#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nv0 s LEU 2 N 0.00 4.25 -0.16 3.17 1.43 -1.26 -4.95 118.68 121.17 2nv0 s LEU 2 Ca 0.00 1.55 -0.00 0.00 -1.03 0.00 0.00 54.13 54.65 2nv0 s LEU 2 Cb 0.00 -3.90 -0.00 0.00 0.03 0.00 0.00 46.19 42.32 2nv0 s LEU 2 CO 0.00 -0.08 -0.14 -0.89 0.23 0.00 0.00 176.35 175.47 2nv0 s THR 3 N -1.70 2.73 -0.16 5.49 2.01 -1.26 -0.91 115.64 121.84 2nv0 s THR 3 Ca 0.49 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 2nv0 s THR 3 Cb -0.15 -2.16 -0.01 0.00 0.01 0.00 0.00 72.50 70.19 2nv0 s THR 3 CO 0.20 0.51 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.91 2nv0 s ILE 4 N 0.83 3.18 0.47 1.82 1.01 -0.09 -0.29 121.20 128.14 2nv0 s ILE 4 Ca -0.05 -0.60 -0.16 0.00 0.00 0.00 0.00 60.65 59.85 2nv0 s ILE 4 Cb -0.15 -2.37 -0.08 0.00 0.01 0.00 0.00 42.46 39.87 2nv0 s ILE 4 CO -0.00 0.50 0.92 -0.83 0.00 0.00 0.00 174.94 175.52 2nv0 s GLY 5 N 0.67 2.11 -0.13 6.18 0.00 0.03 -1.51 107.32 114.66 2nv0 s GLY 5 Ca -0.05 0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.80 2nv0 s GLY 5 CO 0.02 0.38 -0.12 0.14 0.00 0.00 0.00 173.10 173.52 2nv0 s VAL 6 N -2.47 1.35 0.14 1.40 1.01 0.31 -0.14 120.40 122.00 2nv0 s VAL 6 Ca 0.57 -0.51 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 2nv0 s VAL 6 Cb -0.10 -1.29 -0.10 0.00 0.00 0.00 0.00 36.38 34.89 2nv0 s VAL 6 CO 0.28 0.42 1.78 -0.22 0.00 0.00 0.00 175.10 177.36 2nv0 s LEU 7 N 1.45 4.39 -0.17 3.92 2.96 -0.13 -0.61 118.68 130.50 2nv0 s LEU 7 Ca 0.02 2.75 0.17 0.00 -0.22 0.00 0.00 54.13 56.85 2nv0 s LEU 7 Cb -0.13 -3.57 0.38 0.00 0.50 0.00 0.00 46.19 43.37 2nv0 s LEU 7 CO -0.08 -0.98 1.25 0.61 -1.32 0.00 0.00 176.35 175.83 2nv0 n GLY 8 N 4.14 4.73 0.21 7.98 0.00 0.20 -4.59 105.19 117.86 2nv0 n GLY 8 Ca 0.17 -1.15 -0.07 0.00 0.00 0.00 0.00 46.02 44.98 2nv0 n GLY 8 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nv0 h LEU 9 N 0.64 0.49 -7.32 0.99 3.38 -1.90 -3.46 115.31 108.13 2nv0 h LEU 9 Ca 0.02 -0.24 -0.13 0.00 0.09 0.00 0.00 57.88 57.62 2nv0 h LEU 9 Cb 1.16 -0.14 -0.25 0.00 0.09 0.00 0.00 40.66 41.52 2nv0 h LEU 9 CO 0.08 0.89 -0.29 -1.58 0.09 0.00 0.00 178.44 177.64 2nv0 s GLN 10 N -4.07 0.42 0.11 1.13 -0.44 -1.26 -5.07 119.66 110.48 2nv0 s GLN 10 Ca -0.06 0.59 0.00 0.00 -2.50 0.00 0.00 55.36 53.38 2nv0 s GLN 10 Cb 0.12 0.14 0.00 0.00 -1.64 0.00 0.00 33.01 31.63 2nv0 s GLN 10 CO 0.81 -0.08 0.00 0.41 0.50 0.00 0.00 175.29 176.93 2nv0 n GLY 11 N 3.26 -3.05 3.75 2.59 0.00 -1.26 -4.08 105.19 106.40 2nv0 n GLY 11 Ca -0.16 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.62 2nv0 n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nv0 s ALA 12 N -1.14 3.34 0.00 4.61 0.00 -1.26 -4.95 121.76 122.36 2nv0 s ALA 12 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 2nv0 s ALA 12 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.88 2nv0 s ALA 12 CO 0.00 0.11 0.00 1.33 0.00 0.00 0.00 175.76 177.20 2nv0 n VAL 13 N 1.61 0.00 -0.32 0.00 0.24 -1.26 -4.60 118.33 114.01 2nv0 n VAL 13 Ca -0.01 -0.02 -0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2nv0 n VAL 13 Cb 0.47 0.42 0.13 0.00 -1.47 0.00 0.00 33.84 33.39 2nv0 n VAL 13 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 2nv0 h ARG 14 N 0.00 1.01 -0.20 7.34 0.11 -2.00 -1.60 114.38 119.04 2nv0 h ARG 14 Ca 0.00 -0.06 -0.16 0.00 0.10 0.00 0.00 59.98 59.86 2nv0 h ARG 14 Cb 0.00 -0.23 -0.01 0.00 1.11 0.00 0.00 29.97 30.85 2nv0 h ARG 14 CO 0.00 0.67 -0.53 0.93 0.10 0.00 0.00 179.97 181.14 2nv0 h GLU 15 N 1.04 0.58 -0.51 0.08 3.07 -1.90 -1.21 114.58 115.73 2nv0 h GLU 15 Ca 0.36 -0.36 -0.04 0.00 -0.50 0.00 0.00 59.36 58.83 2nv0 h GLU 15 Cb 0.09 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.02 2nv0 h GLU 15 CO -0.15 0.96 0.15 0.45 -1.40 0.00 0.00 179.01 179.03 2nv0 h HIS 16 N 0.45 0.82 -0.38 4.33 3.86 -1.74 -0.42 115.15 122.06 2nv0 h HIS 16 Ca 0.01 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 2nv0 h HIS 16 Cb 1.07 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 2nv0 h HIS 16 CO 0.05 0.71 0.20 0.82 0.86 0.00 0.00 177.93 180.56 2nv0 h ILE 17 N 0.69 1.16 -0.58 2.45 1.08 -1.20 -0.20 117.51 120.90 2nv0 h ILE 17 Ca 0.16 -0.42 0.07 0.00 -0.39 0.00 0.00 64.86 64.29 2nv0 h ILE 17 Cb 0.28 0.74 -0.06 0.00 -3.07 0.00 0.00 36.82 34.71 2nv0 h ILE 17 CO -0.00 0.16 0.25 -0.74 -0.69 0.00 0.00 178.15 177.13 2nv0 h HIS 18 N 0.48 0.45 -0.41 1.37 2.76 -1.02 0.13 115.15 118.91 2nv0 h HIS 18 Ca 0.13 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.29 2nv0 h HIS 18 Cb 0.08 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 28.91 2nv0 h HIS 18 CO -0.02 0.17 0.11 0.00 -1.30 0.00 0.00 177.93 176.88 2nv0 h ALA 19 N 1.36 0.54 -0.22 5.26 0.00 -0.60 0.15 119.26 125.76 2nv0 h ALA 19 Ca 0.28 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.05 2nv0 h ALA 19 Cb 0.28 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 2nv0 h ALA 19 CO -0.24 0.21 -0.08 0.82 0.00 0.00 0.00 179.25 179.96 2nv0 h ILE 20 N 0.52 0.73 -0.86 0.00 2.04 -0.68 -2.06 117.51 117.21 2nv0 h ILE 20 Ca 0.13 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.99 2nv0 h ILE 20 Cb 0.30 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 2nv0 h ILE 20 CO -0.00 0.00 0.53 -0.33 0.00 0.00 0.00 178.15 178.35 2nv0 h GLU 21 N -0.04 1.16 0.00 2.37 5.08 -0.36 -1.89 114.58 120.91 2nv0 h GLU 21 Ca 0.11 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2nv0 h GLU 21 Cb 0.20 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 2nv0 h GLU 21 CO -0.25 0.80 -0.06 0.00 -1.00 0.00 0.00 179.01 178.50 2nv0 h ALA 22 N 1.40 1.47 -0.33 3.43 0.00 -0.17 -0.98 119.26 124.08 2nv0 h ALA 22 Ca 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2nv0 h ALA 22 Cb -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2nv0 h ALA 22 CO -0.06 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.27 2nv0 n GLY 24 N 1.21 0.57 3.86 0.00 0.00 -0.37 -5.05 105.19 105.40 2nv0 n GLY 24 Ca 0.16 -0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 2nv0 n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nv0 s ALA 25 N -2.00 3.85 0.03 4.61 0.00 -1.09 -4.77 121.76 122.40 2nv0 s ALA 25 Ca 0.00 -1.64 -0.19 0.00 0.00 0.00 0.00 51.96 50.13 2nv0 s ALA 25 Cb 0.00 -1.20 -0.06 0.00 0.00 0.00 0.00 23.12 21.86 2nv0 s ALA 25 CO 0.00 0.01 0.56 0.00 0.00 0.00 0.00 175.76 176.33 2nv0 s ALA 26 N -2.29 3.55 -0.11 0.00 0.00 -0.09 -3.70 121.76 119.13 2nv0 s ALA 26 Ca 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 51.96 52.33 2nv0 s