#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1unn s LYS 2 N 0.00 0.09 0.15 2.12 1.02 0.13 -1.12 119.74 122.13 1unn s LYS 2 Ca 0.00 0.04 -0.19 0.00 0.02 0.00 0.00 55.97 55.84 1unn s LYS 2 Cb 0.00 0.04 0.05 0.00 -0.52 0.00 0.00 37.83 37.40 1unn s LYS 2 CO 0.00 -0.01 0.51 -0.59 -0.92 0.00 0.00 175.35 174.34 1unn s PHE 3 N -0.06 -0.35 -0.06 3.18 -0.71 -0.03 -0.89 117.98 119.06 1unn s PHE 3 Ca -0.01 0.07 0.01 0.00 -1.04 0.00 0.00 56.93 55.97 1unn s PHE 3 Cb -0.01 0.42 0.02 0.00 -1.21 0.00 0.00 43.02 42.24 1unn s PHE 3 CO 0.00 -0.80 -0.08 0.99 -1.34 0.00 0.00 175.22 173.99 1unn s THR 4 N -3.79 0.84 0.02 -4.49 2.01 -1.24 -0.08 115.64 108.91 1unn s THR 4 Ca 0.03 -0.29 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1unn s THR 4 Cb 0.00 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.69 1unn s THR 4 CO -0.11 0.29 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.39 1unn s VAL 5 N 0.88 0.15 0.33 3.82 1.01 -0.15 -4.51 120.40 121.93 1unn s VAL 5 Ca -0.11 -0.67 -0.27 0.00 0.00 0.00 0.00 61.98 60.93 1unn s VAL 5 Cb -0.15 -0.24 -0.09 0.00 0.00 0.00 0.00 36.38 35.89 1unn s VAL 5 CO 0.01 -0.33 1.05 -0.70 0.00 0.00 0.00 175.10 175.12 1unn s GLU 6 N -1.05 4.48 0.23 2.72 -6.30 -1.26 -0.12 118.70 117.40 1unn s GLU 6 Ca -0.10 1.61 -0.06 0.00 -2.50 0.00 0.00 54.97 53.91 1unn s GLU 6 Cb -0.07 -2.91 0.40 0.00 0.00 0.00 0.00 34.13 31.54 1unn s GLU 6 CO -0.01 0.12 1.71 -0.09 0.02 0.00 0.00 175.26 177.02 1unn h ARG 7 N 3.28 0.34 0.00 4.30 2.43 -1.14 -0.89 114.38 122.70 1unn h ARG 7 Ca -0.47 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1unn h ARG 7 Cb 1.21 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1unn h ARG 7 CO 0.65 0.22 0.00 0.39 -1.51 0.00 0.00 179.97 179.72 1unn n GLU 8 N -5.07 0.07 0.13 0.20 4.71 -1.26 -1.43 120.64 117.99 1unn n GLU 8 Ca 0.12 0.12 0.12 0.00 -0.01 0.00 0.00 57.16 57.51 1unn n GLU 8 Cb 0.39 -1.50 0.19 0.00 -1.01 0.00 0.00 31.44 29.51 1unn n GLU 8 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1unn h HIS 9 N 0.00 0.00 0.00 -0.32 3.86 -1.53 -3.32 115.15 113.83 1unn h HIS 9 Ca 0.00 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.96 1unn h HIS 9 Cb 0.34 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 1unn h HIS 9 CO 0.00 0.00 -2.12 -0.11 0.86 0.00 0.00 177.93 176.56 1unn n LEU 10 N -2.59 0.17 0.11 2.43 7.94 -0.51 -4.62 117.00 119.93 1unn n LEU 10 Ca 0.03 0.08 -0.13 0.00 -1.11 0.00 0.00 56.01 54.88 1unn n LEU 10 Cb 0.49 0.30 -0.08 0.00 0.53 0.00 0.00 43.42 44.67 1unn n LEU 10 CO 0.35 0.33 0.80 -0.07 -1.11 0.00 0.00 177.39 177.68 1unn h LEU 11 N 0.00 -0.18 -0.45 -1.96 3.38 -1.46 -0.42 115.31 114.22 1unn h LEU 11 Ca -0.35 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.51 1unn h LEU 11 Cb 1.85 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.63 1unn h LEU 11 CO 0.03 -0.10 -0.07 0.50 0.09 0.00 0.00 178.44 178.89 1unn h LYS 12 N -0.25 0.84 -0.86 1.13 3.64 -1.84 -0.96 116.57 118.27 1unn h LYS 12 Ca -0.02 -0.30 0.05 0.00 -1.27 0.00 0.00 60.65 59.11 1unn h LYS 12 Cb 0.19 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.90 1unn h LYS 12 CO 0.04 0.93 0.54 -1.35 -2.27 0.00 0.00 179.45 177.33 1unn h PRO 13 N 0.67 0.98 -0.57 1.90 0.11 -1.80 0.16 132.00 133.45 1unn h PRO 13 Ca 0.12 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.12 1unn h PRO 13 Cb 0.59 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1unn h PRO 13 CO 0.04 0.65 0.17 -0.07 -0.21 0.00 0.00 178.00 178.57 1unn h LEU 14 N 1.01 0.84 -0.30 2.35 3.38 -0.52 -0.94 115.31 121.13 1unn h LEU 14 Ca 0.36 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1unn h LEU 14 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1unn h LEU 14 CO -0.15 0.84 0.14 1.56 0.09 0.00 0.00 178.44 180.92 1unn h GLN 15 N 0.81 0.44 -0.79 1.13 4.20 -0.31 -2.09 115.11 118.49 1unn h GLN 