0.82 0.06 0.00 0.00 0.00 0.00 51.96 51.60 2wv5 s ALA 40 Cb 0.37 -1.53 -0.03 0.00 0.00 0.00 0.00 23.12 21.94 2wv5 s ALA 40 CO -0.01 0.30 -0.16 0.71 0.00 0.00 0.00 175.76 176.59 2wv5 s TYR 41 N 0.09 1.37 -0.17 0.00 1.51 -0.06 -1.83 117.35 118.26 2wv5 s TYR 41 Ca -0.00 -0.39 -0.18 0.00 -1.01 0.00 0.00 57.07 55.48 2wv5 s TYR 41 Cb -0.13 -0.79 -0.04 0.00 -0.11 0.00 0.00 41.96 40.89 2wv5 s TYR 41 CO 0.03 0.07 0.49 -0.51 -1.11 0.00 0.00 175.55 174.52 2wv5 s LEU 42 N -1.42 4.20 0.13 -1.29 1.43 0.97 0.97 118.68 123.67 2wv5 s LEU 42 Ca 0.02 0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 53.81 2wv5 s LEU 42 Cb -0.09 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 2wv5 s LEU 42 CO 0.02 -0.10 0.07 0.68 0.23 0.00 0.00 176.35 177.24 2wv5 s VAL 43 N 1.23 0.10 0.11 -1.59 -7.23 0.26 -1.31 120.40 111.97 2wv5 s VAL 43 Ca 0.24 -1.88 -0.31 0.00 -1.81 0.00 0.00 61.98 58.22 2wv5 s VAL 43 Cb -0.15 -2.02 -0.08 0.00 0.56 0.00 0.00 36.38 34.68 2wv5 s VAL 43 CO 0.10 -0.47 1.46 -2.84 -0.31 0.00 0.00 175.10 173.04 2wv5 s PRO 44 N -4.04 4.28 0.19 4.82 0.02 -1.26 -1.54 135.00 137.47 2wv5 s PRO 44 Ca 0.23 2.17 -0.06 0.00 0.02 0.00 0.00 61.00 63.36 2wv5 s PRO 44 Cb 0.07 -3.29 0.12 0.00 0.02 0.00 0.00 34.50 31.42 2wv5 s PRO 44 CO 0.01 -0.53 1.58 -0.09 -0.33 0.00 0.00 177.00 177.65 2wv5 h ARG 45 N 7.06 0.79 0.00 5.54 2.43 -1.37 -2.48 114.38 126.36 2wv5 h ARG 45 Ca -0.42 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 58.39 2wv5 h ARG 45 Cb 1.20 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2wv5 h ARG 45 CO 0.89 0.99 0.00 -2.39 -1.51 0.00 0.00 179.97 177.94 2wv5 n HIS 46 N -4.08 0.00 -0.09 2.20 1.44 -1.26 -2.14 115.22 111.30 2wv5 n HIS 46 Ca -0.01 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.59 2wv5 n HIS 46 Cb 0.48 -0.28 -0.04 0.00 0.12 0.00 0.00 29.99 30.27 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 0.42 0.00 2.39 5.85 -1.83 -2.76 115.31 119.38 2wv5 h LEU 47 Ca 0.00 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2wv5 h LEU 47 Cb 0.01 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.93 2wv5 h LEU 47 CO 0.00 0.58 0.00 0.49 -0.34 0.00 0.00 178.44 179.17 2wv5 n PHE 48 N -4.67 0.00 0.77 1.25 3.01 -0.91 -2.11 117.46 114.81 2wv5 n PHE 48 Ca -0.03 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.56 2wv5 n PHE 48 Cb 0.21 -0.02 0.43 0.00 -0.01 0.00 0.00 39.48 40.09 2wv5 n PHE 48 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wv5 n ALA 49 N -1.02 2.50 -2.19 4.37 0.00 -1.04 -4.83 120.51 118.30 2wv5 n ALA 49 Ca 0.17 -0.11 -0.28 0.00 0.00 0.00 0.00 53.44 53.21 2wv5 n ALA 49 Cb 0.09 -1.40 -0.00 0.00 0.00 0.00 0.00 19.45 18.14 2wv5 n ALA 49 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2wv5 s GLU 50 N -3.07 3.59 -0.39 0.00 0.41 -0.90 -5.03 118.70 113.32 2wv5 s GLU 50 Ca 0.11 0.34 -0.21 0.00 -0.41 0.00 0.00 54.97 54.80 2wv5 s GLU 50 Cb 0.15 -2.33 0.01 0.00 -1.78 0.00 0.00 34.13 30.18 2wv5 s GLU 50 CO 0.60 -0.24 0.67 -1.59 -0.49 0.00 0.00 175.26 174.21 2wv5 s LYS 51 N -4.67 3.57 0.18 1.61 -2.85 -1.26 -5.02 119.74 111.30 2wv5 s LYS 51 Ca 0.49 -0.03 -0.06 0.00 -1.00 0.00 0.00 55.97 55.37 2wv5 s LYS 51 Cb -0.10 -3.86 -0.02 0.00 -2.06 0.00 0.00 37.83 31.79 2wv5 s LYS 51 CO 0.44 -0.85 0.23 1.52 0.10 0.00 0.00 175.35 176.79 2wv5 s TYR 52 N 2.84 0.70 0.00 1.78 -0.85 -1.26 -4.79 117.35 115.77 2wv5 s TYR 52 Ca 0.25 -1.02 0.00 0.00 -0.52 0.00 0.00 57.07 55.78 2wv5 s TYR 52 Cb -0.14 -0.24 0.00 0.00 0.38 0.00 0.00 41.96 41.96 2wv5 s TYR 52 CO 0.17 -0.71 0.12 -0.40 -1.52 0.00 0.00 175.55 173.22 2wv5 n ASP 53 N -0.24 0.25 -3.68 -0.18 3.85 -0.25 -4.99 116.55 111.31 2wv5 n ASP 53 Ca -0.03 -0.62 -0.10 0.00 -0.71 0.00 0.00 54.79 53.32 2wv5 n ASP 53 Cb 0.64 0.25 -0.09 0.00 -1.35 0.00 0.00 41.12 40.57 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 -0.25 0.54 -0.25 0.11 1.02 -1.02 -4.77 119.74 115.13 2wv5 s LYS 54 Ca 0.00 0.90 -0.06 0.00 0.02 0.00 0.00 55.97 56.83 2wv5 s LYS 54 Cb 0.00 0.11 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 2wv5 s LYS 54 CO 0.00 -0.13 0.03 0.42 -0.92 0.00 0.00 175.35 174.75 2wv5 s ILE 55 N 1.15 3.84 -0.32 2.17 1.01 0.92 -0.14 121.20 129.82 2wv5 s ILE 55 Ca -0.07 -0.46 -0.21 0.00 0.00 0.00 0.00 60.65 59.90 2wv5 s ILE 55 Cb -0.06 -2.84 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 2wv5 s ILE 55 CO -0.11 0.29 0.67 -0.04 0.00 0.00 0.00 174.94 175.75 2wv5 s MET 56 N 1.52 3.84 -0.24 2.79 -1.94 0.17 -1.03 119.30 124.41 2wv5 s MET 56 Ca 0.05 0.29 0.02 0.00 -1.71 0.00 0.00 55.69 54.34 2wv5 s MET 56 Cb -0.15 -3.76 0.05 0.00 2.01 0.00 0.00 34.83 32.98 2wv5 s MET 56 CO 0.01 -0.66 -0.13 -1.17 -0.01 0.00 0.00 175.02 173.06 2wv5 s LEU 57 N 2.74 3.15 -1.45 -0.03 2.96 -0.08 -0.90 118.68 125.08 2wv5 s LEU 57 Ca 0.27 -1.20 -0.09 0.00 -0.22 0.00 0.00 54.13 52.89 2wv5 s LEU 57 Cb -0.14 -1.54 0.05 0.00 0.50 0.00 0.00 46.19 45.05 2wv5 s LEU 57 CO 0.13 -0.15 0.71 -0.67 -1.32 0.00 0.00 176.35 175.06 2wv5 n ASP 58 N 4.49 -5.08 0.00 3.68 2.03 -0.14 -0.97 116.55 120.56 2wv5 n ASP 58 Ca -0.16 -0.46 0.00 0.00 0.52 0.00 0.00 54.79 54.70 2wv5 n ASP 58 Cb 0.44 -4.11 0.00 0.00 -0.72 0.00 0.00 41.12 36.74 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 -1.50 1.07 3.52 0.27 0.00 -1.26 -5.02 105.19 102.28 2wv5 n GLY 59 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.38 3.76 0.05 1.61 3.52 -0.14 -5.07 118.95 122.29 2wv5 s ARG 60 Ca 0.00 -0.43 -0.29 0.00 -0.13 0.00 0.00 55.73 54.87 2wv5 s ARG 60 Cb 0.00 -3.54 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 2wv5 s ARG 60 CO 0.00 -0.22 0.95 0.00 -0.81 0.00 0.00 175.30 175.22 2wv5 s ALA 61 N 1.69 3.22 0.04 6.12 0.00 -1.26 -0.90 121.76 130.67 2wv5 s ALA 61 Ca 0.07 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2wv5 s ALA 61 Cb -0.16 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 2wv5 s ALA 61 CO 0.08 -0.11 -0.04 -1.64 0.00 0.00 0.00 175.76 174.04 2wv5 s MET 62 N 0.47 0.47 0.39 0.00 1.00 -0.20 -4.96 119.30 116.48 2wv5 s MET 62 Ca 0.48 -0.85 0.08 0.00 0.00 0.00 0.00 55.69 55.40 2wv5 s MET 62 Cb -0.22 0.03 -0.05 0.00 0.00 0.00 0.00 34.83 34.59 2wv5 s MET 62 CO 0.28 -0.04 0.18 0.95 0.00 0.00 0.00 175.02 176.39 2wv5 s THR 63 N -2.23 2.55 0.57 2.05 -4.23 -1.26 -0.06 115.64 113.04 2wv5 s THR 63 Ca -0.07 -1.67 0.29 0.00 -1.18 0.00 0.00 61.69 59.06 2wv5 s THR 63 Cb -0.04 -2.98 0.39 0.00 1.34 0.00 0.00 72.50 71.21 2wv5 s THR 63 CO -0.03 -0.06 1.93 0.44 -0.54 0.00 0.00 174.62 176.36 2wv5 h ASP 64 N 1.43 0.00 -0.02 3.99 3.32 -1.93 -0.33 116.42 122.88 2wv5 h ASP 64 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2wv5 h ASP 64 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2wv5 h ASP 64 CO 0.66 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.64 2wv5 n SER 65 N -3.88 0.12 -0.16 6.45 3.41 -1.26 -3.31 113.62 114.99 2wv5 n SER 65 Ca 0.09 -1.76 0.09 0.00 -0.26 0.00 0.00 58.87 57.03 2wv5 n SER 65 Cb 0.66 -0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.52 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 -0.55 1.25 -3.35 4.04 10.43 -0.13 -4.99 116.55 123.24 2wv5 n ASP 66 Ca 0.06 -1.12 -0.10 0.00 2.57 0.00 0.00 54.79 56.20 2wv5 n ASP 66 Cb 0.05 0.82 -0.02 0.00 1.84 0.00 0.00 41.12 43.81 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 -2.64 0.39 0.03 1.24 -0.85 -1.21 -1.10 117.35 113.21 2wv5 s TYR 67 Ca 0.11 -0.85 0.06 0.00 -0.52 0.00 0.00 57.07 55.86 2wv5 s TYR 67 Cb 0.15 0.44 -0.02 0.00 0.38 0.00 0.00 41.96 42.91 2wv5 s TYR 67 CO 0.70 -1.29 -0.17 1.03 -1.52 0.00 0.00 175.55 174.30 2wv5 s ARG 68 N -3.07 1.15 -0.29 -3.49 3.00 -0.30 -4.94 118.95 111.01 2wv5 s ARG 68 Ca 0.20 -0.79 0.03 0.00 0.00 0.00 0.00 55.73 55.17 2wv5 s ARG 68 Cb -0.03 -1.20 0.07 0.00 0.00 0.00 0.00 34.95 33.80 2wv5 s ARG 68 CO 0.13 0.30 -0.05 0.08 0.00 0.00 0.00 175.30 175.76 2wv5 s VAL 69 N -0.75 2.22 0.12 3.52 1.01 -1.26 -0.53 120.40 124.73 2wv5 s VAL 69 Ca 0.04 -1.89 -0.14 0.00 0.00 0.00 0.00 61.98 59.99 2wv5 s VAL 69 Cb -0.08 -2.44 -0.07 0.00 0.00 0.00 0.00 36.38 33.80 2wv5 s VAL 69 CO 0.01 -0.24 0.52 -0.36 0.00 0.00 0.00 175.10 175.04 2wv5 s PHE 70 N 1.03 3.63 0.07 5.22 0.40 -0.46 -4.92 117.98 122.96 2wv5 s PHE 70 Ca -0.02 1.05 0.05 0.00 -0.60 0.00 0.00 56.93 57.41 2wv5 s PHE 70 Cb -0.20 -2.35 -0.04 0.00 0.51 0.00 0.00 43.02 40.94 2wv5 s PHE 70 CO -0.06 0.47 -0.05 -1.21 0.70 0.00 0.00 175.22 175.07 2wv5 s GLU 71 N -1.80 2.41 -0.15 0.44 2.02 -1.26 -1.56 118.70 118.80 2wv5 s GLU 71 Ca 0.35 -0.87 -0.07 0.00 0.02 0.00 0.00 54.97 54.40 2wv5 s GLU 71 Cb -0.15 -2.45 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2wv5 s GLU 71 CO 0.19 0.54 0.09 -0.06 0.02 0.00 0.00 175.26 176.04 2wv5 s PHE 72 N -1.21 3.38 -0.15 1.61 0.40 -1.26 -5.01 117.98 115.74 2wv5 s PHE 72 Ca 0.22 0.28 -0.01 0.00 -0.60 0.00 0.00 56.93 56.83 2wv5 s PHE 72 Cb -0.11 -2.01 -0.01 0.00 0.51 0.00 0.00 43.02 41.40 2wv5 s PHE 72 CO 0.14 0.41 -0.11 -2.00 0.70 0.00 0.00 175.22 174.36 2wv5 s GLU 73 N -0.25 3.38 -0.06 0.44 2.12 -1.26 -1.00 118.70 122.08 2wv5 s GLU 73 Ca 0.09 -0.67 0.05 0.00 0.36 0.00 0.00 54.97 54.80 2wv5 s GLU 73 Cb -0.12 -2.72 -0.02 0.00 0.26 0.00 0.00 34.13 31.53 2wv5 s GLU 73 CO 0.01 0.11 -0.19 0.96 -0.54 0.00 0.00 175.26 175.60 2wv5 s ILE 74 N 0.64 2.59 -0.25 -3.70 -4.36 0.21 -4.84 121.20 111.49 2wv5 s ILE 74 Ca -0.06 -0.89 -0.29 0.00 -0.26 0.00 0.00 60.65 59.15 2wv5 s ILE 74 Cb -0.15 -1.98 -0.02 0.00 1.25 0.00 0.00 42.46 41.56 2wv5 s ILE 74 CO 0.03 0.58 1.51 -1.59 0.24 0.00 0.00 174.94 175.70 2wv5 s LYS 75 N -0.42 3.84 -0.33 0.37 0.00 -1.26 -0.46 119.74 121.48 2wv5 s LYS 75 Ca 0.04 1.52 0.00 0.00 0.00 0.00 0.00 55.97 57.54 2wv5 s LYS 75 Cb -0.12 -3.98 0.11 0.00 0.00 0.00 0.00 37.83 33.84 2wv5 s LYS 75 CO 0.02 -1.23 0.11 0.54 0.00 0.00 0.00 175.35 174.79 2wv5 s VAL 76 N 4.90 1.07 -0.80 1.79 0.11 -0.62 -4.86 120.40 122.00 2wv5 s VAL 76 Ca 0.66 -1.65 -0.04 0.00 -2.93 0.00 0.00 61.98 58.02 2wv5 s VAL 76 Cb -0.22 -1.80 -0.04 0.00 -1.53 0.00 0.00 36.38 32.79 2wv5 s VAL 76 CO 0.27 -0.70 0.71 2.29 -3.33 0.00 0.00 175.10 174.34 2wv5 n LYS 77 N 4.60 -1.65 0.00 1.54 0.00 -1.26 -4.09 118.16 117.30 2wv5 n LYS 77 Ca 0.00 0.88 0.00 0.00 -0.00 0.00 0.00 58.31 59.19 2wv5 n LYS 77 Cb 0.41 -5.06 0.00 0.00 -0.00 0.00 0.00 35.03 30.38 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 -1.37 2.21 3.69 2.58 0.00 -1.26 -4.94 105.19 106.09 2wv5 n GLY 78 Ca -0.04 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 2wv5 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wv5 n GLN 79 N 0.00 1.10 -3.74 1.61 10.64 -1.26 -4.90 117.38 120.82 2wv5 n GLN 79 Ca 0.00 0.43 -0.36 0.00 -1.83 0.00 0.00 57.00 55.24 2wv5 n GLN 79 Cb 0.00 -2.40 -0.06 0.00 -0.86 0.00 0.00 30.24 26.92 2wv5 n GLN 79 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2wv5 s ASP 80 N -1.28 6.52 0.33 2.61 1.01 -1.26 -1.59 116.67 123.02 2wv5 s ASP 80 Ca 0.79 0.61 0.07 0.00 0.71 0.00 0.00 52.55 54.72 2wv5 s ASP 80 Cb -0.40 -2.11 -0.07 0.00 1.01 0.00 0.00 42.92 41.36 2wv5 s ASP 80 CO 0.44 0.30 -0.02 -0.04 0.21 0.00 0.00 175.17 176.05 2wv5 s MET 81 N -1.49 1.71 -0.35 8.23 -1.94 0.39 -4.89 119.30 120.97 2wv5 s MET 81 Ca 0.24 -1.91 -0.18 0.00 -1.71 0.00 0.00 55.69 52.12 2wv5 s MET 81 Cb -0.13 -1.30 -0.00 0.00 2.01 0.00 0.00 34.83 35.41 2wv5 s MET 81 CO 0.13 -0.01 0.53 -1.17 -0.01 0.00 0.00 175.02 174.49 2wv5 s LEU 82 N -3.54 4.32 0.51 -0.03 2.96 -1.26 0.68 118.68 122.32 2wv5 s LEU 82 Ca 0.33 0.02 -0.22 0.00 -0.22 0.00 0.00 54.13 54.04 2wv5 s LEU 82 Cb 0.06 -2.62 -0.06 0.00 0.50 0.00 0.00 46.19 44.07 2wv5 s LEU 82 CO 0.15 -0.49 1.23 -0.55 -1.32 0.00 0.00 176.35 175.36 2wv5 s SER 83 N 1.76 5.75 0.00 3.68 0.15 -0.17 -4.31 113.70 120.57 2wv5 s SER 83 Ca 0.20 2.45 0.13 0.00 0.70 0.00 0.00 55.95 59.44 2wv5 s SER 83 Cb -0.15 -2.61 0.80 0.00 -1.71 0.00 0.00 66.02 62.35 2wv5 s SER 83 CO 0.13 -1.21 1.50 -0.67 1.20 0.00 0.00 173.24 174.19 2wv5 n ASP 84 N -0.82 0.00 -4.35 5.45 2.03 -1.26 -4.54 116.55 113.06 2wv5 n ASP 84 Ca 0.09 -1.55 -0.45 0.00 0.52 0.00 0.00 54.79 53.40 2wv5 n ASP 84 Cb 0.47 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.81 2wv5 n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wv5 s ALA 85 N -2.00 3.59 0.07 -1.67 0.00 -1.26 -0.97 121.76 119.51 2wv5 s ALA 85 Ca 0.20 -2.31 0.02 0.00 0.00 0.00 0.00 51.96 49.87 2wv5 s ALA 85 Cb 0.09 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.96 2wv5 s ALA 85 CO 0.16 -1.93 0.08 0.00 0.00 0.00 0.00 175.76 174.06 2wv5 s ALA 86 N 1.75 3.57 -0.24 0.00 0.00 -0.59 -4.08 121.76 122.16 2wv5 s ALA 86 Ca 0.05 -0.99 -0.07 0.00 0.00 0.00 0.00 51.96 50.95 2wv5 s ALA 86 Cb -0.27 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.37 2wv5 s ALA 86 CO 0.05 0.74 0.05 -1.17 0.00 0.00 0.00 175.76 175.44 2wv5 s LEU 87 N -2.29 3.38 -0.46 0.00 2.96 -0.60 -0.58 118.68 121.09 2wv5 s LEU 87 Ca 0.28 -0.22 -0.15 0.00 -0.22 0.00 0.00 54.13 53.83 2wv5 s LEU 87 Cb -0.12 -1.90 0.07 0.00 0.50 0.00 0.00 46.19 44.74 2wv5 s LEU 87 CO 0.21 -0.02 0.38 -0.32 -1.32 0.00 0.00 176.35 175.27 2wv5 s MET 88 N 1.53 2.94 -0.45 1.98 -2.45 0.27 -1.35 119.30 121.77 2wv5 s MET 88 Ca 0.06 -1.36 -0.16 0.00 -1.25 0.00 0.00 55.69 52.99 2wv5 s MET 88 Cb -0.15 -4.09 0.05 0.00 1.25 0.00 0.00 34.83 31.89 2wv5 s MET 88 CO 0.03 -1.01 0.38 0.08 1.05 0.00 0.00 175.02 175.54 2wv5 s VAL 89 N 1.62 5.21 0.50 10.11 1.01 0.32 -0.88 120.40 138.28 2wv5 s VAL 89 Ca 0.04 -0.86 -0.21 0.00 0.00 0.00 0.00 61.98 60.95 2wv5 s VAL 89 Cb -0.24 -4.07 -0.07 0.00 0.00 0.00 0.00 36.38 32.00 2wv5 s VAL 89 CO 0.06 -0.50 1.09 -0.76 0.00 0.00 0.00 175.10 174.99 2wv5 s LEU 90 N 1.74 3.86 -0.08 3.92 1.43 0.30 -1.15 118.68 128.70 2wv5 s LEU 90 Ca 0.05 2.08 -0.25 0.00 -1.03 0.00 0.00 54.13 54.98 2wv5 s LEU 90 Cb -0.22 -4.49 -0.21 0.00 0.03 0.00 0.00 46.19 41.30 2wv5 s LEU 90 CO 0.08 -0.93 0.96 0.45 0.23 0.00 0.00 176.35 177.14 2wv5 h HIS 91 N 1.58 -0.04 -3.98 0.29 3.86 -1.44 -3.45 115.15 111.96 2wv5 h HIS 91 Ca -0.50 -0.00 -0.69 0.00 -1.16 0.00 0.00 60.37 58.03 2wv5 h HIS 91 Cb 1.24 0.01 -0.29 0.00 1.06 0.00 0.00 27.41 29.43 2wv5 h HIS 91 CO 0.54 0.63 -0.85 1.03 0.86 0.00 0.00 177.93 180.14 2wv5 s ARG 92 N -3.21 2.61 0.00 2.45 3.00 -1.26 -5.09 118.95 117.44 2wv5 s ARG 92 Ca -0.16 -0.84 0.00 0.00 0.00 0.00 0.00 55.73 54.73 2wv5 s ARG 92 Cb -0.00 -2.25 0.00 0.00 0.00 0.00 0.00 34.95 32.70 2wv5 s ARG 92 CO 0.62 0.42 0.00 0.41 0.00 0.00 0.00 175.30 176.75 2wv5 n GLY 93 N 2.86 0.92 3.62 -3.53 0.00 -1.26 -5.10 105.19 102.71 2wv5 n GLY 93 Ca -0.17 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.68 2wv5 n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wv5 s ASN 94 N 0.00 6.69 0.60 1.61 0.01 -1.26 -4.91 114.94 117.68 2wv5 s ASN 94 Ca 0.00 0.95 -0.18 0.00 -0.71 0.00 0.00 52.86 52.92 2wv5 s ASN 94 Cb 0.00 -2.54 -0.10 0.00 0.41 0.00 0.00 41.25 39.02 2wv5 s ASN 94 CO 0.00 -1.11 0.29 2.29 -1.51 0.00 0.00 177.10 177.06 2wv5 n LYS 95 N 7.41 0.31 -4.35 -0.60 2.85 -1.26 -4.84 118.16 117.69 2wv5 n LYS 95 Ca 0.14 0.13 -0.26 0.00 -1.05 0.00 0.00 58.31 57.26 2wv5 n LYS 95 Cb 0.47 -1.51 -0.09 0.00 -0.65 0.00 0.00 35.03 33.26 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 -1.84 2.15 -0.24 0.58 -7.23 -0.30 -5.00 120.40 108.51 2wv5 s VAL 96 Ca 0.64 -1.83 -0.29 0.00 -1.81 0.00 0.00 61.98 58.69 2wv5 s VAL 96 Cb -0.43 -2.98 -0.00 0.00 0.56 0.00 0.00 36.38 33.53 2wv5 s VAL 96 CO 0.59 0.00 1.23 0.00 -0.31 0.00 0.00 175.10 176.61 2wv5 s ARG 97 N -3.82 4.09 -0.16 4.82 3.03 -1.26 -4.23 118.95 121.42 2wv5 s ARG 97 Ca 0.38 1.39 -0.31 0.00 2.03 0.00 0.00 55.73 59.22 2wv5 s ARG 97 Cb 0.06 -3.79 -0.09 0.00 -1.03 0.00 0.00 34.95 30.10 2wv5 s ARG 97 CO 0.20 -0.89 2.08 -3.47 -1.13 0.00 0.00 175.30 172.09 2wv5 n ASP 98 N 7.01 3.29 -0.01 -2.89 -0.08 -1.25 -4.49 116.55 118.12 2wv5 n ASP 98 Ca 0.14 0.59 0.01 0.00 -1.51 0.00 0.00 54.79 54.02 2wv5 n ASP 98 Cb 0.46 -1.45 0.02 0.00 2.34 0.00 0.00 41.12 42.49 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 6.51 1.00 -0.25 5.18 -5.35 0.68 -4.79 119.36 122.33 2wv5 n ILE 99 Ca 0.28 -1.04 0.13 0.00 -0.27 0.00 0.00 62.75 61.86 2wv5 n ILE 99 Cb 0.36 0.46 0.41 0.00 -1.74 0.00 0.00 39.64 39.13 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 0.36 0.80 0.00 7.28 1.35 -1.87 -0.43 112.91 120.40 2wv5 h THR 100 Ca 0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2wv5 h THR 100 Cb 0.61 0.