ALA 26 Cb -0.06 -2.66 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 2nv0 s ALA 26 CO 0.27 0.30 0.05 0.20 0.00 0.00 0.00 175.76 176.58 2nv0 s GLY 27 N -0.68 1.95 -0.08 0.00 0.00 -1.26 -0.91 107.32 106.34 2nv0 s GLY 27 Ca 0.29 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 44.27 2nv0 s GLY 27 CO 0.17 -0.44 -0.10 -2.27 0.00 0.00 0.00 173.10 170.46 2nv0 s LEU 28 N -0.79 1.46 -0.44 0.66 2.96 -0.57 -4.94 118.68 117.02 2nv0 s LEU 28 Ca 0.12 -0.29 -0.29 0.00 -0.22 0.00 0.00 54.13 53.46 2nv0 s LEU 28 Cb -0.12 -0.80 0.02 0.00 0.50 0.00 0.00 46.19 45.79 2nv0 s LEU 28 CO 0.03 -0.03 1.20 -0.69 -1.32 0.00 0.00 176.35 175.54 2nv0 s VAL 29 N 1.06 4.16 -0.50 1.68 1.01 -1.26 -0.53 120.40 126.01 2nv0 s VAL 29 Ca -0.07 1.20 -0.26 0.00 0.00 0.00 0.00 61.98 62.85 2nv0 s VAL 29 Cb -0.15 -4.48 0.03 0.00 0.00 0.00 0.00 36.38 31.79 2nv0 s VAL 29 CO -0.01 -0.89 0.97 -0.69 0.00 0.00 0.00 175.10 174.48 2nv0 s VAL 30 N 4.61 4.39 -0.09 2.92 1.01 0.22 -4.84 120.40 128.62 2nv0 s VAL 30 Ca 0.51 0.65 0.12 0.00 0.00 0.00 0.00 61.98 63.26 2nv0 s VAL 30 Cb -0.09 -4.50 -0.18 0.00 0.00 0.00 0.00 36.38 31.61 2nv0 s VAL 30 CO 0.30 -0.97 0.29 0.29 0.00 0.00 0.00 175.10 175.01 2nv0 n LYS 31 N 7.41 0.75 -4.21 2.72 5.02 -1.26 -0.63 118.16 127.96 2nv0 n LYS 31 Ca 0.05 -0.09 -0.17 0.00 -2.02 0.00 0.00 58.31 56.09 2nv0 n LYS 31 Cb 0.48 -1.25 -0.13 0.00 -0.02 0.00 0.00 35.03 34.11 2nv0 n LYS 31 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2nv0 s ARG 32 N -2.72 0.64 0.32 1.97 0.52 -1.26 -4.93 118.95 113.49 2nv0 s ARG 32 Ca -0.03 -0.55 0.05 0.00 -0.52 0.00 0.00 55.73 54.68 2nv0 s ARG 32 Cb 0.08 -0.57 0.69 0.00 0.52 0.00 0.00 34.95 35.67 2nv0 s ARG 32 CO 0.49 0.14 1.86 -1.35 0.02 0.00 0.00 175.30 176.45 2nv0 h PRO 33 N 5.21 0.82 -0.16 3.54 0.11 -1.90 -1.19 132.00 138.43 2nv0 h PRO 33 Ca -0.34 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 65.77 2nv0 h PRO 33 Cb 1.19 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2nv0 h PRO 33 CO 0.45 0.54 0.15 1.49 -0.21 0.00 0.00 178.00 180.42 2nv0 h GLU 34 N 0.84 0.00 0.00 1.05 4.57 -1.98 -1.31 114.58 117.75 2nv0 h GLU 34 Ca 0.47 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.65 2nv0 h GLU 34 Cb 0.59 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2nv0 h GLU 34 CO -0.23 0.00 0.00 1.96 -1.18 0.00 0.00 179.01 179.56 2nv0 h GLN 35 N 0.00 0.00 -0.17 1.92 4.20 -1.64 -2.19 115.11 117.23 2nv0 h GLN 35 Ca 0.07 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 2nv0 h GLN 35 Cb 0.37 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2nv0 h GLN 35 CO -0.00 0.00 0.09 -0.07 -0.67 0.00 0.00 178.83 178.18 2nv0 h LEU 36 N 0.00 0.20 -1.24 1.46 3.38 -1.38 0.54 115.31 118.27 2nv0 h LEU 36 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nv0 h LEU 36 Cb 0.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2nv0 h LEU 36 CO 0.00 0.17 0.00 0.78 0.09 0.00 0.00 178.44 179.48 2nv0 h ASN 37 N 0.23 0.00 -0.07 -0.43 -0.26 -1.58 -2.93 115.58 110.54 2nv0 h ASN 37 Ca 0.06 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.80 2nv0 h ASN 37 Cb 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 2nv0 h ASN 37 CO -0.01 0.00 0.00 -0.62 -1.06 0.00 0.00 177.43 175.74 2nv0 n GLU 38 N -2.37 1.94 -4.31 0.81 1.02 0.18 -4.95 120.64 112.96 2nv0 n GLU 38 Ca 0.00 -1.37 -0.18 0.00 -0.02 0.00 0.00 57.16 55.59 2nv0 n GLU 38 Cb 0.14 -1.47 -0.10 0.00 -0.02 0.00 0.00 31.44 29.99 2nv0 n GLU 38 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2nv0 s VAL 39 N -1.93 1.58 -0.12 2.62 -7.23 -1.11 -4.87 120.40 109.34 2nv0 s VAL 39 Ca 0.34 -2.02 0.22 0.00 -1.81 0.00 0.00 61.98 58.71 2nv0 s VAL 39 Cb 0.20 -1.86 -0.19 0.00 0.56 0.00 0.00 36.38 35.10 2nv0 s VAL 39 CO 0.31 -0.52 0.71 0.47 -0.31 0.00 0.00 175.10 175.77 2nv0 n ASP 40 N -0.01 0.38 -3.84 4.85 8.00 0.61 -4.98 116.55 121.55 2nv0 n ASP 40 Ca -0.11 0.15 -0.09 0.00 0.71 0.00 0.00 54.79 55.45 2nv0 n ASP 40 Cb 0.59 1.26 -0.04 0.00 -0.02 0.00 0.00 41.12 42.91 2nv0 n ASP 40 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2nv0 s GLY 41 N -4.50 0.10 -0.02 0.44 0.00 -1.22 -3.82 107.32 98.29 2nv0 s GLY 41 Ca -0.05 -0.44 0.00 0.00 0.00 0.00 0.00 44.72 44.24 2nv0 s GLY 41 CO 0.85 -0.33 0.01 -2.27 0.00 0.00 0.00 173.10 171.36 2nv0 s LEU 42 N -2.93 1.29 -0.14 0.66 2.96 -0.52 -0.79 118.68 119.21 2nv0 s LEU 42 Ca 0.14 0.00 -0.16 0.00 -0.22 0.00 0.00 54.13 53.89 2nv0 s LEU 42 Cb -0.02 -0.13 -0.04 0.00 0.50 0.00 0.00 46.19 46.50 2nv0 s LEU 42 CO 0.03 -0.09 0.38 -0.63 -1.32 0.00 0.00 176.35 174.72 2nv0 s ILE 43 N 0.84 5.24 -0.42 6.68 1.01 0.80 -0.74 121.20 134.61 2nv0 s ILE 43 Ca -0.08 0.75 -0.07 0.00 0.00 0.00 0.00 60.65 61.25 2nv0 s ILE 43 Cb -0.11 -3.72 0.10 0.00 0.01 0.00 0.00 42.46 38.74 2nv0 s ILE 43 CO -0.02 0.36 0.25 -0.76 0.00 0.00 0.00 174.94 174.77 2nv0 s LEU 44 N 0.50 5.25 0.00 2.97 1.02 0.66 -0.96 118.68 128.13 2nv0 s LEU 44 Ca 0.21 -1.78 0.00 0.00 0.02 0.00 0.00 54.13 52.58 2nv0 s LEU 44 Cb -0.14 -1.92 0.00 0.00 0.02 0.00 0.00 46.19 44.15 2nv0 s LEU 44 CO 0.07 -0.57 0.00 -0.81 0.02 0.00 0.00 176.35 175.07 2nv0 n PRO 45 N 4.79 0.00 0.00 1.29 -0.04 -1.26 -1.70 135.00 138.08 2nv0 n PRO 45 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 2nv0 n PRO 45 Cb 0.42 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.88 2nv0 n PRO 45 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nv0 n GLY 46 N 5.00 -0.61 0.01 0.55 0.00 -1.26 -1.88 105.19 107.00 2nv0 n GLY 46 Ca 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.35 2nv0 n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nv0 n GLY 47 N -0.49 -0.24 2.76 -0.02 0.00 -1.26 -3.57 105.19 102.36 2nv0 n GLY 47 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2nv0 n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nv0 s GLU 48 N -2.24 1.14 0.29 1.61 2.56 -1.26 -4.75 118.70 116.05 2nv0 s GLU 48 Ca -0.02 -1.70 -0.01 0.00 0.00 0.00 0.00 54.97 53.24 2nv0 s GLU 48 Cb 0.02 -2.34 0.48 0.00 2.00 0.00 0.00 34.13 34.29 2nv0 s GLU 48 CO 0.21 -1.08 1.91 0.66 -0.56 0.00 0.00 175.26 176.40 2nv0 h SER 49 N 7.27 0.96 0.07 -1.70 4.64 -1.92 0.29 113.55 123.14 2nv0 h SER 49 Ca -0.06 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2nv0 h SER 49 Cb 0.96 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2nv0 h SER 49 CO 0.49 0.63 -0.03 0.74 -0.87 0.00 0.00 176.83 177.79 2nv0 h THR 50 N 1.10 1.04 -0.53 2.95 2.02 -1.97 0.48 112.91 118.00 2nv0 h THR 50 Ca 0.39 -0.36 0.09 0.00 0.77 0.00 0.00 66.41 67.29 2nv0 