15 Ca 0.18 -0.07 0.07 0.00 0.06 0.00 0.00 58.65 58.89 1unn h GLN 15 Cb 0.30 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.94 1unn h GLN 15 CO -0.00 0.42 0.47 1.96 -0.67 0.00 0.00 178.83 181.01 1unn h GLN 16 N 0.35 0.82 0.00 1.46 1.08 -0.63 -2.60 115.11 115.60 1unn h GLN 16 Ca 0.10 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1unn h GLN 16 Cb 0.13 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.37 1unn h GLN 16 CO -0.01 0.55 -0.30 -0.39 -0.95 0.00 0.00 178.83 177.73 1unn h VAL 17 N 0.85 0.00 -3.56 -0.54 -1.51 -1.01 -3.37 116.25 107.11 1unn h VAL 17 Ca 0.36 -0.70 -0.74 0.00 -1.23 0.00 0.00 66.70 64.38 1unn h VAL 17 Cb 0.21 1.53 -0.30 0.00 -2.13 0.00 0.00 31.29 30.60 1unn h VAL 17 CO -0.19 0.00 -0.21 -0.44 -1.23 0.00 0.00 177.57 175.50 1unn s SER 18 N -5.05 5.91 0.00 4.19 0.01 -0.80 -3.44 113.70 114.51 1unn s SER 18 Ca 0.07 -2.52 0.00 0.00 1.31 0.00 0.00 55.95 54.81 1unn s SER 18 Cb 0.10 -2.03 0.00 0.00 0.21 0.00 0.00 66.02 64.30 1unn s SER 18 CO 0.68 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 174.40 1unn n GLY 19 N 4.07 -2.11 0.00 3.44 0.00 -1.26 -4.72 105.19 104.62 1unn n GLY 19 Ca 0.05 0.72 0.05 0.00 0.00 0.00 0.00 46.02 46.84 1unn n GLY 19 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1unn n PRO 20 N -1.60 0.26 -0.31 1.61 -0.02 -1.26 -4.07 135.00 129.61 1unn n PRO 20 Ca 0.00 0.07 0.01 0.00 -2.02 0.00 0.00 63.50 61.56 1unn n PRO 20 Cb 0.00 -1.50 0.12 0.00 -0.02 0.00 0.00 33.50 32.10 1unn n PRO 20 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1unn n LEU 21 N -1.11 2.79 -2.14 2.45 4.32 -1.26 -4.24 117.00 117.82 1unn n LEU 21 Ca 0.07 -1.42 -0.23 0.00 -0.02 0.00 0.00 56.01 54.40 1unn n LEU 21 Cb 0.05 -0.57 -0.01 0.00 -1.62 0.00 0.00 43.42 41.27 1unn n LEU 21 CO 0.06 0.42 -0.02 0.61 -1.22 0.00 0.00 177.39 177.25 1unn n GLY 22 N 0.17 -0.88 7.00 -0.72 0.00 -1.26 -4.75 105.19 104.76 1unn n GLY 22 Ca 0.11 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1unn n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1unn n GLY 23 N 0.98 1.15 3.81 -0.02 0.00 -1.26 -4.53 105.19 105.32 1unn n GLY 23 Ca 0.09 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 1unn n GLY 23 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1unn s ARG 24 N 0.00 4.28 0.55 1.61 3.52 -1.26 -5.09 118.95 122.56 1unn s ARG 24 Ca 0.00 0.88 -0.04 0.00 -0.13 0.00 0.00 55.73 56.43 1unn s ARG 24 Cb 0.00 -2.98 0.01 0.00 -1.56 0.00 0.00 34.95 30.41 1unn s ARG 24 CO 0.00 0.46 0.84 -1.25 -0.81 0.00 0.00 175.30 174.53 1unn s PRO 25 N -1.74 2.93 -0.24 5.12 0.04 -1.26 -5.02 135.00 134.82 1unn s PRO 25 Ca 0.40 -0.16 0.07 0.00 0.04 0.00 0.00 61.00 61.35 1unn s PRO 25 Cb -0.18 -2.35 -0.19 0.00 0.04 0.00 0.00 34.50 31.82 1unn s PRO 25 CO 0.21 -0.60 -0.13 0.25 0.04 0.00 0.00 177.00 176.77 1unn n THR 26 N -2.45 1.44 -4.80 1.26 -2.24 -1.26 -4.83 114.28 101.40 1unn n THR 26 Ca 0.04 -0.66 -0.33 0.00 -2.27 0.00 0.00 64.05 60.83 1unn n THR 26 Cb 0.58 -1.11 -0.13 0.00 -2.10 0.00 0.00 70.33 67.57 1unn n THR 26 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1unn s LEU 27 N -6.17 2.79 0.28 3.22 1.43 -1.26 -5.04 118.68 113.93 1unn s LEU 27 Ca -0.27 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 1unn s LEU 27 Cb 0.08 -1.60 0.63 0.00 0.03 0.00 0.00 46.19 45.33 1unn s LEU 27 CO 0.67 0.27 1.74 -0.65 0.23 0.00 0.00 176.35 178.61 1unn h PRO 28 N 5.92 0.56 0.00 1.29 0.11 -2.02 -0.70 132.00 137.15 1unn h PRO 28 Ca -0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1unn h PRO 28 Cb 1.18 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1unn h PRO 28 CO 0.53 0.37 0.00 0.97 -0.21 0.00 0.00 178.00 179.66 1unn h ILE 29 N 0.58 0.00 0.00 4.15 2.10 -1.96 -1.18 117.51 121.20 1unn h ILE 29 Ca 0.51 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 66.33 1unn h ILE 29 Cb 0.82 0.82 0.00 