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 2wv5 h THR 100 CO 0.00 0.11 0.00 2.29 -0.25 0.00 0.00 175.52 177.67 2wv5 n LYS 101 N -4.55 0.06 -0.19 4.72 2.85 -1.26 -1.16 118.16 118.62 2wv5 n LYS 101 Ca 0.17 0.07 0.09 0.00 -1.05 0.00 0.00 58.31 57.60 2wv5 n LYS 101 Cb 0.51 -1.50 0.19 0.00 -0.65 0.00 0.00 35.03 33.59 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 -1.08 0.51 -3.05 5.58 8.25 -0.17 -4.95 115.22 120.31 2wv5 n HIS 102 Ca 0.01 -0.34 -0.18 0.00 -0.26 0.00 0.00 57.72 56.96 2wv5 n HIS 102 Cb 0.01 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.14 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 -1.17 2.37 0.31 4.41 0.40 -0.31 -0.60 117.98 123.40 2wv5 s PHE 103 Ca 0.32 -0.51 0.03 0.00 -0.60 0.00 0.00 56.93 56.18 2wv5 s PHE 103 Cb 0.18 -2.31 -0.04 0.00 0.51 0.00 0.00 43.02 41.36 2wv5 s PHE 103 CO 0.25 -0.63 0.15 1.03 0.70 0.00 0.00 175.22 176.72 2wv5 s ARG 104 N -4.44 1.62 0.00 0.44 0.52 -1.26 -4.71 118.95 111.12 2wv5 s ARG 104 Ca 0.57 -1.93 0.23 0.00 -0.52 0.00 0.00 55.73 54.08 2wv5 s ARG 104 Cb -0.08 -0.17 0.40 0.00 0.52 0.00 0.00 34.95 35.62 2wv5 s ARG 104 CO 0.34 -0.44 1.39 -0.25 0.02 0.00 0.00 175.30 176.36 2wv5 n ASP 105 N -0.94 3.44 -3.65 0.23 8.00 -1.26 0.49 116.55 122.85 2wv5 n ASP 105 Ca 0.00 -1.99 -0.08 0.00 0.71 0.00 0.00 54.79 53.43 2wv5 n ASP 105 Cb 0.65 -0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 41.51 2wv5 n ASP 105 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2wv5 s THR 106 N -1.52 0.00 -0.64 -3.53 -4.23 -1.26 -4.89 115.64 99.57 2wv5 s THR 106 Ca 0.38 -1.05 -0.10 0.00 -1.18 0.00 0.00 61.69 59.74 2wv5 s THR 106 Cb 0.22 -2.23 -0.09 0.00 1.34 0.00 0.00 72.50 71.75 2wv5 s THR 106 CO 0.31 0.00 1.81 0.00 -0.54 0.00 0.00 174.62 176.21 2wv5 n ALA 107 N -0.47 3.36 0.44 3.99 0.00 -1.26 -4.59 120.51 121.98 2wv5 n ALA 107 Ca -0.05 -1.98 0.00 0.00 0.00 0.00 0.00 53.44 51.41 2wv5 n ALA 107 Cb 0.59 -3.12 0.00 0.00 0.00 0.00 0.00 19.45 16.93 2wv5 n ALA 107 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2wv5 n ARG 108 N 5.33 0.26 -0.09 0.00 0.63 -1.26 -4.70 116.66 116.83 2wv5 n ARG 108 Ca 0.37 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 2wv5 n ARG 108 Cb 0.19 -1.04 0.00 0.00 0.45 0.00 0.00 32.46 32.06 2wv5 n ARG 108 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 2wv5 n MET 109 N -0.23 2.40 -3.58 -0.14 2.81 -1.26 -4.62 117.12 112.50 2wv5 n MET 109 Ca 0.00 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.87 2wv5 n MET 109 Cb 0.02 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 32.48 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 1.88 0.49 -0.46 0.03 0.00 -1.26 -5.08 119.74 115.34 2wv5 s LYS 110 Ca 0.00 1.06 -0.35 0.00 0.00 0.00 0.00 55.97 56.67 2wv5 s LYS 110 Cb 0.00 0.45 -0.16 0.00 0.00 0.00 0.00 37.83 38.12 2wv5 s LYS 110 CO 0.00 -0.14 1.83 1.17 0.00 0.00 0.00 175.35 178.21 2wv5 n LYS 111 N 4.74 0.00 0.00 1.78 4.81 -1.26 -2.05 118.16 126.18 2wv5 n LYS 111 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.30 2wv5 n LYS 111 Cb 0.54 -1.24 0.00 0.00 0.02 0.00 0.00 35.03 34.34 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 6.12 1.95 3.68 3.14 0.00 0.47 -4.97 105.19 115.57 2wv5 n GLY 112 Ca 0.47 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.21 2wv5 n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wv5 s THR 113 N -2.00 3.84 -0.17 2.61 -4.23 -0.87 -4.74 115.64 110.08 2wv5 s THR 113 Ca 0.00 -1.28 -0.36 0.00 -1.18 0.00 0.00 61.69 58.87 2wv5 s THR 113 Cb 0.00 -2.90 -0.13 0.00 1.34 0.00 0.00 72.50 70.81 2wv5 s THR 113 CO 0.00 -0.04 1.85 -2.65 -0.54 0.00 0.00 174.62 173.24 2wv5 n PRO 114 N 0.07 1.78 -5.17 3.99 -0.02 -1.26 -1.14 135.00 133.25 2wv5 n PRO 114 Ca -0.10 0.65 -0.30 0.00 -2.02 0.00 0.00 63.50 61.73 2wv5 n PRO 114 Cb 0.54 -2.45 -0.16 0.00 -0.02 0.00 0.00 33.50 31.41 2wv5 n PRO 114 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wv5 s VAL 115 N 4.08 1.87 -0.08 -1.45 1.01 -0.84 -3.30 120.40 121.69 2wv5 s VAL 115 Ca 0.96 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 2wv5 s VAL 115 Cb -0.83 -1.57 0.03 0.00 0.00 0.00 0.00 36.38 34.01 2wv5 s VAL 115 CO 0.57 0.53 -0.03 -0.69 0.00 0.00 0.00 175.10 175.47 2wv5 s VAL 116 N -0.37 0.60 -0.20 2.92 1.01 0.35 -1.66 120.40 123.04 2wv5 s VAL 116 Ca 0.04 -0.04 -0.11 0.00 0.00 0.00 0.00 61.98 61.87 2wv5 s VAL 116 Cb -0.11 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 2wv5 s VAL 116 CO 0.01 0.29 0.19 -0.83 0.00 0.00 0.00 175.10 174.76 2wv5 s GLY 117 N 1.73 2.06 -0.22 4.51 0.00 0.98 -1.12 107.32 115.26 2wv5 s GLY 117 Ca 0.02 -0.68 -0.10 0.00 0.00 0.00 0.00 44.72 43.96 2wv5 s GLY 117 CO -0.05 0.32 0.15 0.14 0.00 0.00 0.00 173.10 173.66 2wv5 s VAL 118 N 0.65 5.38 0.12 1.40 1.01 0.02 -1.39 120.40 127.59 2wv5 s VAL 118 Ca 0.10 0.20 0.09 0.00 0.00 0.00 0.00 61.98 62.37 2wv5 s VAL 118 Cb -0.12 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2wv5 s VAL 118 CO 0.02 0.39 -0.21 -0.69 0.00 0.00 0.00 175.10 174.61 2wv5 s VAL 119 N 0.74 1.79 -0.35 2.92 1.01 -0.10 -3.34 120.40 123.08 2wv5 s VAL 119 Ca 0.08 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.41 2wv5 s VAL 119 Cb -0.12 -1.66 0.19 0.00 0.00 0.00 0.00 36.38 34.78 2wv5 s VAL 119 CO 0.02 -0.11 0.80 0.21 0.00 0.00 0.00 175.10 176.02 2wv5 s ASN 120 N -2.10 -1.07 0.21 3.32 2.47 -1.23 -1.63 114.94 114.91 2wv5 s ASN 120 Ca 0.09 -0.32 -0.05 0.00 0.42 0.00 0.00 52.86 53.00 2wv5 s ASN 120 Cb -0.09 1.45 -0.03 0.00 -1.45 0.00 0.00 41.25 41.13 2wv5 s ASN 120 CO 0.05 -0.14 0.24 0.54 -3.72 0.00 0.00 177.10 174.06 2wv5 s ASN 121 N 2.21 0.08 0.25 -4.21 2.20 -1.02 -2.28 114.94 112.17 2wv5 s ASN 121 Ca 0.16 -1.22 0.18 0.00 -0.94 0.00 0.00 52.86 51.04 2wv5 s ASN 121 Cb -0.03 0.44 0.93 0.00 -2.00 0.00 0.00 41.25 40.59 2wv5 s ASN 121 CO -0.15 -0.93 1.55 0.00 -2.94 0.00 0.00 177.10 174.64 2wv5 n ALA 122 N -0.29 1.15 -0.05 3.54 0.00 -1.26 -1.13 120.51 122.47 2wv5 n ALA 122 