h THR 50 Cb 0.13 1.28 -0.07 0.00 -1.74 0.00 0.00 68.15 67.74 2nv0 h THR 50 CO -0.14 0.09 0.15 0.74 0.37 0.00 0.00 175.52 176.74 2nv0 h THR 51 N -0.26 0.75 -0.55 3.16 2.02 -1.89 -1.41 112.91 114.73 2nv0 h THR 51 Ca -0.01 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 2nv0 h THR 51 Cb 0.22 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 2nv0 h THR 51 CO 0.02 0.06 0.25 -0.03 0.37 0.00 0.00 175.52 176.18 2nv0 h MET 52 N 0.31 0.81 -0.50 6.66 -1.53 0.35 -1.89 114.93 119.15 2nv0 h MET 52 Ca 0.27 -0.13 -0.05 0.00 -3.44 0.00 0.00 59.70 56.35 2nv0 h MET 52 Cb 0.34 -0.14 -0.02 0.00 -0.55 0.00 0.00 31.60 31.23 2nv0 h MET 52 CO -0.31 0.68 0.13 -0.09 0.14 0.00 0.00 176.91 177.46 2nv0 h ARG 53 N 0.75 0.79 -0.65 0.39 9.65 0.22 0.55 114.38 126.08 2nv0 h ARG 53 Ca 0.19 -0.19 0.05 0.00 -1.10 0.00 0.00 59.98 58.93 2nv0 h ARG 53 Cb 0.15 -0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 2nv0 h ARG 53 CO -0.02 0.76 0.37 0.00 2.80 0.00 0.00 179.97 183.88 2nv0 h ARG 54 N 0.68 0.69 -0.41 0.20 2.47 -0.95 -0.84 114.38 116.22 2nv0 h ARG 54 Ca 0.16 -0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.77 2nv0 h ARG 54 Cb 0.32 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.47 2nv0 h ARG 54 CO 0.00 0.45 -0.00 -0.07 0.56 0.00 0.00 179.97 180.91 2nv0 h LEU 55 N 0.71 0.71 -1.09 3.04 3.38 -1.04 -0.26 115.31 120.76 2nv0 h LEU 55 Ca 0.28 -0.31 0.20 0.00 0.09 0.00 0.00 57.88 58.14 2nv0 h LEU 55 Cb 0.12 -0.19 -0.10 0.00 0.09 0.00 0.00 40.66 40.57 2nv0 h LEU 55 CO -0.15 0.84 0.61 0.40 0.09 0.00 0.00 178.44 180.24 2nv0 h ILE 56 N 0.55 0.67 0.15 1.22 2.04 -0.38 0.24 117.51 122.00 2nv0 h ILE 56 Ca 0.12 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 2nv0 h ILE 56 Cb 0.48 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 2nv0 h ILE 56 CO 0.02 0.12 -0.07 0.44 0.00 0.00 0.00 178.15 178.66 2nv0 h ASP 57 N 0.68 -0.17 -0.55 1.72 3.32 -0.73 0.13 116.42 120.81 2nv0 h ASP 57 Ca 0.58 -0.37 0.11 0.00 0.02 0.00 0.00 57.03 57.37 2nv0 h ASP 57 Cb 1.01 0.04 -0.10 0.00 0.22 0.00 0.00 39.33 40.51 2nv0 h ASP 57 CO -0.37 0.35 -0.07 0.74 -1.72 0.00 0.00 179.24 178.18 2nv0 h THR 58 N -0.78 0.50 -0.34 0.35 2.02 -0.58 0.20 112.91 114.27 2nv0 h THR 58 Ca -0.02 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.14 2nv0 h THR 58 Cb 0.53 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 2nv0 h THR 58 CO 0.03 0.01 0.00 -1.22 0.37 0.00 0.00 175.52 174.71 2nv0 n TYR 59 N -5.32 0.55 -3.75 3.16 4.01 0.79 -4.94 117.16 111.66 2nv0 n TYR 59 Ca 0.07 -0.25 -0.24 0.00 -0.16 0.00 0.00 57.90 57.32 2nv0 n TYR 59 Cb 0.30 -0.05 0.02 0.00 -0.31 0.00 0.00 39.34 39.31 2nv0 n TYR 59 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2nv0 n GLN 60 N 0.49 -3.86 0.01 -0.72 1.13 0.06 -4.67 117.38 109.82 2nv0 n GLN 60 Ca 0.12 0.54 0.11 0.00 -1.94 0.00 0.00 57.00 55.84 2nv0 n GLN 60 Cb 0.36 -4.87 0.11 0.00 0.11 0.00 0.00 30.24 25.94 2nv0 n GLN 60 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2nv0 n PHE 61 N -4.26 0.14 0.04 1.08 3.72 0.41 -4.55 117.46 114.03 2nv0 n PHE 61 Ca -0.27 0.04 -0.13 0.00 -0.05 0.00 0.00 57.45 57.04 2nv0 n PHE 61 Cb 0.67 -0.31 -0.09 0.00 -0.94 0.00 0.00 39.48 38.82 2nv0 n PHE 61 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 2nv0 h MET 62 N 0.00 -0.08 -0.30 -1.08 2.86 -1.93 -0.67 114.93 113.74 2nv0 h MET 62 Ca 0.00 0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.47 2nv0 h MET 62 Cb 0.60 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.27 2nv0 h MET 62 CO 0.00 0.23 -0.49 1.49 1.06 0.00 0.00 176.91 179.20 2nv0 h GLU 63 N -0.39 0.83 -0.95 1.72 4.22 -1.96 -1.56 114.58 116.49 2nv0 h GLU 63 Ca -0.01 -0.49 0.11 0.00 0.08 0.00 0.00 59.36 59.05 2nv0 h GLU 63 Cb 0.35 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.56 2nv0 h GLU 63 CO 0.01 1.13 0.61 -1.35 -2.18 0.00 0.00 179.01 177.23 2nv0 h PRO 64 N 0.65 0.90 -0.57 0.92 0.11 -1.78 -0.42 132.00 131.81 2nv0 h PRO 64 Ca 0.03 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 2nv0 h PRO 64 Cb 1.08 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 2nv0 h PRO 64 CO 0.11 0.59 -0.07 -0.07 -0.21 0.00 0.00 178.00 178.36 2nv0 h LEU 65 N 0.93 1.04 -0.73 2.35 3.38 -0.78 -0.09 115.31 121.41 2nv0 h LEU 65 Ca 0.46 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2nv0 h LEU 65 Cb 0.48 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2nv0 h LEU 65 CO -0.22 1.12 0.38 0.03 0.09 0.00 0.00 178.44 179.84 2nv0 h ARG 66 N 0.94 1.02 -0.62 1.13 3.08 -0.77 -1.95 114.38 117.22 2nv0 h ARG 66 Ca 0.15 -0.13 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 2nv0 h ARG 66 Cb 0.63 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 2nv0 h ARG 66 CO 0.04 0.78 0.09 1.49 -1.07 0.00 0.00 179.97 181.30 2nv0 h GLU 67 N 1.01 1.04 -0.53 0.04 4.81 -0.85 -1.53 114.58 118.56 2nv0 h GLU 67 Ca 0.25 -0.28 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 2nv0 h GLU 67 Cb 0.07 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 2nv0 h GLU 67 CO -0.04 0.97 0.20 0.35 -0.73 0.00 0.00 179.01 179.76 2nv0 h PHE 68 N 0.94 0.35 -0.45 0.92 3.57 -0.88 -1.80 116.94 119.60 2nv0 h PHE 68 Ca 0.19 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 2nv0 h PHE 68 Cb 0.44 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2nv0 h PHE 68 CO 0.03 0.11 0.20 0.00 -2.23 0.00 0.00 178.31 176.43 2nv0 h ALA 69 N 1.35 0.58 0.00 2.41 0.00 -1.17 -2.49 119.26 119.94 2nv0 h ALA 69 Ca 0.26 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2nv0 h ALA 69 Cb 0.28 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2nv0 h ALA 69 CO -0.26 0.16 -0.08 0.00 0.00 0.00 0.00 179.25 179.08 2nv0 h ALA 70 N 1.05 1.78 0.00 0.00 0.00 -0.81 0.14 119.26 121.42 2nv0 h ALA 70 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2nv0 h ALA 70 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2nv0 h ALA 70 CO -0.02 0.09 0.00 1.04 0.00 0.00 0.00 179.25 180.37 2nv0 n GLN 71 N -4.31 0.25 -0.66 0.00 6.02 -0.72 -4.91 117.38 113.06 2nv0 n GLN 71 Ca -0.03 0.