0.00 -1.09 0.00 0.00 36.82 37.36 1unn h ILE 29 CO -0.41 0.00 -0.03 0.18 -1.08 0.00 0.00 178.15 176.80 1unn n LEU 30 N -2.48 0.73 -0.77 2.19 4.32 -0.27 -0.84 117.00 119.88 1unn n LEU 30 Ca -0.00 0.55 0.10 0.00 -0.02 0.00 0.00 56.01 56.63 1unn n LEU 30 Cb 0.13 -0.33 0.29 0.00 -1.62 0.00 0.00 43.42 41.89 1unn n LEU 30 CO 0.16 -0.16 0.73 0.61 -1.22 0.00 0.00 177.39 177.52 1unn n GLY 31 N 1.33 0.84 3.85 -0.72 0.00 -0.45 -4.69 105.19 105.36 1unn n GLY 31 Ca 0.06 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.33 1unn n GLY 31 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1unn s ASN 32 N -1.40 5.70 -0.10 1.61 -0.87 -0.02 -0.97 114.94 118.89 1unn s ASN 32 Ca 0.33 -0.14 -0.04 0.00 -1.57 0.00 0.00 52.86 51.44 1unn s ASN 32 Cb 0.18 -1.52 -0.04 0.00 -0.02 0.00 0.00 41.25 39.86 1unn s ASN 32 CO 0.26 -0.01 0.08 -0.76 -2.57 0.00 0.00 177.10 174.10 1unn s LEU 33 N -3.65 4.01 -0.03 0.60 1.43 0.12 -4.63 118.68 116.53 1unn s LEU 33 Ca 0.33 0.31 -0.25 0.00 -1.03 0.00 0.00 54.13 53.48 1unn s LEU 33 Cb -0.09 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1unn s LEU 33 CO 0.25 0.39 0.78 -0.22 0.23 0.00 0.00 176.35 177.78 1unn s LEU 34 N -1.02 4.35 -0.09 1.79 2.96 0.26 -0.87 118.68 126.06 1unn s LEU 34 Ca 0.15 1.35 0.03 0.00 -0.22 0.00 0.00 54.13 55.44 1unn s LEU 34 Cb -0.12 -3.23 -0.02 0.00 0.50 0.00 0.00 46.19 43.32 1unn s LEU 34 CO 0.04 -0.14 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.00 1unn s LEU 35 N 0.75 2.49 -0.03 -0.68 1.02 0.12 -0.96 118.68 121.37 1unn s LEU 35 Ca 0.42 -0.36 0.00 0.00 0.02 0.00 0.00 54.13 54.20 1unn s LEU 35 Cb -0.19 -1.51 0.03 0.00 0.02 0.00 0.00 46.19 44.54 1unn s LEU 35 CO 0.21 0.23 0.00 -1.10 0.02 0.00 0.00 176.35 175.72 1unn s GLN 36 N -0.08 0.33 -0.22 1.70 -0.21 0.20 -1.46 119.66 119.93 1unn s GLN 36 Ca -0.04 0.08 -0.08 0.00 0.02 0.00 0.00 55.36 55.34 1unn s GLN 36 Cb -0.14 -0.54 -0.04 0.00 1.00 0.00 0.00 33.01 33.29 1unn s GLN 36 CO 0.04 -0.15 0.09 0.08 -2.12 0.00 0.00 175.29 173.23 1unn s VAL 37 N 1.13 4.83 -0.14 1.09 1.01 0.12 -0.31 120.40 128.13 1unn s VAL 37 Ca -0.08 -0.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.79 1unn s VAL 37 Cb -0.13 -3.22 0.05 0.00 0.00 0.00 0.00 36.38 33.07 1unn s VAL 37 CO -0.02 0.39 0.35 0.00 0.00 0.00 0.00 175.10 175.82 1unn s ALA 38 N 0.94 -0.87 0.00 5.51 0.00 -0.72 -1.55 121.76 125.08 1unn s ALA 38 Ca 0.05 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.19 1unn s ALA 38 Cb -0.14 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1unn s ALA 38 CO 0.03 -0.21 0.00 -3.47 0.00 0.00 0.00 175.76 172.11 1unn n ASP 39 N 3.65 0.00 -1.61 0.00 -0.08 -1.26 -1.21 116.55 116.04 1unn n ASP 39 Ca -0.19 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 52.96 1unn n ASP 39 Cb 0.56 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.21 1unn n ASP 39 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1unn n GLY 40 N 0.00 4.76 3.11 0.27 0.00 -1.26 -4.94 105.19 107.13 1unn n GLY 40 Ca 0.00 -1.18 -0.25 0.00 0.00 0.00 0.00 46.02 44.58 1unn n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1unn s THR 41 N -3.29 1.33 -0.22 2.61 2.01 -0.35 -0.17 115.64 117.55 1unn s THR 41 Ca 0.50 -0.66 -0.12 0.00 0.31 0.00 0.00 61.69 61.72 1unn s THR 41 Cb 0.44 -1.15 -0.05 0.00 0.01 0.00 0.00 72.50 71.76 1unn s THR 41 CO 0.04 0.39 0.20 -0.22 -0.69 0.00 0.00 174.62 174.34 1unn s LEU 42 N 0.05 4.14 -0.03 4.42 2.96 0.11 -1.75 118.68 128.59 1unn s LEU 42 Ca -0.03 0.22 -0.00 0.00 -0.22 0.00 0.00 54.13 54.09 1unn s LEU 42 Cb -0.11 -2.19 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 1unn s LEU 42 CO 0.02 0.06 0.03 -0.44 -1.32 0.00 0.00 176.35 174.70 1unn s SER 43 N 0.92 5.39 -0.07 3.68 0.01 0.58 0.23 113.70 124.43 1unn s SER 43 Ca 0.10 0.10 0.03 0.00 1.31 0.00 0.00 55.95 57.49 1unn s SER 43 Cb -0.13 -1.50 0.01 0.00 0.21 