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 53.44 53.57 2wv5 n ALA 122 Cb 0.65 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 2wv5 n ALA 122 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2wv5 h ASP 123 N 0.00 -0.01 -0.02 0.00 3.58 -1.96 -3.41 116.42 114.60 2wv5 h ASP 123 Ca 0.00 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.37 2wv5 h ASP 123 Cb 0.06 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.12 2wv5 h ASP 123 CO 0.00 0.53 0.00 1.33 -2.88 0.00 0.00 179.24 178.22 2wv5 n VAL 124 N -4.77 1.65 -4.81 2.25 0.24 -1.22 -5.11 118.33 106.56 2wv5 n VAL 124 Ca -0.01 -1.88 0.00 0.00 -2.04 0.00 0.00 64.34 60.41 2wv5 n VAL 124 Cb 0.04 -0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.39 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 -1.10 2.07 3.77 7.63 0.00 -0.28 -4.58 105.19 112.69 2wv5 n GLY 125 Ca 0.12 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 2wv5 n GLY 125 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wv5 s ARG 126 N 0.00 4.15 0.16 1.61 0.52 -1.26 -2.42 118.95 121.70 2wv5 s ARG 126 Ca 0.00 0.35 -0.20 0.00 -0.52 0.00 0.00 55.73 55.36 2wv5 s ARG 126 Cb 0.00 -3.35 0.05 0.00 0.52 0.00 0.00 34.95 32.18 2wv5 s ARG 126 CO 0.00 0.39 0.54 -1.17 0.02 0.00 0.00 175.30 175.08 2wv5 s LEU 127 N -0.09 -0.21 -0.04 2.53 0.20 -0.65 -4.98 118.68 115.43 2wv5 s LEU 127 Ca 0.23 -0.16 0.03 0.00 0.69 0.00 0.00 54.13 54.92 2wv5 s LEU 127 Cb -0.15 2.33 0.00 0.00 -0.43 0.00 0.00 46.19 47.95 2wv5 s LEU 127 CO 0.10 -0.95 -0.12 -0.63 -0.29 0.00 0.00 176.35 174.45 2wv5 s ILE 128 N -3.78 1.08 -0.06 6.68 -1.09 -1.26 -0.92 121.20 121.85 2wv5 s ILE 128 Ca 0.03 -0.50 0.04 0.00 -2.23 0.00 0.00 60.65 57.99 2wv5 s ILE 128 Cb -0.00 -0.96 -0.00 0.00 -1.58 0.00 0.00 42.46 39.91 2wv5 s ILE 128 CO -0.11 0.33 -0.20 0.72 -1.23 0.00 0.00 174.94 174.45 2wv5 s PHE 129 N 0.29 2.00 -0.09 3.97 -0.12 -0.49 -4.97 117.98 118.57 2wv5 s PHE 129 Ca -0.07 -0.65 0.04 0.00 -0.05 0.00 0.00 56.93 56.20 2wv5 s PHE 129 Cb -0.12 -1.35 -0.00 0.00 -0.63 0.00 0.00 43.02 40.92 2wv5 s PHE 129 CO 0.02 -0.23 -0.22 -1.54 -0.05 0.00 0.00 175.22 173.19 2wv5 s SER 130 N 0.12 3.24 0.00 1.98 1.04 -1.26 -0.01 113.70 118.80 2wv5 s SER 130 Ca -0.08 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 55.85 2wv5 s SER 130 Cb -0.14 -1.32 0.00 0.00 0.10 0.00 0.00 66.02 64.67 2wv5 s SER 130 CO 0.04 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.05 2wv5 n GLY 131 N 3.38 4.24 3.62 7.32 0.00 -0.66 -4.73 105.19 118.35 2wv5 n GLY 131 Ca -0.19 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 2wv5 n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wv5 s GLU 132 N -0.86 3.02 0.10 1.61 2.02 0.38 -1.98 118.70 122.97 2wv5 s GLU 132 Ca 0.00 -0.47 -0.31 0.00 0.02 0.00 0.00 54.97 54.21 2wv5 s GLU 132 Cb 0.00 -2.75 -0.08 0.00 0.10 0.00 0.00 34.13 31.40 2wv5 s GLU 132 CO 0.00 0.62 1.51 0.00 0.02 0.00 0.00 175.26 177.40 2wv5 s ALA 133 N -0.66 3.66 0.00 5.21 0.00 -0.29 -0.48 121.76 129.20 2wv5 s ALA 133 Ca 0.10 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2wv5 s ALA 133 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.39 2wv5 s ALA 133 CO 0.02 -0.84 0.00 1.28 0.00 0.00 0.00 175.76 176.22 2wv5 n LEU 134 N 4.63 0.00 -3.97 0.00 4.77 -0.13 0.18 117.00 122.48 2wv5 n LEU 134 Ca 0.14 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 2wv5 n LEU 134 Cb 0.41 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.43 2wv5 n LEU 134 CO 0.60 0.00 0.02 0.42 -1.33 0.00 0.00 177.39 177.10 2wv5 s THR 135 N 0.09 0.05 0.38 -5.08 -4.23 -1.17 -4.02 115.64 101.66 2wv5 s THR 135 Ca 0.00 -1.39 -0.13 0.00 -1.18 0.00 0.00 61.69 59.00 2wv5 s THR 135 Cb 0.00 -1.92 -0.08 0.00 1.34 0.00 0.00 72.50 71.84 2wv5 s THR 135 CO 0.00 -0.22 0.77 -0.47 -0.54 0.00 0.00 174.62 174.16 2wv5 s TYR 136 N -3.98 3.43 -0.07 3.99 5.04 -1.26 0.22 117.35 124.71 2wv5 s TYR 136 Ca 0.19 1.15 0.02 0.00 -2.44 0.00 0.00 57.07 55.98 2wv5 s TYR 136 Cb 0.03 -2.51 0.01 0.00 0.35 0.00 0.00 41.96 39.84 2wv5 s TYR 136 CO 0.02 -0.04 -0.12 0.15 -1.34 0.00 0.00 175.55 174.22 2wv5 s LYS 137 N -3.51 1.66 -0.01 4.97 -0.14 0.19 -4.83 119.74 118.07 2wv5 s LYS 137 Ca 0.53 -0.39 -0.23 0.00 -1.36 0.00 0.00 55.97 54.52 2wv5 s LYS 137 Cb -0.10 -1.39 -0.14 0.00 -1.68 0.00 0.00 37.83 34.52 2wv5 s LYS 137 CO 0.25 0.01 1.00 -0.44 -0.76 0.00 0.00 175.35 175.41 2wv5 h ASP 138 N 7.04 -0.54 -3.02 2.83 3.45 -1.93 -1.80 116.42 122.44 2wv5 h ASP 138 Ca -0.31 -0.07 -0.38 0.00 0.43 0.00 0.00 57.03 56.71 2wv5 h ASP 138 Cb 1.18 0.14 -0.38 0.00 -0.56 0.00 0.00 39.33 39.71 2wv5 h ASP 138 CO 0.47 -0.14 -0.70 -0.63 -1.57 0.00 0.00 179.24 176.68 2wv5 s ILE 139 N -4.22 -0.18 -0.15 0.35 1.01 -1.26 -1.33 121.20 115.42 2wv5 s ILE 139 Ca -0.12 0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 2wv5 s ILE 139 Cb 0.01 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 42.02 2wv5 s ILE 139 CO 0.42 -0.06 0.06 -0.69 0.00 0.00 0.00 174.94 174.66 2wv5 s VAL 140 N 2.22 4.81 -0.29 2.92 1.01 -0.59 -4.93 120.40 125.54 2wv5 s VAL 140 Ca 0.04 -0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.85 2wv5 s VAL 140 Cb -0.14 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2wv5 s VAL 140 CO -0.07 0.52 0.26 -0.69 0.00 0.00 0.00 175.10 175.11 2wv5 s VAL 141 N -0.11 5.26 0.70 2.92 1.01 -1.26 -0.74 120.40 128.18 2wv5 s VAL 141 Ca 0.07 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.15 2wv5 s VAL 141 Cb -0.12 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.65 2wv5 s VAL 141 CO 0.01 0.16 1.07 -0.76 0.00 0.00 0.00 175.10 