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 2nv0 n GLN 71 Cb 0.16 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.92 2nv0 n GLN 71 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nv0 n GLY 72 N 0.20 0.78 3.71 1.08 0.00 0.48 -5.03 105.19 106.41 2nv0 n GLY 72 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2nv0 n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nv0 s LYS 73 N -0.34 4.38 0.56 1.61 1.02 -1.18 -4.89 119.74 120.90 2nv0 s LYS 73 Ca 0.00 1.88 -0.21 0.00 0.02 0.00 0.00 55.97 57.66 2nv0 s LYS 73 Cb 0.00 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 2nv0 s LYS 73 CO 0.00 -0.36 1.36 -2.14 -0.92 0.00 0.00 175.35 173.29 2nv0 s PRO 74 N 1.28 3.03 -0.02 -1.68 0.02 -1.25 -4.62 135.00 131.76 2nv0 s PRO 74 Ca 0.61 2.23 0.01 0.00 0.02 0.00 0.00 61.00 63.87 2nv0 s PRO 74 Cb -0.32 -2.19 0.01 0.00 0.02 0.00 0.00 34.50 32.02 2nv0 s PRO 74 CO 0.29 -1.27 -0.03 -1.64 -0.33 0.00 0.00 177.00 174.01 2nv0 s MET 75 N -2.98 0.46 -0.24 5.54 -1.94 -0.57 -1.43 119.30 118.13 2nv0 s MET 75 Ca 0.73 -0.09 0.01 0.00 -1.71 0.00 0.00 55.69 54.64 2nv0 s MET 75 Cb -0.41 -0.51 0.06 0.00 2.01 0.00 0.00 34.83 35.99 2nv0 s MET 75 CO 0.47 -0.01 -0.05 0.12 -0.01 0.00 0.00 175.02 175.54 2nv0 s PHE 76 N 0.43 2.54 -0.28 -0.03 5.36 0.09 -1.18 117.98 124.92 2nv0 s PHE 76 Ca -0.05 -1.87 -0.15 0.00 -0.96 0.00 0.00 56.93 53.90 2nv0 s PHE 76 Cb -0.08 -1.67 -0.03 0.00 -0.34 0.00 0.00 43.02 40.90 2nv0 s PHE 76 CO -0.01 -0.80 0.38 0.20 -1.46 0.00 0.00 175.22 173.54 2nv0 s GLY 77 N 1.34 1.88 -0.02 13.12 0.00 -0.50 -0.25 107.32 122.89 2nv0 s GLY 77 Ca -0.05 -0.85 0.07 0.00 0.00 0.00 0.00 44.72 43.89 2nv0 s GLY 77 CO -0.06 0.99 -0.23 -1.08 0.00 0.00 0.00 173.10 172.72 2nv0 s THR 78 N 2.08 2.33 0.00 0.90 -1.32 -0.69 -1.74 115.64 117.20 2nv0 s THR 78 Ca 0.15 -1.03 0.00 0.00 -1.21 0.00 0.00 61.69 59.60 2nv0 s THR 78 Cb -0.16 -1.84 0.00 0.00 -1.51 0.00 0.00 72.50 68.99 2nv0 s THR 78 CO 0.10 0.57 0.00 0.00 -2.21 0.00 0.00 174.62 173.08 2nv0 h ALA 80 N -0.66 1.88 0.00 0.00 0.00 -1.74 -1.68 119.26 117.05 2nv0 h ALA 80 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2nv0 h ALA 80 Cb 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2nv0 h ALA 80 CO 0.00 -0.04 -0.05 0.78 0.00 0.00 0.00 179.25 179.94 2nv0 h GLY 81 N 0.60 0.00 1.00 0.00 0.00 -0.16 -0.71 103.07 103.81 2nv0 h GLY 81 Ca 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.66 2nv0 h GLY 81 CO -0.12 0.00 0.42 -2.00 0.00 0.00 0.00 176.54 174.84 2nv0 h LEU 82 N 0.00 0.86 -0.42 3.11 5.85 -1.37 -1.03 115.31 122.32 2nv0 h LEU 82 Ca -0.00 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.66 2nv0 h LEU 82 Cb 0.38 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2nv0 h LEU 82 CO 0.01 0.68 0.25 0.40 -0.34 0.00 0.00 178.44 179.44 2nv0 h ILE 83 N 0.97 1.06 -0.77 4.05 2.04 -1.24 -1.85 117.51 121.77 2nv0 h ILE 83 Ca 0.25 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 2nv0 h ILE 83 Cb -0.01 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 2nv0 h ILE 83 CO -0.05 0.09 0.38 0.40 0.00 0.00 0.00 178.15 178.98 2nv0 h ILE 84 N 0.51 1.24 0.00 -0.67 1.08 -1.24 -3.11 117.51 115.31 2nv0 h ILE 84 Ca 0.16 -0.65 -0.13 0.00 -0.39 0.00 0.00 64.86 63.85 2nv0 h ILE 84 Cb -0.01 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 33.96 2nv0 h ILE 84 CO -0.07 0.28 -0.64 0.25 -0.69 0.00 0.00 178.15 177.28 2nv0 h LEU 85 N 1.09 0.00 0.00 1.44 5.85 -0.90 0.12 115.31 122.91 2nv0 h LEU 85 Ca 0.27 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.99 2nv0 h LEU 85 Cb 0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2nv0 h LEU 85 CO -0.04 0.64 0.00 0.00 -0.34 0.00 0.00 178.44 178.70 2nv0 n ALA 86 N -2.30 0.00 -2.62 1.25 0.00 -0.72 -0.95 120.51 115.17 2nv0 n ALA 86 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 2nv0 n ALA 86 Cb 0.73 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.11 2nv0 n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2nv0 s LYS 87 N 2.50 2.27 0.38 0.00 1.02 -0.14 -1.54 119.74 124.22 2nv0 s LYS 87 Ca 0.00 -1.46 0.08 0.00 0.02 0.00 0.00 55.97 54.60 2nv0 s LYS 87 Cb 0.00 -2.14 -0.07 0.00 -0.52 0.00 0.00 37.83 35.10 2nv0 s LYS 87 CO 0.00 0.32 -0.03 -1.21 -0.92 0.00 0.00 175.35 173.51 2nv0 s GLU 88 N -3.69 1.87 0.32 1.68 2.02 -1.26 -1.01 118.70 118.63 2nv0 s GLU 88 Ca 0.32 -2.02 -0.29 0.00 0.02 0.00 0.00 54.97 53.00 2nv0 s GLU 88 Cb -0.06 -1.59 -0.11 0.00 0.10 0.00 0.00 34.13 32.48 2nv0 s GLU 88 CO 0.20 0.01 1.44 0.96 0.02 0.00 0.00 175.26 177.89 2nv0 s ILE 89 N -2.73 2.37 0.00 -1.63 -4.36 -1.26 -4.86 121.20 108.74 2nv0 s ILE 89 Ca 0.34 0.35 0.00 0.00 -0.26 0.00 0.00 60.65 61.08 2nv0 s ILE 89 Cb 0.07 -3.22 0.00 0.00 1.25 0.00 0.00 42.46 40.56 2nv0 s ILE 89 CO 0.17 0.07 0.00 0.00 0.24 0.00 0.00 174.94 175.42 2nv0 n ALA 90 N 1.21 0.00 -2.00 2.27 0.00 -1.26 -5.14 120.51 115.58 2nv0 n ALA 90 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2nv0 n ALA 90 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 2nv0 n ALA 90 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2nv0 n PRO 95 N -0.99 0.00 0.00 0.00 -0.04 -1.26 -5.30 135.00 127.42 2nv0 n PRO 95 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2nv0 n PRO 95 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2nv0 n PRO 95 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2nv0 n HIS 96 N 0.00 -0.98 0.08 0.54 8.25 -1.26 -4.49 115.22 117.35 2nv0 n HIS 96 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 2nv0 n HIS 96 Cb 0.00 0.17 -0.11 0.00 1.12 0.00 0.00 29.99 31.18 2nv0 n HIS 96 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2nv0 h LEU 97 N 0.00 0.15 2.93 2.41 3.38 -0.92 -3.47 115.31 119.80 2nv0 h LEU 97 Ca 0.00 -0.16 -0.39 0.00 0.09 0.00 0.00 57.88 57.42 2nv0 h LEU 97 Cb 0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2nv0 h LEU 97 CO 0.00 1.10 -0.51 0.61 0.09 0.00 0.00 178.44 179.73 2nv0 n GLY 98 N 1.33 -0.49 0.13 0.83 0.00 -0.59 -4.90 105.19 101.50 2nv0 n GLY 98 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.79 2nv0 n GLY 98 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nv0 h LEU 99 N 0.00 0.49 -9.18 0.99 3.38 -1.26 -3.44 115.31 106.28 2nv0 h LEU 99 Ca -0.47 -0.77 -0.59 0.00 0.09 0.00 0.00 57.88 56.14 2nv0 h LEU 99 Cb 1.35 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.84 2nv0 h LEU 99 CO 0.55 1.65 -0.07 -0.22 0.09 0.00 0.00 178.44 180.44 2nv0 s LEU 100 N -7.11 4.19 -1.46 1.67 2.96 -0.57 -4.97 118.68 113.39 2nv0 s LEU 100 Ca -0.14 0.71 -0.08 0.00 -0.22 0.00 0.00 54.13 54.40 2nv0 s LEU 100 Cb 0.06 -2.70 0.03 0.00 0.50 0.00 0.00 46.19 44.08 2nv0 s LEU 100 CO 0.84 -0.12 2.58 -3.20 -1.32 0.00 0.00 176.35 175.13 2nv0 n ASN 101 N 4.44 7.89 -4.07 3.68 5.15 -1.26 -3.85 115.26 127.23 2nv0 n ASN 101 Ca -0.06 -2.88 -0.19 0.00 -0.60 0.00 0.00 54.58 50.86 2nv0 n ASN 101 Cb 0.51 -1.47 -0.14 0.00 -0.53 0.00 0.00 39.78 38.15 2nv0 n ASN 101 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2nv0 