0.00 0.00 66.02 64.60 1unn s SER 43 CO 0.04 0.31 -0.16 -0.76 0.41 0.00 0.00 173.24 173.08 1unn s LEU 44 N -1.44 1.79 -0.06 2.44 2.01 -0.37 -0.63 118.68 122.43 1unn s LEU 44 Ca 0.19 -0.38 0.02 0.00 0.01 0.00 0.00 54.13 53.97 1unn s LEU 44 Cb -0.12 -1.01 0.02 0.00 0.01 0.00 0.00 46.19 45.09 1unn s LEU 44 CO 0.09 0.08 -0.11 -0.89 1.01 0.00 0.00 176.35 176.54 1unn s THR 45 N 0.52 1.01 -0.02 5.49 2.01 -0.14 -0.20 115.64 124.32 1unn s THR 45 Ca -0.15 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 61.49 1unn s THR 45 Cb -0.16 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 1unn s THR 45 CO 0.05 0.33 -0.13 -0.83 -0.69 0.00 0.00 174.62 173.35 1unn s GLY 46 N 0.74 1.60 0.02 4.40 0.00 -0.15 -0.58 107.32 113.35 1unn s GLY 46 Ca -0.13 -1.03 -0.06 0.00 0.00 0.00 0.00 44.72 43.49 1unn s GLY 46 CO 0.03 -0.87 0.11 -1.08 0.00 0.00 0.00 173.10 171.29 1unn s THR 47 N -0.85 0.10 -0.16 0.90 -1.32 -1.26 -0.70 115.64 112.35 1unn s THR 47 Ca 0.14 -0.86 0.14 0.00 -1.21 0.00 0.00 61.69 59.90 1unn s THR 47 Cb -0.11 -0.59 0.36 0.00 -1.51 0.00 0.00 72.50 70.65 1unn s THR 47 CO 0.03 -0.47 1.18 -0.90 -2.21 0.00 0.00 174.62 172.25 1unn n ASP 48 N 1.20 1.90 0.00 8.08 5.68 -0.92 -4.69 116.55 127.79 1unn n ASP 48 Ca -0.21 -3.46 0.00 0.00 -0.50 0.00 0.00 54.79 50.62 1unn n ASP 48 Cb 0.57 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 40.07 1unn n ASP 48 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1unn n LEU 49 N -1.16 0.00 -0.01 -2.12 4.77 -1.26 -4.64 117.00 112.59 1unn n LEU 49 Ca 0.17 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.13 1unn n LEU 49 Cb 0.69 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.66 1unn n LEU 49 CO -0.02 0.00 -0.55 -0.62 -1.33 0.00 0.00 177.39 174.87 1unn n GLU 50 N -1.38 0.64 -4.01 3.23 -0.58 -1.26 -4.96 120.64 112.32 1unn n GLU 50 Ca 0.00 0.13 -0.10 0.00 -0.42 0.00 0.00 57.16 56.78 1unn n GLU 50 Cb 0.00 -1.71 -0.05 0.00 -0.57 0.00 0.00 31.44 29.10 1unn n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1unn s MET 51 N -2.87 1.58 0.01 3.49 0.23 -1.26 -1.20 119.30 119.28 1unn s MET 51 Ca -0.05 -1.32 -0.22 0.00 -1.03 0.00 0.00 55.69 53.07 1unn s MET 51 Cb 0.09 0.46 0.05 0.00 -1.53 0.00 0.00 34.83 33.90 1unn s MET 51 CO 0.83 -0.65 0.50 -1.83 -2.03 0.00 0.00 175.02 171.83 1unn s GLU 52 N -3.90 0.95 -0.05 3.16 -1.05 0.45 -2.18 118.70 116.09 1unn s GLU 52 Ca 0.24 -0.13 0.04 0.00 -0.15 0.00 0.00 54.97 54.96 1unn s GLU 52 Cb -0.00 0.43 -0.00 0.00 -0.44 0.00 0.00 34.13 34.12 1unn s GLU 52 CO 0.10 -0.32 -0.17 1.41 0.95 0.00 0.00 175.26 177.24 1unn s MET 53 N -1.94 1.78 -0.06 -4.83 -2.45 0.12 -1.04 119.30 110.89 1unn s MET 53 Ca -0.08 -0.59 0.03 0.00 -1.25 0.00 0.00 55.69 53.79 1unn s MET 53 Cb -0.01 -1.54 0.01 0.00 1.25 0.00 0.00 34.83 34.54 1unn s MET 53 CO 0.02 0.22 -0.13 0.08 1.05 0.00 0.00 175.02 176.26 1unn s VAL 54 N 0.09 1.20 0.10 10.11 1.01 0.12 -0.98 120.40 132.06 1unn s VAL 54 Ca -0.05 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1unn s VAL 54 Cb -0.12 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1unn s VAL 54 CO 0.02 0.37 -0.15 0.00 0.00 0.00 0.00 175.10 175.34 1unn s ALA 55 N 0.53 2.76 -0.06 5.51 0.00 0.72 -0.22 121.76 131.00 1unn s ALA 55 Ca -0.13 -1.29 0.04 0.00 0.00 0.00 0.00 51.96 50.59 1unn s ALA 55 Cb -0.15 -0.75 -0.02 0.00 0.00 0.00 0.00 23.12 22.21 1unn s ALA 55 CO 0.04 0.61 -0.19 1.03 0.00 0.00 0.00 175.76 177.24 1unn s ARG 56 N -2.05 2.58 -0.08 0.00 0.52 -0.30 -1.23 118.95 118.39 1unn s ARG 56 Ca 0.18 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.63 1unn s ARG 56 Cb -0.11 -2.31 0.01 0.00 0.52 0.00 0.00 34.95 33.07 1unn s ARG 56 CO 0.10 0.49 -0.14 0.08 0.02 0.00 0.00 175.30 175.86 1unn s VAL 57 N -0.41 1.29 0.24 3.52 1.01 0.14 -4.88 120.40 121.30 1unn s VAL 57 Ca 0.04 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 