175.58 2wv5 s LEU 142 N 1.86 3.01 0.63 3.92 1.43 0.11 -4.95 118.68 124.69 2wv5 s LEU 142 Ca 0.09 1.44 0.35 0.00 -1.03 0.00 0.00 54.13 54.98 2wv5 s LEU 142 Cb -0.16 -4.29 1.98 0.00 0.03 0.00 0.00 46.19 43.74 2wv5 s LEU 142 CO 0.11 -1.40 2.21 -0.03 0.23 0.00 0.00 176.35 177.47 2wv5 h MET 143 N -0.69 0.00 -0.69 1.70 1.85 -1.98 0.75 114.93 115.87 2wv5 h MET 143 Ca -0.45 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.63 2wv5 h MET 143 Cb 1.22 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.25 2wv5 h MET 143 CO 0.59 0.00 0.02 -0.40 -0.40 0.00 0.00 176.91 176.72 2wv5 n ASP 144 N -3.42 4.66 0.00 1.39 5.75 -1.26 -4.88 116.55 118.79 2wv5 n ASP 144 Ca -0.02 -2.74 0.00 0.00 -0.01 0.00 0.00 54.79 52.02 2wv5 n ASP 144 Cb 0.19 -0.65 0.00 0.00 -1.03 0.00 0.00 41.12 39.63 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 0.45 2.71 3.79 6.12 0.00 0.26 -5.01 105.19 113.50 2wv5 n GLY 145 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.74 2.06 -0.05 1.61 -1.08 -1.25 -4.73 116.67 109.50 2wv5 s ASP 146 Ca 0.00 0.38 -0.07 0.00 -0.52 0.00 0.00 52.55 52.34 2wv5 s ASP 146 Cb 0.00 -0.47 0.01 0.00 -1.46 0.00 0.00 42.92 41.00 2wv5 s ASP 146 CO 0.00 -3.39 0.19 -0.89 0.52 0.00 0.00 175.17 171.59 2wv5 s THR 147 N -3.53 0.02 -0.02 1.71 2.01 -1.26 0.07 115.64 114.64 2wv5 s THR 147 Ca 0.73 -0.20 0.04 0.00 0.31 0.00 0.00 61.69 62.57 2wv5 s THR 147 Cb -0.06 -0.33 -0.01 0.00 0.01 0.00 0.00 72.50 72.11 2wv5 s THR 147 CO 0.54 -0.11 -0.14 -0.04 -0.69 0.00 0.00 174.62 174.19 2wv5 s MET 148 N -0.35 1.24 0.37 4.92 1.00 0.08 -4.98 119.30 121.59 2wv5 s MET 148 Ca -0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 55.69 55.14 2wv5 s MET 148 Cb -0.03 -1.16 -0.04 0.00 0.00 0.00 0.00 34.83 33.60 2wv5 s MET 148 CO 0.01 0.25 0.62 -1.25 0.00 0.00 0.00 175.02 174.65 2wv5 s PRO 149 N -0.14 3.54 -1.28 2.03 0.04 -1.26 -1.54 135.00 136.38 2wv5 s PRO 149 Ca 0.02 -0.10 -0.11 0.00 0.04 0.00 0.00 61.00 60.84 2wv5 s PRO 149 Cb -0.07 -2.57 -0.00 0.00 0.04 0.00 0.00 34.50 31.89 2wv5 s PRO 149 CO 0.00 0.06 0.59 0.41 0.04 0.00 0.00 177.00 178.11 2wv5 n GLY 150 N -1.74 -0.58 3.90 0.56 0.00 -0.44 -4.52 105.19 102.37 2wv5 n GLY 150 Ca -0.03 0.29 -0.25 0.00 0.00 0.00 0.00 46.02 46.03 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 -6.80 4.16 -0.12 0.99 1.43 -0.68 -0.92 118.68 116.74 2wv5 s LEU 151 Ca 0.23 0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 2wv5 s LEU 151 Cb -0.09 -2.73 -0.00 0.00 0.03 0.00 0.00 46.19 43.40 2wv5 s LEU 151 CO 0.88 0.03 -0.21 0.12 0.23 0.00 0.00 176.35 177.41 2wv5 s PHE 152 N -1.81 2.64 0.22 0.29 5.36 -0.27 0.55 117.98 124.96 2wv5 s PHE 152 Ca 0.33 -1.04 -0.08 0.00 -0.96 0.00 0.00 56.93 55.18 2wv5 s PHE 152 Cb -0.10 -1.77 -0.07 0.00 -0.34 0.00 0.00 43.02 40.74 2wv5 s PHE 152 CO 0.27 -0.43 0.51 0.00 -1.46 0.00 0.00 175.22 174.11 2wv5 s ALA 153 N 0.49 3.62 -0.11 11.12 0.00 0.13 -1.92 121.76 135.09 2wv5 s ALA 153 Ca -0.14 -0.36 -0.30 0.00 0.00 0.00 0.00 51.96 51.16 2wv5 s ALA 153 Cb -0.17 -2.35 0.09 0.00 0.00 0.00 0.00 23.12 20.69 2wv5 s ALA 153 CO 0.05 0.52 0.81 1.52 0.00 0.00 0.00 175.76 178.67 2wv5 s TYR 154 N -1.81 -0.56 -0.57 0.00 -0.85 -0.49 -0.96 117.35 112.13 2wv5 s TYR 154 Ca 0.46 1.01 -0.24 0.00 -0.52 0.00 0.00 57.07 57.77 2wv5 s TYR 154 Cb -0.11 0.41 0.04 0.00 0.38 0.00 0.00 41.96 42.68 2wv5 s TYR 154 CO 0.23 -0.48 0.96 0.15 -1.52 0.00 0.00 175.55 174.88 2wv5 s LYS 155 N -1.00 3.31 -0.14 -3.49 3.01 0.37 0.59 119.74 122.39 2wv5 s LYS 155 Ca -0.06 -0.31 -0.29 0.00 -1.01 0.00 0.00 55.97 54.30 2wv5 s LYS 155 Cb -0.01 -4.07 0.08 0.00 -1.01 0.00 0.00 37.83 32.82 2wv5 s LYS 155 CO 0.06 -1.54 0.76 0.00 0.51 0.00 0.00 175.35 175.14 2wv5 s ALA 156 N 4.02 -1.81 -0.69 5.17 0.00 -1.02 -0.47 121.76 126.95 2wv5 s ALA 156 Ca 0.30 1.60 -0.26 0.00 0.00 0.00 0.00 51.96 53.60 2wv5 s ALA 156 Cb -0.13 -0.53 0.04 0.00 0.00 0.00 0.00 23.12 22.50 2wv5 s ALA 156 CO 0.18 -0.34 1.17 0.00 0.00 0.00 0.00 175.76 176.77 2wv5 s ALA 157 N -0.63 2.89 0.34 0.00 0.00 -1.26 -4.19 121.76 118.91 2wv5 s ALA 157 Ca -0.06 -1.42 0.09 0.00 0.00 0.00 0.00 51.96 50.57 2wv5 s ALA 157 Cb -0.02 -4.10 -0.05 0.00 0.00 0.00 0.00 23.12 18.95 2wv5 s ALA 157 CO 0.05 -3.04 0.05 0.95 0.00 0.00 0.00 175.76 173.78 2wv5 s THR 158 N 5.13 2.72 0.17 0.00 -4.23 -1.26 -4.94 115.64 113.23 2wv5 s THR 158 Ca 0.32 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 58.89 2wv5 s THR 158 Cb -0.10 -2.86 -0.02 0.00 1.34 0.00 0.00 72.50 70.86 2wv5 s THR 158 CO 0.15 -0.19 0.22 -0.13 -0.54 0.00 0.00 174.62 174.14 2wv5 s ARG 159 N -3.76 1.16 0.50 3.99 0.52 -1.26 -4.94 118.95 115.16 2wv5 s ARG 159 Ca 0.36 -1.34 -0.23 0.00 -0.52 0.00 0.00 55.73 54.00 2wv5 s ARG 159 Cb -0.01 0.34 -0.07 0.00 0.52 0.00 0.00 34.95 35.74 2wv5 s ARG 159 CO 0.20 -0.41 1.40 0.00 0.02 0.00 0.00 175.30 176.51 2wv5 n ALA 160 N -0.22 1.81 0.00 2.13 0.00 -1.26 -2.32 120.51 120.65 2wv5 n ALA 160 Ca -0.04 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2wv5 n ALA 160 Cb 0.64 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.71 2wv5 n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wv5 n GLY 161 N 0.67 2.80 0.00 0.00 0.00 -1.26 -4.89 105.19 102.51 2wv5 n GLY 161 Ca 0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 2wv5 n GLY 161 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wv5 n TYR 162 N -0.70 0.00 -2.19 1.61 4.02 -0.98 -3.44 117.16 115.47 2wv5 n TYR 162 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2wv5 n TYR 162 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 2wv5 n TYR 162 