s VAL 102 N 0.63 0.85 -0.17 3.44 -7.23 -1.26 -0.26 120.40 116.39 2nv0 s VAL 102 Ca 0.59 -0.70 -0.16 0.00 -1.81 0.00 0.00 61.98 59.90 2nv0 s VAL 102 Cb 0.17 -0.76 -0.04 0.00 0.56 0.00 0.00 36.38 36.31 2nv0 s VAL 102 CO -0.07 0.06 0.41 -0.69 -0.31 0.00 0.00 175.10 174.50 2nv0 s VAL 103 N -0.59 5.20 -0.02 1.32 1.01 -0.39 -0.97 120.40 125.97 2nv0 s VAL 103 Ca 0.01 0.77 0.08 0.00 0.00 0.00 0.00 61.98 62.84 2nv0 s VAL 103 Cb -0.06 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 2nv0 s VAL 103 CO 0.00 0.28 -0.25 -0.69 0.00 0.00 0.00 175.10 174.45 2nv0 s VAL 104 N 1.04 2.14 -0.07 2.92 1.01 -0.18 -0.06 120.40 127.20 2nv0 s VAL 104 Ca 0.21 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 61.11 2nv0 s VAL 104 Cb -0.15 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2nv0 s VAL 104 CO 0.08 0.56 -0.14 -0.70 0.00 0.00 0.00 175.10 174.90 2nv0 s GLU 105 N -0.68 2.71 0.71 2.72 2.12 0.84 -4.33 118.70 122.80 2nv0 s GLU 105 Ca 0.10 -0.70 -0.15 0.00 0.36 0.00 0.00 54.97 54.59 2nv0 s GLU 105 Cb -0.10 -2.43 0.03 0.00 0.26 0.00 0.00 34.13 31.88 2nv0 s GLU 105 CO -0.01 0.52 1.18 -0.98 -0.54 0.00 0.00 175.26 175.44 2nv0 s ARG 106 N -0.47 2.31 0.36 4.30 1.04 -1.26 -0.70 118.95 124.54 2nv0 s ARG 106 Ca 0.06 1.65 -0.26 0.00 -1.04 0.00 0.00 55.73 56.14 2nv0 s ARG 106 Cb -0.12 -1.87 -0.12 0.00 -2.04 0.00 0.00 34.95 30.81 2nv0 s ARG 106 CO 0.02 -1.68 1.05 -1.71 -0.04 0.00 0.00 175.30 172.94 2nv0 n ASN 107 N -2.65 1.51 0.00 -2.89 5.15 -1.26 -4.71 115.26 110.41 2nv0 n ASN 107 Ca 0.13 1.11 0.00 0.00 -0.60 0.00 0.00 54.58 55.21 2nv0 n ASN 107 Cb 0.51 -1.35 0.00 0.00 -0.53 0.00 0.00 39.78 38.40 2nv0 n ASN 107 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2nv0 n SER 108 N 0.79 1.14 -4.81 1.20 3.41 -1.26 -5.07 113.62 109.03 2nv0 n SER 108 Ca 0.09 -1.32 -0.36 0.00 -0.26 0.00 0.00 58.87 57.02 2nv0 n SER 108 Cb 0.36 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.25 2nv0 n SER 108 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2nv0 s PHE 109 N -0.32 3.63 0.97 7.33 0.08 -1.26 -5.04 117.98 123.36 2nv0 s PHE 109 Ca 0.00 1.50 -0.12 0.00 0.12 0.00 0.00 56.93 58.43 2nv0 s PHE 109 Cb 0.00 -2.71 0.17 0.00 -0.57 0.00 0.00 43.02 39.91 2nv0 s PHE 109 CO 0.00 0.26 1.09 0.20 -0.10 0.00 0.00 175.22 176.67 2nv0 s GLY 110 N -1.71 1.60 0.55 4.36 0.00 -1.26 -4.69 107.32 106.17 2nv0 s GLY 110 Ca 0.47 -0.11 0.27 0.00 0.00 0.00 0.00 44.72 45.35 2nv0 s GLY 110 CO 0.21 0.45 2.17 3.21 0.00 0.00 0.00 173.10 179.14 2nv0 h ARG 111 N -1.84 0.00 -0.01 2.90 2.47 -1.98 -1.60 114.38 114.32 2nv0 h ARG 111 Ca -0.52 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.20 2nv0 h ARG 111 Cb 1.30 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.62 2nv0 h ARG 111 CO 0.54 0.05 -0.27 1.04 0.56 0.00 0.00 179.97 181.89 2nv0 n GLN 112 N -3.84 0.67 -0.28 0.04 6.02 -1.26 -4.20 117.38 114.54 2nv0 n GLN 112 Ca -0.03 -0.37 0.03 0.00 -0.01 0.00 0.00 57.00 56.62 2nv0 n GLN 112 Cb 0.15 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 29.96 2nv0 n GLN 112 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2nv0 n VAL 113 N -0.84 0.66 1.13 5.09 0.24 -0.68 -4.86 118.33 119.07 2nv0 n VAL 113 Ca 0.11 -0.78 0.09 0.00 -2.04 0.00 0.00 64.34 61.73 2nv0 n VAL 113 Cb 0.34 0.32 0.32 0.00 -1.47 0.00 0.00 33.84 33.34 2nv0 n VAL 113 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2nv0 n ASP 114 N -0.48 1.73 -4.01 -1.34 5.68 -0.74 -4.84 116.55 112.54 2nv0 n ASP 114 Ca 0.05 -1.79 -0.14 0.00 -0.50 0.00 0.00 54.79 52.41 2nv0 n ASP 114 Cb 0.63 -0.14 -0.13 0.00 -1.14 0.00 0.00 41.12 40.34 2nv0 n ASP 114 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2nv0 s SER 115 N -1.41 0.72 0.13 -1.12 0.01 -1.26 -0.60 113.70 110.17 2nv0 s SER 115 Ca 0.30 -0.31 -0.25 0.00 1.31 0.00 0.00 55.95 57.00 2nv0 s SER 115 Cb 0.16 -0.02 0.07 0.00 0.21 0.00 0.00 66.02 66.44 2nv0 s SER 115 CO 0.24 -0.06 0.79 0.72 0.41 0.00 0.00 173.24 175.34 2nv0 s PHE 116 N -0.71 -0.32 0.15 2.43 -0.12 -0.19 -5.01 117.98 114.20 2nv0 s PHE 116 Ca -0.04 0.06 0.10 0.00 -0.05 0.00 0.00 56.93 57.01 2nv0 s PHE 116 Cb -0.06 0.60 -0.04 0.00 -0.63 0.00 0.00 43.02 42.89 2nv0 s PHE 116 CO 0.00 -0.83 -0.19 -1.21 -0.05 0.00 0.00 175.22 172.94 2nv0 s GLU 117 N -3.49 1.71 -0.13 1.99 2.02 -1.26 -0.69 118.70 118.85 2nv0 s GLU 117 Ca 0.07 -1.31 -0.11 0.00 0.02 0.00 0.00 54.97 53.63 2nv0 s GLU 117 Cb -0.02 -2.02 0.04 0.00 0.10 0.00 0.00 34.13 32.23 2nv0 s GLU 117 CO -0.05 0.45 0.34 0.00 0.02 0.00 0.00 175.26 176.02 2nv0 s ALA 118 N -1.38 -0.84 -0.08 5.21 0.00 -0.47 -4.98 121.76 119.21 2nv0 s ALA 118 Ca 0.19 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 2nv0 s ALA 118 Cb -0.09 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 2nv0 s ALA 118 CO 0.10 -0.17 1.12 -0.51 0.00 0.00 0.00 175.76 176.30 2nv0 s ASP 119 N 0.36 7.13 0.02 0.00 1.11 -1.26 -0.13 116.67 123.90 2nv0 s ASP 119 Ca -0.01 1.68 0.06 0.00 0.18 0.00 0.00 52.55 54.45 2nv0 s ASP 119 Cb -0.03 -2.56 -0.03 0.00 1.07 0.00 0.00 42.92 41.37 2nv0 s ASP 119 CO -0.01 -0.53 -0.15 -0.76 1.18 0.00 0.00 175.17 174.90 2nv0 s LEU 120 N 2.18 2.76 -0.25 1.23 1.43 0.12 -4.88 118.68 121.28 2nv0 s LEU 120 Ca 0.52 -0.32 -0.17 0.00 -1.03 0.00 0.00 54.13 53.14 2nv0 s LEU 120 Cb -0.22 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 2nv0 s LEU 120 CO 0.20 0.28 0.46 -0.89 0.23 0.00 0.00 176.35 176.62 2nv0 s THR 121 N -0.91 5.12 -0.12 5.49 2.01 -1.26 0.06 115.64 126.03 2nv0 s THR 121 Ca 0.15 0.77 0.03 0.00 0.31 0.00 0.00 61.69 62.95 2nv0 s THR 121 Cb -0.11 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.63 2nv0 s THR 121 CO 0.05 0.13 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.26 2nv0 s ILE 122 N 2.06 2.04 -0.06 1.82 1.01 -1.26 -4.40 121.20 122.41 2nv0 s ILE 122 Ca 0.19 -0.99 -0.36 0.00 0.00 0.00 0.00 60.65 59.50 2nv0 s ILE 122 Cb -0.16 -1.79 -0.13 0.00 0.01 0.00 0.00 42.46 40.40 2nv0 s ILE 122 CO 0.09 0.55 1.75 1.17 0.00 0.00 0.00 174.94 178.50 2nv0 n LYS 123 N 3.81 1.88 0.00 2.79 4.81 0.32 -0.74 118.16 131.02 2nv0 n LYS 123 Ca -0.20 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 2nv0 n LYS 123 Cb 0.52 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 33.10 2nv0 n LYS 123 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nv0 n GLY 124 N 4.01 0.37 3.26 3.14 0.00 -1.26 -4.99 105.19 109.72 2nv0 n GLY 124 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 2nv0 n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nv0 s LEU 