1unn s VAL 57 Cb -0.12 -1.17 -0.09 0.00 0.00 0.00 0.00 36.38 35.00 1unn s VAL 57 CO 0.02 0.39 1.22 0.00 0.00 0.00 0.00 175.10 176.73 1unn s ALA 58 N 0.69 3.46 -0.35 5.51 0.00 -1.26 0.06 121.76 129.87 1unn s ALA 58 Ca -0.14 1.03 -0.10 0.00 0.00 0.00 0.00 51.96 52.75 1unn s ALA 58 Cb -0.16 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.56 1unn s ALA 58 CO 0.03 -0.41 0.18 -0.51 0.00 0.00 0.00 175.76 175.06 1unn s LEU 59 N -0.76 4.50 -0.00 0.00 1.43 0.75 -4.84 118.68 119.75 1unn s LEU 59 Ca 0.51 -0.83 0.20 0.00 -1.03 0.00 0.00 54.13 52.97 1unn s LEU 59 Cb -0.35 -2.01 -0.21 0.00 0.03 0.00 0.00 46.19 43.65 1unn s LEU 59 CO 0.41 -0.32 0.58 0.55 0.23 0.00 0.00 176.35 177.80 1unn n VAL 60 N 4.99 0.74 -2.30 -1.59 3.14 -1.26 -4.82 118.33 117.23 1unn n VAL 60 Ca -0.12 -0.64 -0.30 0.00 -2.96 0.00 0.00 64.34 60.32 1unn n VAL 60 Cb 0.47 -0.37 -0.00 0.00 -1.06 0.00 0.00 33.84 32.88 1unn n VAL 60 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1unn s GLN 61 N -3.10 3.64 0.40 1.45 -0.21 -1.26 -5.04 119.66 115.52 1unn s GLN 61 Ca -0.06 0.55 -0.24 0.00 0.02 0.00 0.00 55.36 55.63 1unn s GLN 61 Cb 0.10 -2.22 -0.12 0.00 1.00 0.00 0.00 33.01 31.77 1unn s GLN 61 CO 0.85 -0.35 0.89 -2.30 -2.12 0.00 0.00 175.29 172.25 1unn n PRO 62 N -2.30 1.13 -3.77 2.91 -0.02 -1.26 -4.77 135.00 126.92 1unn n PRO 62 Ca 0.04 0.40 -0.09 0.00 -2.02 0.00 0.00 63.50 61.84 1unn n PRO 62 Cb 0.54 -1.86 -0.03 0.00 -0.02 0.00 0.00 33.50 32.13 1unn n PRO 62 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1unn s HIS 63 N -1.28 -0.19 -0.01 6.00 -3.43 -1.26 -3.68 115.29 111.44 1unn s HIS 63 Ca 0.63 -0.19 0.00 0.00 -0.80 0.00 0.00 55.06 54.70 1unn s HIS 63 Cb -0.60 0.57 0.01 0.00 -1.43 0.00 0.00 32.58 31.14 1unn s HIS 63 CO 0.57 -1.08 -0.00 -1.21 -2.00 0.00 0.00 174.74 171.02 1unn s GLU 64 N -3.89 0.13 0.74 -0.38 2.02 -0.07 -4.93 118.70 112.32 1unn s GLU 64 Ca 0.10 0.01 -0.11 0.00 0.02 0.00 0.00 54.97 54.99 1unn s GLU 64 Cb -0.04 -0.21 0.04 0.00 0.10 0.00 0.00 34.13 34.02 1unn s GLU 64 CO 0.02 -0.04 1.08 -1.25 0.02 0.00 0.00 175.26 175.09 1unn s PRO 65 N 0.36 2.55 0.00 0.39 0.04 -1.26 -0.69 135.00 136.39 1unn s PRO 65 Ca -0.03 0.99 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1unn s PRO 65 Cb -0.05 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1unn s PRO 65 CO -0.01 -1.39 0.00 0.41 0.04 0.00 0.00 177.00 176.06 1unn n GLY 66 N -1.71 -0.43 3.38 0.56 0.00 -0.59 -3.38 105.19 103.02 1unn n GLY 66 Ca 0.08 -1.65 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 1unn n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1unn s ALA 67 N -1.24 -1.25 0.23 4.61 0.00 -1.26 0.14 121.76 122.98 1unn s ALA 67 Ca 0.00 0.53 -0.21 0.00 0.00 0.00 0.00 51.96 52.28 1unn s ALA 67 Cb 0.00 0.38 0.07 0.00 0.00 0.00 0.00 23.12 23.57 1unn s ALA 67 CO 0.00 -0.50 0.98 -0.08 0.00 0.00 0.00 175.76 176.16 1unn s THR 68 N -2.48 0.00 0.08 0.00 -1.32 -0.53 -4.55 115.64 106.84 1unn s THR 68 Ca -0.05 -0.68 0.08 0.00 -1.21 0.00 0.00 61.69 59.83 1unn s THR 68 Cb -0.01 -2.85 -0.03 0.00 -1.51 0.00 0.00 72.50 68.10 1unn s THR 68 CO -0.02 0.00 -0.21 0.42 -2.21 0.00 0.00 174.62 172.60 1unn s THR 69 N -2.24 1.69 0.03 5.08 -4.23 -0.87 0.11 115.64 115.21 1unn s THR 69 Ca 0.20 -1.40 -0.02 0.00 -1.18 0.00 0.00 61.69 59.29 1unn s THR 69 Cb -0.03 -1.51 -0.02 0.00 1.34 0.00 0.00 72.50 72.27 1unn s THR 69 CO 0.07 0.05 0.00 0.68 -0.54 0.00 0.00 174.62 174.88 1unn s VAL 70 N -1.01 0.15 0.03 2.29 -7.23 -0.05 -2.00 120.40 112.60 1unn s VAL 70 Ca 0.07 -1.27 -0.34 0.00 -1.81 0.00 0.00 61.98 58.63 1unn s VAL 70 Cb -0.09 -0.86 -0.12 0.00 0.56 0.00 0.00 36.38 35.86 1unn s VAL 70 CO 0.03 -0.70 1.77 -2.65 -0.31 0.00 0.00 175.10 173.24 1unn n PRO 71 N 0.87 2.27 0.09 4.82 -0.02 -1.26 0.14 135.00 141.91 1unn n PRO 71 Ca -0.19 0.83 -0.13 0.00 -2.02 0.00 