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wv5 s ALA 163 N -2.00 3.56 0.00 -0.72 0.00 -1.26 -2.84 121.76 118.50 2wv5 s ALA 163 Ca 0.24 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.32 2wv5 s ALA 163 Cb 0.11 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2wv5 s ALA 163 CO 0.19 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.78 2wv5 n GLY 164 N 2.95 0.87 3.76 0.00 0.00 0.76 -0.38 105.19 113.15 2wv5 n GLY 164 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.25 2.97 0.20 -0.02 0.00 -1.13 -3.38 107.32 103.72 2wv5 s GLY 165 Ca 0.00 0.66 -0.30 0.00 0.00 0.00 0.00 44.72 45.08 2wv5 s GLY 165 CO 0.00 1.19 1.11 0.00 0.00 0.00 0.00 173.10 175.39 2wv5 s ALA 166 N -1.36 3.38 -0.17 3.20 0.00 -1.21 -1.24 121.76 124.37 2wv5 s ALA 166 Ca 0.46 0.84 -0.04 0.00 0.00 0.00 0.00 51.96 53.23 2wv5 s ALA 166 Cb -0.25 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 2wv5 s ALA 166 CO 0.31 -0.21 -0.04 0.08 0.00 0.00 0.00 175.76 175.91 2wv5 s VAL 167 N -0.44 3.81 0.02 0.00 1.01 -0.10 -0.80 120.40 123.90 2wv5 s VAL 167 Ca 0.48 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 62.16 2wv5 s VAL 167 Cb -0.30 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 2wv5 s VAL 167 CO 0.36 0.48 -0.23 -0.76 0.00 0.00 0.00 175.10 174.95 2wv5 s LEU 168 N 0.57 2.13 0.00 3.92 1.43 -0.27 0.54 118.68 126.99 2wv5 s LEU 168 Ca -0.03 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 2wv5 s LEU 168 Cb -0.14 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 44.96 2wv5 s LEU 168 CO 0.03 0.22 0.00 0.00 0.23 0.00 0.00 176.35 176.83 2wv5 n ALA 169 N 2.04 0.00 -3.24 4.21 0.00 -0.51 -0.50 120.51 122.51 2wv5 n ALA 169 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.03 2wv5 n ALA 169 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.91 2wv5 n ALA 169 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wv5 n LYS 170 N -0.04 1.21 -1.76 0.00 4.76 -1.21 -2.97 118.16 118.14 2wv5 n LYS 170 Ca 0.00 -3.60 -0.41 0.00 -2.87 0.00 0.00 58.31 51.43 2wv5 n LYS 170 Cb 0.00 -1.51 -0.03 0.00 -1.84 0.00 0.00 35.03 31.65 2wv5 n LYS 170 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wv5 s ASP 171 N -1.61 5.28 0.74 4.39 2.15 0.07 -4.59 116.67 123.10 2wv5 s ASP 171 Ca 0.37 1.30 0.00 0.00 0.43 0.00 0.00 52.55 54.65 2wv5 s ASP 171 Cb 0.18 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 2wv5 s ASP 171 CO -0.09 -2.19 0.00 0.61 -0.17 0.00 0.00 175.17 173.34 2wv5 n GLY 172 N 5.72 2.20 0.78 2.66 0.00 -1.26 -0.83 105.19 114.46 2wv5 n GLY 172 Ca 0.28 -0.53 0.07 0.00 0.00 0.00 0.00 46.02 45.84 2wv5 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wv5 n ALA 173 N 8.49 2.45 -2.66 4.61 0.00 -1.26 -4.88 120.51 127.26 2wv5 n ALA 173 Ca 0.00 -0.74 -0.38 0.00 0.00 0.00 0.00 53.44 52.33 2wv5 n ALA 173 Cb 0.00 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 2wv5 n ALA 173 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2wv5 s ASP 174 N -0.99 6.63 -0.23 0.00 1.47 -0.01 -5.08 116.67 118.46 2wv5 s ASP 174 Ca 0.28 0.75 -0.09 0.00 1.18 0.00 0.00 52.55 54.67 2wv5 s ASP 174 Cb 0.15 -2.18 -0.04 0.00 -0.34 0.00 0.00 42.92 40.51 2wv5 s ASP 174 CO 0.19 0.34 0.11 -0.89 0.68 0.00 0.00 175.17 175.59 2wv5 s THR 175 N -0.94 4.86 0.04 2.11 2.01 -1.26 -0.76 115.64 121.70 2wv5 s THR 175 Ca 0.20 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.24 2wv5 s THR 175 Cb -0.15 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.09 2wv5 s THR 175 CO 0.09 0.36 -0.10 0.72 -0.69 0.00 0.00 174.62 175.00 2wv5 s PHE 176 N 1.13 0.88 -0.06 4.92 -0.12 -1.16 -4.97 117.98 118.61 2wv5 s PHE 176 Ca 0.06 -0.37 -0.30 0.00 -0.05 0.00 0.00 56.93 56.26 2wv5 s PHE 176 Cb -0.14 -0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 41.70 2wv5 s PHE 176 CO 0.04 -0.01 1.16 0.42 -0.05 0.00 0.00 175.22 176.78 2wv5 s ILE 177 N -0.97 4.35 -0.08 -4.49 1.01 0.23 -1.42 121.20 119.83 2wv5 s ILE 177 Ca -0.03 1.67 -0.20 0.00 0.00 0.00 0.00 60.65 62.09 2wv5 s ILE 177 Cb -0.08 -4.07 -0.29 0.00 0.01 0.00 0.00 42.46 38.03 2wv5 s ILE 177 CO 0.01 0.00 0.75 0.58 0.00 0.00 0.00 174.94 176.28 2wv5 h VAL 178 N 5.01 1.34 0.00 2.92 2.07 -0.22 -3.38 116.25 123.99 2wv5 h VAL 178 Ca -0.34 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 64.71 2wv5 h VAL 178 Cb 1.16 3.01 0.00 0.00 -1.52 0.00 0.00 31.29 33.94 2wv5 h VAL 178 CO 0.87 0.69 0.00 0.61 0.02 0.00 0.00 177.57 179.76 2wv5 n GLY 179 N 1.68 -0.74 3.79 2.17 0.00 -1.21 -2.84 105.19 108.03 2wv5 n GLY 179 Ca -0.18 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 2wv5 n GLY 179 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wv5 s THR 180 N -3.00 4.58 0.16 2.61 -4.23 -0.72 -0.92 115.64 114.11 2wv5 s THR 180 Ca 0.00 -0.79 -0.30 0.00 -1.18 0.00 0.00 61.69 59.42 2wv5 s THR 180 Cb 0.00 -3.23 -0.07 0.00 1.34 0.00 0.00 72.50 70.54 2wv5 s THR 180 CO 0.00 0.09 1.18 -2.28 -0.54 0.00 0.00 174.62 173.07 2wv5 s HIS 181 N -1.45 3.46 0.07 3.99 2.46 -0.37 0.26 115.29 123.71 2wv5 s HIS 181 Ca 0.30 1.43 -0.00 0.00 0.47 0.00 0.00 55.06 57.25 2wv5 s HIS 181 Cb -0.12 -3.40 -0.00 0.00 -0.13 0.00 0.00 32.58 28.93 2wv5 s HIS 181 CO 0.23 -1.11 -0.01 0.43 -2.47 0.00 0.00 174.74 171.80 2wv5 n SER 182 N 2.76 0.92 -4.04 9.88 7.64 -0.61 -0.17 113.62 130.00 2wv5 n SER 182 Ca 0.05 0.12 -0.10 0.00 1.01 0.00 0.00 58.87 59.94 2wv5 n SER 182 Cb 0.45 -0.28 -0.11 0.00 -1.01 0.00 0.00 64.21 63.26 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 -2.02 0.39 -0.04 -0.43 0.00 -1.08 -4.70 121.76 113.88 2wv5 s ALA 183 Ca -0.01 -0.78 -0.06 0.00 0.00 0.00 0.00 51.96 