125 N 0.00 2.06 -0.01 0.99 1.02 0.08 -5.07 118.68 117.75 2nv0 s LEU 125 Ca 0.00 -0.51 -0.03 0.00 0.02 0.00 0.00 54.13 53.61 2nv0 s LEU 125 Cb 0.00 -1.36 -0.02 0.00 0.02 0.00 0.00 46.19 44.83 2nv0 s LEU 125 CO 0.00 0.23 0.42 0.44 0.02 0.00 0.00 176.35 177.46 2nv0 h ASP 126 N 6.14 -0.10 -4.18 2.29 3.32 -1.98 -3.41 116.42 118.50 2nv0 h ASP 126 Ca -0.30 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.28 2nv0 h ASP 126 Cb 1.18 0.03 0.02 0.00 0.22 0.00 0.00 39.33 40.77 2nv0 h ASP 126 CO 0.47 0.00 0.37 -1.61 -1.72 0.00 0.00 179.24 176.76 2nv0 s GLU 127 N -2.07 3.94 0.88 3.56 0.41 -1.26 -4.95 118.70 119.20 2nv0 s GLU 127 Ca -0.02 0.98 -0.13 0.00 -0.41 0.00 0.00 54.97 55.39 2nv0 s GLU 127 Cb 0.00 -2.13 0.03 0.00 -1.78 0.00 0.00 34.13 30.25 2nv0 s GLU 127 CO 0.05 -0.28 0.56 -2.30 -0.49 0.00 0.00 175.26 172.81 2nv0 n PRO 128 N -1.52 -0.10 -5.06 0.39 -0.02 -1.26 -4.82 135.00 122.60 2nv0 n PRO 128 Ca 0.07 0.02 -0.31 0.00 -2.02 0.00 0.00 63.50 61.26 2nv0 n PRO 128 Cb 0.54 -1.94 -0.17 0.00 -0.02 0.00 0.00 33.50 31.91 2nv0 n PRO 128 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2nv0 s PHE 129 N -2.26 2.36 -0.60 6.00 5.36 0.11 -4.88 117.98 124.06 2nv0 s PHE 129 Ca 0.61 -0.97 -0.28 0.00 -0.96 0.00 0.00 56.93 55.33 2nv0 s PHE 129 Cb -0.25 -1.60 0.03 0.00 -0.34 0.00 0.00 43.02 40.86 2nv0 s PHE 129 CO 0.63 -0.41 1.24 0.99 -1.46 0.00 0.00 175.22 176.21 2nv0 s THR 130 N 0.44 3.94 0.00 0.12 2.01 -1.26 0.16 115.64 121.04 2nv0 s THR 130 Ca -0.17 0.80 -0.27 0.00 0.31 0.00 0.00 61.69 62.35 2nv0 s THR 130 Cb -0.17 -4.72 -0.04 0.00 0.01 0.00 0.00 72.50 67.58 2nv0 s THR 130 CO 0.07 -1.40 0.87 -0.83 -0.69 0.00 0.00 174.62 172.64 2nv0 s GLY 131 N 3.29 2.82 -0.41 4.40 0.00 0.82 -4.92 107.32 113.33 2nv0 s GLY 131 Ca 0.43 0.39 -0.13 0.00 0.00 0.00 0.00 44.72 45.41 2nv0 s GLY 131 CO 0.24 1.43 0.28 0.14 0.00 0.00 0.00 173.10 175.19 2nv0 s VAL 132 N 0.67 4.89 -0.23 1.40 1.01 -1.26 -1.37 120.40 125.51 2nv0 s VAL 132 Ca 0.45 -0.91 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 2nv0 s VAL 132 Cb -0.20 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2nv0 s VAL 132 CO 0.25 -0.36 0.06 -0.36 0.00 0.00 0.00 175.10 174.68 2nv0 s PHE 133 N 1.60 3.11 -0.21 5.22 0.40 0.13 -0.57 117.98 127.66 2nv0 s PHE 133 Ca 0.03 -0.30 -0.05 0.00 -0.60 0.00 0.00 56.93 56.02 2nv0 s PHE 133 Cb -0.21 -2.18 0.07 0.00 0.51 0.00 0.00 43.02 41.22 2nv0 s PHE 133 CO 0.07 -0.22 0.10 0.42 0.70 0.00 0.00 175.22 176.30 2nv0 s ILE 134 N 1.23 -0.07 -1.42 0.64 1.01 -1.26 -1.02 121.20 120.31 2nv0 s ILE 134 Ca 0.04 -0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.28 2nv0 s ILE 134 Cb -0.14 -0.72 0.03 0.00 0.01 0.00 0.00 42.46 41.63 2nv0 s ILE 134 CO 0.03 -0.44 0.64 0.54 0.00 0.00 0.00 174.94 175.71 2nv0 n ARG 135 N 5.27 -4.21 -1.97 2.79 1.74 0.23 -4.83 116.66 115.67 2nv0 n ARG 135 Ca -0.07 0.51 -0.42 0.00 -0.77 0.00 0.00 57.85 57.11 2nv0 n ARG 135 Cb 0.47 -4.96 -0.02 0.00 -1.02 0.00 0.00 32.46 26.92 2nv0 n ARG 135 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2nv0 s ALA 136 N -3.70 3.68 0.87 7.54 0.00 -1.26 -4.46 121.76 124.43 2nv0 s ALA 136 Ca 0.17 1.36 -0.11 0.00 0.00 0.00 0.00 51.96 53.37 2nv0 s ALA 136 Cb -0.09 -3.58 0.12 0.00 0.00 0.00 0.00 23.12 19.57 2nv0 s ALA 136 CO 0.86 -0.77 1.09 -1.25 0.00 0.00 0.00 175.76 175.69 2nv0 s PRO 137 N 0.10 1.44 -0.11 0.00 0.04 -1.26 -4.08 135.00 131.13 2nv0 s PRO 137 Ca 0.63 1.02 0.02 0.00 0.04 0.00 0.00 61.00 62.71 2nv0 s PRO 137 Cb -0.43 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 2nv0 s PRO 137 CO 0.40 -2.17 -0.18 -1.01 0.04 0.00 0.00 177.00 174.07 2nv0 s HIS 138 N -2.86 2.68 -0.24 0.56 3.76 0.13 -4.83 115.29 114.47 2nv0 s HIS 138 Ca 0.63 -0.80 -0.27 0.00 -0.15 0.00 0.00 55.06 54.47 2nv0 s HIS 138 Cb -0.19 -1.77 0.00 0.00 1.11 0.00 0.00 32.58 31.74 2nv0 s HIS 138 CO 0.57 -0.29 0.95 0.42 -0.85 0.00 0.00 174.74 175.55 2nv0 s ILE 139 N 0.28 4.74 -0.01 0.60 1.01 -1.26 -0.11 121.20 126.45 2nv0 s ILE 139 Ca -0.13 1.80 0.01 0.00 0.00 0.00 0.00 60.65 62.33 2nv0 s ILE 139 Cb -0.17 -4.23 -0.26 0.00 0.01 0.00 0.00 42.46 37.81 2nv0 s ILE 139 CO 0.07 -0.16 0.80 -0.07 0.00 0.00 0.00 174.94 175.58 2nv0 h LEU 140 N 9.38 0.28 -7.02 2.97 3.38 -0.83 -3.41 115.31 120.06 2nv0 h LEU 140 Ca -0.21 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.27 2nv0 h LEU 140 Cb 1.07 -0.09 -0.20 0.00 0.09 0.00 0.00 40.66 41.53 2nv0 h LEU 140 CO 0.94 1.37 0.14 -1.83 0.09 0.00 0.00 178.44 179.15 2nv0 s GLU 141 N -2.61 0.96 -0.06 1.13 -1.05 -1.21 -5.00 118.70 110.85 2nv0 s GLU 141 Ca -0.09 0.50 0.04 0.00 -0.15 0.00 0.00 54.97 55.28 2nv0 s GLU 141 Cb 0.07 0.46 -0.02 0.00 -0.44 0.00 0.00 34.13 34.20 2nv0 s GLU 141 CO 0.84 -0.24 -0.18 0.00 0.95 0.00 0.00 175.26 176.63 2nv0 s ALA 142 N -0.63 2.50 1.00 -0.84 0.00 -1.26 -1.26 121.76 121.27 2nv0 s ALA 142 Ca -0.07 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.76 2nv0 s ALA 142 Cb -0.02 -0.89 0.19 0.00 0.00 0.00 0.00 23.12 22.40 2nv0 s ALA 142 CO 0.07 0.49 1.09 0.20 0.00 0.00 0.00 175.76 177.61 2nv0 s GLY 143 N -0.48 1.57 0.38 0.00 0.00 0.64 -4.93 107.32 104.49 2nv0 s GLY 143 Ca 0.06 -0.36 0.27 0.00 0.00 0.00 0.00 44.72 44.69 2nv0 s GLY 143 CO 0.01 0.25 1.83 1.05 0.00 0.00 0.00 173.10 176.24 2nv0 h GLU 144 N -1.90 0.00 -0.01 2.90 4.11 -2.00 -1.91 114.58 115.77 2nv0 h GLU 144 Ca -0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.88 2nv0 h GLU 144 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 2nv0 h GLU 144 CO 0.58 0.00 -0.04 0.27 0.07 0.00 0.00 179.01 179.89 2nv0 n ASN 145 N -2.50 1.33 -4.62 3.06 6.94 -1.26 -4.91 115.26 113.29 2nv0 n ASN 145 Ca 0.00 -1.36 -0.35 0.00 -0.02 0.00 0.00 54.58 52.85 2nv0 n ASN 145 Cb 0.17 0.02 -0.10 0.00 -2.36 0.00 0.00 39.78 37.51 2nv0 n ASN 145 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2nv0 s VAL 146 N -2.09 4.81 -0.22 3.53 1.01 -0.72 -4.73 120.40 121.99 2nv0 s VAL 146 Ca 0.36 -0.02 -0.19 0.00 0.00 0.00 0.00 61.98 62.13 2nv0 s VAL 146 Cb 0.21 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 2nv0 s VAL 146 CO 0.37 0.44 0.54 -0.70 0.00 0.00 0.00 175.10 175.75 2nv0 s GLU 147 N 0.56 4.15 -0.17 2.72 2.12 0.11 -4.91 118.70 123.27 2nv0 s GLU 147 Ca 0.04 0.42 -0.28 0.00 0.36 0.00 0.00 54.97 55.52 2nv0 s GLU 147 Cb -0.13 -3.60 -0.01 0.00 0.26 0.00 0.00 34.13 30.66 2nv0 s GLU 147 CO 0.01 -0.25 0.94 0.08 -0.54 0.00 0.00 175.26 175.50 2nv0 s VAL 148 N 1.96 4.80 -0.15 3.70 1.01 -1.26 -0.39 120.40 130.07 2nv0 s VAL 148 Ca 