0.00 63.50 61.99 1unn n PRO 71 Cb 0.58 -2.65 -0.08 0.00 -0.02 0.00 0.00 33.50 31.32 1unn n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1unn h ALA 72 N 7.97 -0.26 -0.68 3.55 0.00 -1.35 -2.27 119.26 126.23 1unn h ALA 72 Ca -0.47 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.20 1unn h ALA 72 Cb 1.26 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 1unn h ALA 72 CO 0.93 -0.43 0.28 -0.09 0.00 0.00 0.00 179.25 179.94 1unn h ARG 73 N -0.70 1.00 -0.50 0.00 9.65 -1.90 -0.78 114.38 121.15 1unn h ARG 73 Ca -0.03 -0.17 -0.09 0.00 -1.10 0.00 0.00 59.98 58.59 1unn h ARG 73 Cb 0.49 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.88 1unn h ARG 73 CO 0.04 0.82 -0.04 0.87 2.80 0.00 0.00 179.97 184.47 1unn h LYS 74 N 0.95 0.91 -0.66 0.20 1.57 -1.94 0.16 116.57 117.77 1unn h LYS 74 Ca 0.23 -0.31 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1unn h LYS 74 Cb 0.19 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1unn h LYS 74 CO -0.02 0.96 0.44 0.35 -0.57 0.00 0.00 179.45 180.60 1unn h PHE 75 N 0.77 0.83 -0.43 -1.35 3.57 -1.21 0.56 116.94 119.69 1unn h PHE 75 Ca 0.14 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 1unn h PHE 75 Cb 0.57 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1unn h PHE 75 CO 0.04 0.52 0.14 0.35 -2.23 0.00 0.00 178.31 177.14 1unn h PHE 76 N 0.90 0.68 0.00 0.41 3.57 -0.95 -1.54 116.94 120.00 1unn h PHE 76 Ca 0.24 -0.06 -0.08 0.00 3.53 0.00 0.00 57.97 61.60 1unn h PHE 76 Cb -0.10 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.43 1unn h PHE 76 CO -0.03 0.61 -0.38 -0.44 -2.23 0.00 0.00 178.31 175.85 1unn h ASP 77 N 0.55 0.00 -0.07 0.41 3.32 -0.31 0.27 116.42 120.59 1unn h ASP 77 Ca 0.14 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 1unn h ASP 77 Cb 0.24 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1unn h ASP 77 CO -0.01 0.38 -0.07 0.40 -1.72 0.00 0.00 179.24 178.22 1unn h ILE 78 N 0.00 1.36 -0.44 0.35 2.04 -0.57 -0.17 117.51 120.08 1unn h ILE 78 Ca -0.00 -1.21 0.03 0.00 1.00 0.00 0.00 64.86 64.68 1unn h ILE 78 Cb 0.67 2.00 -0.03 0.00 -0.74 0.00 0.00 36.82 38.72 1unn h ILE 78 CO 0.05 0.34 0.24 0.00 0.00 0.00 0.00 178.15 178.77 1unn h ARG 80 N 0.47 0.32 0.00 0.00 2.43 -0.39 -2.47 114.38 114.74 1unn h ARG 80 Ca 0.18 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1unn h ARG 80 Cb 0.07 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1unn h ARG 80 CO -0.11 0.37 -0.21 0.41 -1.51 0.00 0.00 179.97 178.92 1unn n GLY 81 N -1.05 -1.57 3.77 2.80 0.00 -0.08 -4.77 105.19 104.28 1unn n GLY 81 Ca 0.00 -0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1unn n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1unn s LEU 82 N -4.16 3.38 0.51 0.99 1.43 -0.63 -4.97 118.68 115.22 1unn s LEU 82 Ca 0.10 2.03 -0.22 0.00 -1.03 0.00 0.00 54.13 55.00 1unn s LEU 82 Cb 0.14 -4.55 -0.06 0.00 0.03 0.00 0.00 46.19 41.74 1unn s LEU 82 CO 0.63 -1.68 1.25 -2.16 0.23 0.00 0.00 176.35 174.62 1unn s PRO 83 N -4.08 3.44 0.15 1.29 0.04 -1.26 -4.89 135.00 129.69 1unn s PRO 83 Ca 0.67 1.98 -0.32 0.00 0.04 0.00 0.00 61.00 63.37 1unn s PRO 83 Cb -0.21 -2.31 -0.17 0.00 0.04 0.00 0.00 34.50 31.85 1unn s PRO 83 CO 0.42 -0.87 0.91 -1.91 0.04 0.00 0.00 177.00 175.59 1unn n GLU 84 N -0.79 0.52 -0.75 4.56 4.07 -1.26 -1.21 120.64 125.78 1unn n GLU 84 Ca 0.09 0.18 0.00 0.00 -0.06 0.00 0.00 57.16 57.37 1unn n GLU 84 Cb 0.47 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.35 1unn n GLU 84 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1unn n GLY 85 N 1.81 0.84 3.76 8.31 0.00 -1.26 -5.02 105.19 113.63 1unn n GLY 85 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1unn n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1unn s ALA 86 N -3.30 2.65 -0.28 4.61 0.00 -0.35 -4.72 121.76 120.38 1unn s ALA 86 Ca 0.00 1.06 -0.12 0.00 0.00 