51.12 2wv5 s ALA 183 Cb 0.00 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.26 2wv5 s ALA 183 CO 0.01 -0.14 0.15 0.20 0.00 0.00 0.00 175.76 175.99 2wv5 s GLY 184 N -1.78 -0.08 -0.23 0.00 0.00 -1.26 0.37 107.32 104.35 2wv5 s GLY 184 Ca -0.09 0.30 -0.14 0.00 0.00 0.00 0.00 44.72 44.78 2wv5 s GLY 184 CO -0.02 0.22 0.56 -0.32 0.00 0.00 0.00 173.10 173.54 2wv5 s GLY 185 N -0.30 -0.48 -1.10 0.20 0.00 -0.50 -4.99 107.32 100.15 2wv5 s GLY 185 Ca -0.04 1.93 -0.22 0.00 0.00 0.00 0.00 44.72 46.39 2wv5 s GLY 185 CO 0.01 1.94 0.72 -2.01 0.00 0.00 0.00 173.10 173.75 2wv5 n ASN 186 N 4.00 -4.92 0.00 1.64 5.15 -1.26 -2.11 115.26 117.76 2wv5 n ASN 186 Ca -0.20 -1.08 0.00 0.00 -0.60 0.00 0.00 54.58 52.70 2wv5 n ASN 186 Cb 0.57 -2.53 0.00 0.00 -0.53 0.00 0.00 39.78 37.29 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 -1.85 2.27 2.97 8.20 0.00 -1.26 -5.01 105.19 110.50 2wv5 n GLY 187 Ca -0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 2wv5 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wv5 s VAL 188 N -2.43 1.26 0.19 1.61 0.11 -0.90 -2.45 120.40 117.80 2wv5 s VAL 188 Ca 0.00 -0.45 -0.01 0.00 -2.93 0.00 0.00 61.98 58.59 2wv5 s VAL 188 Cb 0.00 -1.22 -0.04 0.00 -1.53 0.00 0.00 36.38 33.59 2wv5 s VAL 188 CO 0.00 0.40 0.38 -0.83 -3.33 0.00 0.00 175.10 171.73 2wv5 s GLY 189 N 1.50 1.87 -0.05 6.54 0.00 0.20 -1.41 107.32 115.97 2wv5 s GLY 189 Ca 0.03 -0.79 0.02 0.00 0.00 0.00 0.00 44.72 43.97 2wv5 s GLY 189 CO -0.08 -0.74 -0.08 -0.19 0.00 0.00 0.00 173.10 172.02 2wv5 s TYR 190 N -1.83 1.04 0.03 1.90 1.51 0.16 -1.39 117.35 118.78 2wv5 s TYR 190 Ca 0.39 -0.34 0.07 0.00 -1.01 0.00 0.00 57.07 56.18 2wv5 s TYR 190 Cb -0.11 -0.82 -0.03 0.00 -0.11 0.00 0.00 41.96 40.88 2wv5 s TYR 190 CO 0.28 -0.22 -0.20 0.00 -1.11 0.00 0.00 175.55 174.31 2wv5 s SER 192 N -1.32 6.63 0.16 0.00 0.01 0.71 -1.11 113.70 118.78 2wv5 s SER 192 Ca 0.14 0.45 -0.31 0.00 1.31 0.00 0.00 55.95 57.54 2wv5 s SER 192 Cb -0.10 -2.48 -0.09 0.00 0.21 0.00 0.00 66.02 63.55 2wv5 s SER 192 CO 0.04 -0.99 1.49 0.00 0.41 0.00 0.00 173.24 174.19 2wv5 s VAL 194 N 0.94 2.27 0.27 0.00 1.01 -1.13 -4.94 120.40 118.82 2wv5 s VAL 194 Ca 0.67 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.43 2wv5 s VAL 194 Cb -0.41 -1.91 -0.09 0.00 0.00 0.00 0.00 36.38 33.96 2wv5 s VAL 194 CO 0.33 0.54 1.08 -0.55 0.00 0.00 0.00 175.10 176.50 2wv5 s SER 195 N 0.64 7.32 0.14 3.32 0.15 -1.26 -4.58 113.70 119.43 2wv5 s SER 195 Ca -0.10 2.22 -0.15 0.00 0.70 0.00 0.00 55.95 58.61 2wv5 s SER 195 Cb -0.16 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.53 2wv5 s SER 195 CO 0.02 -0.11 1.71 -0.09 1.20 0.00 0.00 173.24 175.98 2wv5 h ARG 196 N 3.95 0.62 -0.34 5.44 1.12 -0.24 -2.02 114.38 122.90 2wv5 h ARG 196 Ca -0.46 -0.10 0.06 0.00 -1.11 0.00 0.00 59.98 58.37 2wv5 h ARG 196 Cb 1.21 -0.11 -0.05 0.00 -0.01 0.00 0.00 29.97 31.01 2wv5 h ARG 196 CO 0.67 0.54 0.00 0.77 -3.11 0.00 0.00 179.97 178.85 2wv5 h SER 197 N 0.55 -0.13 -0.95 -3.80 0.02 -1.93 -0.60 113.55 106.70 2wv5 h SER 197 Ca 0.15 0.08 0.21 0.00 -0.84 0.00 0.00 61.79 61.38 2wv5 h SER 197 Cb 0.13 0.14 -0.08 0.00 0.14 0.00 0.00 62.40 62.73 2wv5 h SER 197 CO -0.02 -0.03 0.62 0.24 -1.14 0.00 0.00 176.83 176.50 2wv5 h MET 198 N 0.10 0.49 -0.04 3.45 2.86 -1.84 -1.28 114.93 118.67 2wv5 h MET 198 Ca 0.17 -0.03 -0.13 0.00 -2.06 0.00 0.00 59.70 57.65 2wv5 h MET 198 Cb 0.22 -0.11 0.01 0.00 0.06 0.00 0.00 31.60 31.78 2wv5 h MET 198 CO -0.27 0.33 -0.48 -0.07 1.06 0.00 0.00 176.91 177.47 2wv5 h LEU 199 N 0.51 0.48 -0.07 1.22 3.38 -0.43 -3.00 115.31 117.40 2wv5 h LEU 199 Ca 0.52 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2wv5 h LEU 199 Cb 1.14 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 2wv5 h LEU 199 CO -0.25 1.13 -0.05 1.56 0.09 0.00 0.00 178.44 180.92 2wv5 h GLN 200 N -0.12 -0.06 -0.83 1.13 1.08 -0.40 0.28 115.11 116.20 2wv5 h GLN 200 Ca -0.05 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2wv5 h GLN 200 Cb 1.17 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.58 2wv5 h GLN 200 CO 0.10 -0.04 0.37 0.87 -0.95 0.00 0.00 178.83 179.18 2wv5 h LYS 201 N -0.06 1.21 -0.23 1.46 6.56 -1.46 0.10 116.57 124.15 2wv5 h LYS 201 Ca 0.05 -0.19 -0.03 0.00 -1.06 0.00 0.00 60.65 59.42 2wv5 h LYS 201 Cb 0.13 -0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 31.57 2wv5 h LYS 201 CO -0.11 0.94 0.02 1.98 -2.06 0.00 0.00 179.45 180.23 2wv5 h MET 202 N 1.19 0.34 0.06 3.15 -1.53 -1.30 0.67 114.93 117.50 2wv5 h MET 202 Ca 0.28 -0.05 -0.27 0.00 -3.44 0.00 0.00 59.70 56.22 2wv5 h MET 202 Cb 0.15 -0.06 0.02 0.00 -0.55 0.00 0.00 31.60 31.16 2wv5 h MET 202 CO -0.03 0.35 -1.12 -0.22 0.14 0.00 0.00 176.91 176.03 2wv5 h LYS 203 N 0.33 0.56 -0.09 0.39 3.64 0.22 -2.40 116.57 119.23 2wv5 h LYS 203 Ca 0.08 -0.69 -0.12 0.00 -1.27 0.00 0.00 60.65 58.65 2wv5 h LYS 203 Cb 0.19 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2wv5 h LYS 203 CO 0.00 1.29 -0.47 0.00 -2.27 0.00 0.00 179.45 178.00 2wv5 h ALA 204 N 0.46 1.03 0.00 5.00 0.00 -0.33 -2.43 119.26 122.99 2wv5 h ALA 204 Ca -0.14 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 2wv5 h ALA 204 Cb 1.78 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 2wv5 h ALA 204 CO 0.21 0.63 -0.19 1.25 0.00 0.00 0.00 179.25 181.16 2wv5 h HIS 205 N 0.19 0.00 0.00 0.00 -0.00 0.44 -3.51 115.15 112.27 2wv5 h HIS 205 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2wv5 h HIS 205 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.31 2wv5 h HIS 205 CO 0.02 0.19 0.00 0.28 -0.00 0.00 0.00 177.93 178.41