0.24 1.87 0.17 0.00 0.00 0.00 0.00 61.98 64.26 2nv0 s VAL 148 Cb -0.16 -4.24 -0.24 0.00 0.00 0.00 0.00 36.38 31.74 2nv0 s VAL 148 CO 0.09 -0.04 0.28 0.18 0.00 0.00 0.00 175.10 175.62 2nv0 n LEU 149 N 5.46 0.25 -3.65 3.92 4.77 -0.09 -4.89 117.00 122.76 2nv0 n LEU 149 Ca 0.08 0.12 -0.14 0.00 -0.03 0.00 0.00 56.01 56.04 2nv0 n LEU 149 Cb 0.48 0.37 -0.08 0.00 -2.33 0.00 0.00 43.42 41.86 2nv0 n LEU 149 CO 0.50 0.42 0.31 -0.55 -1.33 0.00 0.00 177.39 176.74 2nv0 s SER 150 N -5.58 -0.62 0.08 -1.43 0.15 -1.01 -0.53 113.70 104.75 2nv0 s SER 150 Ca -0.08 1.14 0.05 0.00 0.70 0.00 0.00 55.95 57.76 2nv0 s SER 150 Cb 0.07 1.14 -0.03 0.00 -1.71 0.00 0.00 66.02 65.49 2nv0 s SER 150 CO 0.83 -0.26 -0.14 -1.61 1.20 0.00 0.00 173.24 173.26 2nv0 s GLU 151 N 0.10 0.84 -0.10 5.44 2.02 -1.26 -0.86 118.70 124.87 2nv0 s GLU 151 Ca -0.02 -0.98 -0.02 0.00 0.02 0.00 0.00 54.97 53.97 2nv0 s GLU 151 Cb -0.04 -0.83 0.03 0.00 0.10 0.00 0.00 34.13 33.40 2nv0 s GLU 151 CO 0.02 0.18 0.00 -1.58 0.02 0.00 0.00 175.26 173.90 2nv0 s HIS 152 N -1.37 0.83 -1.60 1.61 5.65 0.15 -4.76 115.29 115.80 2nv0 s HIS 152 Ca -0.01 -0.39 -0.13 0.00 0.25 0.00 0.00 55.06 54.78 2nv0 s HIS 152 Cb -0.09 -0.90 0.11 0.00 -1.18 0.00 0.00 32.58 30.51 2nv0 s HIS 152 CO 0.02 -0.41 0.75 0.09 -0.65 0.00 0.00 174.74 174.54 2nv0 n ASN 153 N 5.10 -2.96 0.00 9.88 3.02 -1.26 -1.51 115.26 127.54 2nv0 n ASN 153 Ca -0.08 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.51 2nv0 n ASN 153 Cb 0.49 -3.09 0.00 0.00 -0.61 0.00 0.00 39.78 36.57 2nv0 n ASN 153 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2nv0 n GLY 154 N -1.59 0.85 3.56 7.41 0.00 -1.26 -5.02 105.19 109.13 2nv0 n GLY 154 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 2nv0 n GLY 154 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2nv0 s ARG 155 N -0.27 3.52 -0.01 1.61 3.52 -0.57 -5.07 118.95 121.68 2nv0 s ARG 155 Ca 0.00 -0.48 -0.30 0.00 -0.13 0.00 0.00 55.73 54.82 2nv0 s ARG 155 Cb 0.00 -2.91 -0.06 0.00 -1.56 0.00 0.00 34.95 30.42 2nv0 s ARG 155 CO 0.00 0.36 1.64 0.42 -0.81 0.00 0.00 175.30 176.92 2nv0 s ILE 156 N 0.04 3.41 -0.20 4.11 1.01 -1.26 -0.68 121.20 127.64 2nv0 s ILE 156 Ca 0.01 0.65 0.04 0.00 0.00 0.00 0.00 60.65 61.35 2nv0 s ILE 156 Cb -0.13 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 2nv0 s ILE 156 CO 0.02 -0.04 0.19 1.33 0.00 0.00 0.00 174.94 176.44 2nv0 n VAL 157 N 5.19 0.00 -3.77 2.92 0.24 -0.04 -4.31 118.33 118.56 2nv0 n VAL 157 Ca 0.17 -0.41 -0.13 0.00 -2.04 0.00 0.00 64.34 61.93 2nv0 n VAL 157 Cb 0.42 1.00 -0.11 0.00 -1.47 0.00 0.00 33.84 33.68 2nv0 n VAL 157 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nv0 s ALA 158 N -1.34 -0.73 0.03 2.33 0.00 -1.08 -1.49 121.76 119.49 2nv0 s ALA 158 Ca 0.02 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 52.73 2nv0 s ALA 158 Cb 0.03 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.65 2nv0 s ALA 158 CO 0.16 -0.15 0.24 0.00 0.00 0.00 0.00 175.76 176.01 2nv0 s ALA 159 N 0.28 -0.53 0.01 0.00 0.00 0.04 -0.92 121.76 120.65 2nv0 s ALA 159 Ca -0.01 -0.06 0.01 0.00 0.00 0.00 0.00 51.96 51.89 2nv0 s ALA 159 Cb -0.03 0.23 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 2nv0 s ALA 159 CO -0.01 -0.34 -0.03 0.21 0.00 0.00 0.00 175.76 175.60 2nv0 s LYS 160 N -2.17 0.24 -0.32 0.00 2.20 0.48 -0.95 119.74 119.22 2nv0 s LYS 160 Ca -0.08 -0.33 0.02 0.00 -0.36 0.00 0.00 55.97 55.22 2nv0 s LYS 160 Cb -0.03 -0.07 0.16 0.00 -1.51 0.00 0.00 37.83 36.38 2nv0 s LYS 160 CO -0.01 0.01 0.40 -1.14 -0.36 0.00 0.00 175.35 174.25 2nv0 s GLN 161 N -0.71 0.49 6.77 4.03 0.74 0.16 0.03 119.66 131.17 2nv0 s GLN 161 Ca -0.06 -0.18 0.00 0.00 0.05 0.00 0.00 55.36 55.17 2nv0 s GLN 161 Cb -0.05 -0.42 0.00 0.00 1.10 0.00 0.00 33.01 33.64 2nv0 s GLN 161 CO -0.00 -1.09 0.00 0.41 -0.55 0.00 0.00 175.29 174.06 2nv0 n GLY 162 N 5.01 2.42 0.01 2.59 0.00 -1.26 -0.89 105.19 113.06 2nv0 n GLY 162 Ca 0.04 0.22 0.13 0.00 0.00 0.00 0.00 46.02 46.40 2nv0 n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nv0 n GLN 163 N 5.28 0.04 -3.65 1.61 10.64 -1.26 -4.89 117.38 125.15 2nv0 n GLN 163 Ca 0.00 0.02 -0.37 0.00 -1.83 0.00 0.00 57.00 54.81 2nv0 n GLN 163 Cb 0.00 -1.53 -0.06 0.00 -0.86 0.00 0.00 30.24 27.79 2nv0 n GLN 163 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 2nv0 s PHE 164 N -3.02 3.66 -0.01 2.61 0.08 -0.07 -1.52 117.98 119.71 2nv0 s PHE 164 Ca 0.12 0.78 0.03 0.00 0.12 0.00 0.00 56.93 57.98 2nv0 s PHE 164 Cb 0.17 -2.16 -0.00 0.00 -0.57 0.00 0.00 43.02 40.46 2nv0 s PHE 164 CO 0.64 0.65 -0.09 -1.17 -0.10 0.00 0.00 175.22 175.15 2nv0 s LEU 165 N -0.93 1.96 -0.01 -0.37 2.96 -0.33 -0.66 118.68 121.30 2nv0 s LEU 165 Ca 0.20 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.93 2nv0 s LEU 165 Cb -0.15 -0.48 0.00 0.00 0.50 0.00 0.00 46.19 46.07 2nv0 s LEU 165 CO 0.09 0.10 0.02 -0.83 -1.32 0.00 0.00 176.35 174.41 2nv0 s GLY 166 N -0.11 -0.01 0.03 7.98 0.00 -0.12 -1.42 107.32 113.67 2nv0 s GLY 166 Ca 0.02 0.05 -0.07 0.00 0.00 0.00 0.00 44.72 44.71 2nv0 s GLY 166 CO -0.00 0.03 0.14 0.00 0.00 0.00 0.00 173.10 173.28 2nv0 n SER 168 N 0.90 1.49 -4.89 0.00 3.41 -0.55 -1.06 113.62 112.93 2nv0 n SER 168 Ca -0.20 -1.21 -0.23 0.00 -0.26 0.00 0.00 58.87 56.98 2nv0 n SER 168 Cb 0.58 0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 64.72 2nv0 n SER 168 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2nv0 s PHE 169 N -2.41 2.27 -0.71 7.33 -0.71 -1.26 -4.30 117.98 118.19 2nv0 s PHE 169 Ca 0.24 -0.62 -0.17 0.00 -1.04 0.00 0.00 56.93 55.34 2nv0 s PHE 169 Cb 0.19 -2.08 0.15 0.00 -1.21 0.00 0.00 43.02 40.07 2nv0 s PHE 169 CO 0.50 -0.29 0.74 -1.01 -1.34 0.00 0.00 175.22 173.83 2nv0 s HIS 170 N -2.59 3.34 -1.79 3.49 3.76 0.27 -3.93 115.29 117.84 2nv0 s HIS 170 Ca 0.44 -1.46 0.25 0.00 -0.15 0.00 0.00 55.06 54.14 2nv0 s HIS 170 Cb -0.02 -3.94 1.40 0.00 1.11 0.00 0.00 32.58 31.12 2nv0 s HIS 170 CO 0.26 -1.16 1.84 -0.35 -0.85 0.00 0.00 174.74 174.48 2nv0 n PRO 171 N 5.30 0.62 -0.00 8.40 -0.04 -1.26 -3.06 135.00 144.96 2nv0 n PRO 171 Ca 0.03 0.02 0.09 0.00 -0.04 0.00 0.00 63.50 63.59 2nv0 n PRO 171 Cb 0.44 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.29 2nv0 n PRO 171 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2nv0 n GLU 172 N -1.11 1.00 -1.13 0.54 0.00 -1.26 -4.55 120.64 114.12 2nv0 n GLU 172 Ca 0.16 -0.05 -0.20 0.00 0.00 0.00 0.00 57.16 57.07 2nv0 n GLU 172 Cb 0.13 -1.36 -0.02 0.00 0.00 0.00 0.00 31.44 30.19 2nv0 n GLU 172 