0.00 0.00 51.96 52.89 1unn s ALA 86 Cb 0.00 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 1unn s ALA 86 CO 0.00 -1.12 0.24 -1.21 0.00 0.00 0.00 175.76 173.67 1unn s GLU 87 N -3.16 3.94 -0.31 0.00 0.41 -1.26 -0.61 118.70 117.71 1unn s GLU 87 Ca 0.74 -0.24 -0.10 0.00 -0.41 0.00 0.00 54.97 54.96 1unn s GLU 87 Cb -0.32 -3.67 -0.01 0.00 -1.78 0.00 0.00 34.13 28.35 1unn s GLU 87 CO 0.36 -0.22 0.16 0.42 -0.49 0.00 0.00 175.26 175.48 1unn s ILE 88 N 1.84 4.66 -0.22 -1.63 1.01 0.84 -4.44 121.20 123.27 1unn s ILE 88 Ca 0.09 -0.36 -0.12 0.00 0.00 0.00 0.00 60.65 60.25 1unn s ILE 88 Cb -0.16 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 1unn s ILE 88 CO 0.11 0.09 0.24 0.00 0.00 0.00 0.00 174.94 175.37 1unn s ALA 89 N 1.63 3.60 -0.05 9.38 0.00 0.13 -0.97 121.76 135.47 1unn s ALA 89 Ca 0.05 -0.72 0.05 0.00 0.00 0.00 0.00 51.96 51.33 1unn s ALA 89 Cb -0.17 -2.40 -0.00 0.00 0.00 0.00 0.00 23.12 20.55 1unn s ALA 89 CO 0.07 -0.15 -0.19 0.08 0.00 0.00 0.00 175.76 175.56 1unn s VAL 90 N 0.98 1.60 -0.11 0.00 1.01 0.89 -0.58 120.40 124.19 1unn s VAL 90 Ca 0.12 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 1unn s VAL 90 Cb -0.13 -1.38 0.03 0.00 0.00 0.00 0.00 36.38 34.90 1unn s VAL 90 CO 0.05 0.46 0.35 0.00 0.00 0.00 0.00 175.10 175.95 1unn s GLN 91 N 0.06 0.45 -0.00 2.72 -2.07 -0.20 -0.85 119.66 119.78 1unn s GLN 91 Ca -0.06 0.38 -0.26 0.00 -1.82 0.00 0.00 55.36 53.60 1unn s GLN 91 Cb -0.13 0.22 -0.04 0.00 -1.09 0.00 0.00 33.01 31.97 1unn s GLN 91 CO 0.03 -0.07 0.81 -1.17 -1.32 0.00 0.00 175.29 173.57 1unn s LEU 92 N -0.05 4.39 -0.36 2.60 2.96 -0.28 -0.69 118.68 127.25 1unn s LEU 92 Ca -0.02 1.43 0.00 0.00 -0.22 0.00 0.00 54.13 55.33 1unn s LEU 92 Cb -0.03 -3.29 0.14 0.00 0.50 0.00 0.00 46.19 43.51 1unn s LEU 92 CO 0.01 -0.11 0.21 -0.70 -1.32 0.00 0.00 176.35 174.45 1unn s GLU 93 N 0.52 0.62 7.71 1.98 2.56 0.13 -4.57 118.70 127.65 1unn s GLU 93 Ca 0.42 -1.40 0.00 0.00 0.00 0.00 0.00 54.97 53.99 1unn s GLU 93 Cb -0.20 -1.40 0.00 0.00 2.00 0.00 0.00 34.13 34.53 1unn s GLU 93 CO 0.23 -1.21 0.00 0.41 -0.56 0.00 0.00 175.26 174.13 1unn n GLY 94 N 3.98 3.23 0.66 -1.50 0.00 -1.26 -1.81 105.19 108.50 1unn n GLY 94 Ca 0.12 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 46.04 1unn n GLY 94 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1unn n GLU 95 N 13.58 1.87 -4.30 1.61 -0.58 -1.26 -4.85 120.64 126.72 1unn n GLU 95 Ca 0.00 -1.19 -0.24 0.00 -0.42 0.00 0.00 57.16 55.31 1unn n GLU 95 Cb 0.00 -1.33 -0.13 0.00 -0.57 0.00 0.00 31.44 29.42 1unn n GLU 95 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1unn s ARG 96 N -1.59 1.16 -0.19 3.49 1.81 -0.75 -2.60 118.95 120.27 1unn s ARG 96 Ca 0.22 -1.19 -0.03 0.00 -1.72 0.00 0.00 55.73 53.00 1unn s ARG 96 Cb 0.12 -1.45 -0.02 0.00 -0.45 0.00 0.00 34.95 33.16 1unn s ARG 96 CO 0.14 0.34 -0.05 1.41 -0.68 0.00 0.00 175.30 176.46 1unn s MET 97 N -1.95 3.48 -0.02 3.54 -2.45 -0.10 0.22 119.30 122.02 1unn s MET 97 Ca 0.08 -0.59 -0.21 0.00 -1.25 0.00 0.00 55.69 53.71 1unn s MET 97 Cb -0.10 -2.95 -0.05 0.00 1.25 0.00 0.00 34.83 32.98 1unn s MET 97 CO 0.05 -0.01 0.62 -0.51 1.05 0.00 0.00 175.02 176.22 1unn s LEU 98 N 1.00 4.39 -0.07 4.11 1.43 0.14 -0.75 118.68 128.93 1unn s LEU 98 Ca 0.00 1.17 0.02 0.00 -1.03 0.00 0.00 54.13 54.30 1unn s LEU 98 Cb -0.15 -2.97 0.01 0.00 0.03 0.00 0.00 46.19 43.12 1unn s LEU 98 CO 0.00 0.05 -0.14 -0.69 0.23 0.00 0.00 176.35 175.80 1unn s VAL 99 N 0.06 1.26 0.00 -1.59 1.01 0.48 -1.03 120.40 120.59 1unn s VAL 99 Ca 0.33 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.77 1unn s VAL 99 Cb -0.18 -1.15 -0.00 0.00 0.00 0.00 0.00 36.38 35.05 1unn s VAL 99 CO 0.17 0.39 -0.02 -0.13 0.00 0.00 0.00 175.10 175.51 1unn s ARG 100 N 0.69 0.18 -0.27 2.72 0.52 0.26 -0.93 118.95 122.13 1unn s ARG 100 Ca -0.14 -0.11 -0.16 