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2nv0 n LEU 173 N -1.63 6.34 -3.49 -1.84 4.77 -1.17 -4.76 117.00 115.22 2nv0 n LEU 173 Ca 0.01 -3.58 -0.11 0.00 -0.03 0.00 0.00 56.01 52.30 2nv0 n LEU 173 Cb 0.33 -1.16 -0.02 0.00 -2.33 0.00 0.00 43.42 40.24 2nv0 n LEU 173 CO 0.36 1.46 0.36 0.28 -1.33 0.00 0.00 177.39 178.53 2nv0 s THR 174 N -1.94 0.01 -2.29 -5.08 -1.32 -1.26 -4.96 115.64 98.79 2nv0 s THR 174 Ca 0.44 -0.17 0.22 0.00 -1.21 0.00 0.00 61.69 60.98 2nv0 s THR 174 Cb 0.30 -1.10 0.50 0.00 -1.51 0.00 0.00 72.50 70.68 2nv0 s THR 174 CO -0.09 -0.05 1.62 -0.62 -2.21 0.00 0.00 174.62 173.27 2nv0 n GLU 175 N -0.36 1.63 -3.00 7.08 -0.58 -1.26 -4.75 120.64 119.39 2nv0 n GLU 175 Ca -0.16 -0.94 -0.43 0.00 -0.42 0.00 0.00 57.16 55.21 2nv0 n GLU 175 Cb 0.64 -1.41 -0.05 0.00 -0.57 0.00 0.00 31.44 30.05 2nv0 n GLU 175 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2nv0 s ASP 176 N -1.67 6.29 -0.13 1.62 -1.08 -1.26 -4.92 116.67 115.51 2nv0 s ASP 176 Ca 0.34 -0.61 0.11 0.00 -0.52 0.00 0.00 52.55 51.87 2nv0 s ASP 176 Cb 0.18 -2.36 0.55 0.00 -1.46 0.00 0.00 42.92 39.83 2nv0 s ASP 176 CO 0.28 -1.04 1.37 1.41 0.52 0.00 0.00 175.17 177.71 2nv0 n HIS 177 N 6.78 1.29 0.10 -5.34 8.25 -1.26 -4.48 115.22 120.56 2nv0 n HIS 177 Ca -0.02 -0.47 -0.01 0.00 -0.26 0.00 0.00 57.72 56.96 2nv0 n HIS 177 Cb 0.47 -0.31 0.25 0.00 1.12 0.00 0.00 29.99 31.52 2nv0 n HIS 177 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2nv0 h ARG 178 N 2.83 0.23 -0.14 -0.41 3.08 -1.91 -0.31 114.38 117.75 2nv0 h ARG 178 Ca 0.00 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 59.83 2nv0 h ARG 178 Cb 1.36 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.40 2nv0 h ARG 178 CO 0.27 0.57 -0.38 0.28 -1.07 0.00 0.00 179.97 179.64 2nv0 h VAL 179 N 0.20 1.36 -0.99 2.04 2.07 -1.89 -2.21 116.25 116.83 2nv0 h VAL 179 Ca 0.02 -1.67 0.08 0.00 0.82 0.00 0.00 66.70 65.95 2nv0 h VAL 179 Cb 0.74 2.06 -0.07 0.00 -1.52 0.00 0.00 31.29 32.50 2nv0 h VAL 179 CO 0.06 0.50 0.64 0.74 0.02 0.00 0.00 177.57 179.53 2nv0 h THR 180 N 0.11 1.05 -0.81 2.57 2.02 -1.76 -1.51 112.91 114.58 2nv0 h THR 180 Ca -0.01 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 2nv0 h THR 180 Cb 0.99 -0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 2nv0 h THR 180 CO 0.08 0.20 0.48 -0.61 0.37 0.00 0.00 175.52 176.05 2nv0 h GLN 181 N 1.12 1.11 -0.58 6.66 5.75 -0.92 0.83 115.11 129.09 2nv0 h GLN 181 Ca 0.44 -0.10 0.07 0.00 -0.15 0.00 0.00 58.65 58.91 2nv0 h GLN 181 Cb 0.24 -0.23 -0.06 0.00 1.07 0.00 0.00 27.48 28.50 2nv0 h GLN 181 CO -0.19 0.78 0.25 -0.07 -2.65 0.00 0.00 178.83 176.96 2nv0 h LEU 182 N 1.12 0.30 -0.37 -2.39 3.38 -0.65 0.15 115.31 116.86 2nv0 h LEU 182 Ca 0.29 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.28 2nv0 h LEU 182 Cb -0.03 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2nv0 h LEU 182 CO -0.05 0.19 0.09 0.15 0.09 0.00 0.00 178.44 178.91 2nv0 h PHE 183 N 0.46 0.62 -0.84 1.13 3.57 -0.80 -2.11 116.94 118.96 2nv0 h PHE 183 Ca 0.28 -0.07 0.07 0.00 3.53 0.00 0.00 57.97 61.78 2nv0 h PHE 183 Cb 0.28 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.78 2nv0 h PHE 183 CO -0.14 0.61 0.51 0.28 -2.23 0.00 0.00 178.31 177.34 2nv0 h VAL 184 N 0.45 1.00 -0.83 1.41 2.07 -0.42 -1.15 116.25 118.78 2nv0 h VAL 184 Ca 0.12 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2nv0 h VAL 184 Cb 0.30 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 2nv0 h VAL 184 CO 0.00 0.17 0.48 -0.33 0.02 0.00 0.00 177.57 177.91 2nv0 h GLU 185 N 0.91 1.13 -0.71 1.57 5.08 -0.76 0.50 114.58 122.30 2nv0 h GLU 185 Ca 0.38 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 2nv0 h GLU 185 Cb 0.23 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2nv0 h GLU 185 CO -0.19 0.80 0.39 0.52 -1.00 0.00 0.00 179.01 179.53 2nv0 h MET 186 N 1.14 0.98 -0.28 2.33 2.86 -0.62 -0.15 114.93 121.19 2nv0 h MET 186 Ca 0.30 -0.10 -0.13 0.00 -2.06 0.00 0.00 59.70 57.70 2nv0 h MET 186 Cb -0.03 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.43 2nv0 h MET 186 CO -0.05 0.71 -0.35 0.28 1.06 0.00 0.00 176.91 178.56 2nv0 h VAL 187 N 0.99 1.30 -0.73 -2.22 2.07 -0.44 -0.67 116.25 116.55 2nv0 h VAL 187 Ca 0.25 -1.53 0.01 0.00 0.82 0.00 0.00 66.70 66.25 2nv0 h VAL 187 Cb 0.02 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 2nv0 h VAL 187 CO -0.04 0.49 0.48 -0.08 0.02 0.00 0.00 177.57 178.44 2nv0 h GLU 188 N 0.47 0.94 -0.52 1.57 4.57 -0.70 0.20 114.58 121.11 2nv0 h GLU 188 Ca 0.04 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2nv0 h GLU 188 Cb 0.93 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 2nv0 h GLU 188 CO 0.08 0.62 0.30 1.49 -1.18 0.00 0.00 179.01 180.32 2nv0 h GLU 189 N 0.97 0.72 -0.68 1.92 4.81 -0.86 -1.54 114.58 119.92 2nv0 h GLU 189 Ca 0.28 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.47 2nv0 h GLU 189 Cb -0.08 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.11 2nv0 h GLU 189 CO -0.07 0.54 0.42 -0.92 -0.73 0.00 0.00 179.01 178.25 2nv0 h TYR 190 N 0.70 0.78 -0.42 0.92 3.20 -0.62 -2.99 116.97 118.54 2nv0 h TYR 190 Ca 0.19 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.02 2nv0 h TYR 190 Cb 0.02 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.02 2nv0 h TYR 190 CO -0.02 0.43 0.02 -0.22 -1.64 0.00 0.00 178.16 176.73 2nv0 h LYS 191 N 0.80 0.65 -0.31 1.82 3.11 -0.11 0.90 116.57 123.45 2nv0 h LYS 191 Ca 0.28 -0.15 -0.16 0.00 -2.81 0.00 0.00 60.65 57.81 2nv0 h LYS 191 Cb 0.06 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.19 2nv0 h LYS 191 CO -0.12 0.66 -0.45 1.96 -2.81 0.00 0.00 179.45 178.68 2nv0 h GLN 192 N 0.62 0.80 0.00 1.90 1.08 -1.26 -3.14 115.11 115.12 2nv0 h GLN 192 Ca 0.13 -0.45 -0.09 0.00 -1.45 0.00 0.00 58.65 56.79 2nv0 h GLN 192 Cb 0.36 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 2nv0 h GLN 192 CO 0.01 1.08 -0.64 0.87 -0.95 0.00 0.00 178.83 179.21 2nv0 h LYS 193 N 0.64 0.00 -6.42 1.46 1.79 -1.30 -3.47 116.57 109.27 2nv0 h LYS 193 Ca 0.04 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 57.88 2nv0 h LYS 193 Cb 1.02 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 31.76 2nv0 h LYS 193 CO 0.10 0.34 0.38 0.00 -1.08 0.00 0.00 179.45 179.19 2nv0 n ALA 194 N -2.23 -0.13 0.65 3.86 0.00 0.27 -5.11 120.51 117.82 2nv0 n ALA 194 Ca -0.00 0.44 0.08 0.00 0.00 0.00 0.00 53.44 53.96 2nv0 n ALA 194 Cb 0.71 -2.11 0.07 0.00 0.00 0.00 0.00 19.45 18.11 2nv0 n ALA 194 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97