0.00 -0.52 0.00 0.00 55.73 54.80 1unn s ARG 100 Cb -0.16 -0.16 0.08 0.00 0.52 0.00 0.00 34.95 35.23 1unn s ARG 100 CO 0.04 0.04 0.66 0.45 0.02 0.00 0.00 175.30 176.50 1unn s SER 101 N -0.14 -0.88 1.56 0.23 0.15 -0.68 -0.69 113.70 113.24 1unn s SER 101 Ca -0.00 1.44 0.00 0.00 0.70 0.00 0.00 55.95 58.08 1unn s SER 101 Cb -0.01 1.32 0.00 0.00 -1.71 0.00 0.00 66.02 65.61 1unn s SER 101 CO -0.00 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.81 1unn n GLY 102 N 4.22 2.79 1.59 9.45 0.00 -1.26 -0.94 105.19 121.04 1unn n GLY 102 Ca -0.20 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 1unn n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1unn n ARG 103 N 13.56 2.56 -3.97 1.61 1.74 -1.26 -4.93 116.66 125.98 1unn n ARG 103 Ca 0.00 -3.57 -0.35 0.00 -0.77 0.00 0.00 57.85 53.16 1unn n ARG 103 Cb 0.00 -2.03 -0.09 0.00 -1.02 0.00 0.00 32.46 29.32 1unn n ARG 103 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1unn s SER 104 N -2.88 5.84 0.00 0.55 0.01 -0.11 -5.11 113.70 112.00 1unn s SER 104 Ca 0.49 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.94 1unn s SER 104 Cb 0.42 -1.96 -0.00 0.00 0.21 0.00 0.00 66.02 64.69 1unn s SER 104 CO 0.00 0.24 -0.02 -0.13 0.41 0.00 0.00 173.24 173.74 1unn s ARG 105 N -0.01 0.16 0.01 12.44 0.52 -1.26 -1.69 118.95 129.12 1unn s ARG 105 Ca 0.07 -0.16 -0.02 0.00 -0.52 0.00 0.00 55.73 55.10 1unn s ARG 105 Cb -0.12 -0.10 -0.01 0.00 0.52 0.00 0.00 34.95 35.25 1unn s ARG 105 CO 0.01 0.02 0.03 -0.06 0.02 0.00 0.00 175.30 175.32 1unn s PHE 106 N -0.28 0.14 -0.13 -0.53 0.40 -0.11 -4.98 117.98 112.49 1unn s PHE 106 Ca -0.02 -0.29 -0.00 0.00 -0.60 0.00 0.00 56.93 56.02 1unn s PHE 106 Cb -0.02 -0.11 0.02 0.00 0.51 0.00 0.00 43.02 43.42 1unn s PHE 106 CO -0.00 -0.19 -0.10 0.45 0.70 0.00 0.00 175.22 176.08 1unn s SER 107 N -1.15 2.45 0.17 1.36 0.15 -1.26 -0.39 113.70 115.03 1unn s SER 107 Ca -0.13 -0.41 0.06 0.00 0.70 0.00 0.00 55.95 56.18 1unn s SER 107 Cb -0.07 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 63.20 1unn s SER 107 CO -0.00 -0.09 0.05 -0.76 1.20 0.00 0.00 173.24 173.64 1unn s LEU 108 N 1.60 3.51 0.53 3.45 1.43 0.07 -4.89 118.68 124.38 1unn s LEU 108 Ca 0.05 -0.28 -0.18 0.00 -1.03 0.00 0.00 54.13 52.69 1unn s LEU 108 Cb -0.13 -2.15 -0.06 0.00 0.03 0.00 0.00 46.19 43.88 1unn s LEU 108 CO -0.09 0.09 1.04 -0.94 0.23 0.00 0.00 176.35 176.67 1unn s SER 109 N -2.97 6.17 0.28 2.29 1.04 -1.26 -0.92 113.70 118.33 1unn s SER 109 Ca 0.29 1.82 0.06 0.00 0.48 0.00 0.00 55.95 58.60 1unn s SER 109 Cb -0.10 -2.54 -0.06 0.00 0.10 0.00 0.00 66.02 63.42 1unn s SER 109 CO 0.20 -0.90 -0.05 0.42 0.98 0.00 0.00 173.24 173.89 1unn s THR 110 N -2.27 1.61 0.03 2.02 -4.23 -1.07 -4.12 115.64 107.61 1unn s THR 110 Ca 0.64 -2.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.06 1unn s THR 110 Cb -0.15 -2.47 -0.02 0.00 1.34 0.00 0.00 72.50 71.20 1unn s THR 110 CO 0.28 -0.28 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.23 1unn s LEU 111 N -3.44 2.19 0.34 4.79 1.43 -0.85 -4.97 118.68 118.17 1unn s LEU 111 Ca 0.30 -0.44 -0.29 0.00 -1.03 0.00 0.00 54.13 52.67 1unn s LEU 111 Cb 0.04 -0.27 -0.11 0.00 0.03 0.00 0.00 46.19 45.88 1unn s LEU 111 CO 0.12 -0.10 1.51 -2.84 0.23 0.00 0.00 176.35 175.27 1unn s PRO 112 N -1.21 4.13 0.28 1.29 0.02 -1.26 -2.05 135.00 136.20 1unn s PRO 112 Ca -0.05 2.55 0.03 0.00 0.02 0.00 0.00 61.00 63.54 1unn s PRO 112 Cb -0.08 -3.00 0.64 0.00 0.02 0.00 0.00 34.50 32.09 1unn s PRO 112 CO 0.01 -0.55 1.77 0.00 -0.33 0.00 0.00 177.00 177.89 1unn h ALA 113 N 3.70 1.48 0.00 -1.55 0.00 -1.84 -1.09 119.26 119.96 1unn h ALA 113 Ca -0.49 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1unn h ALA 113 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1unn h ALA 113 CO 0.70 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.87 1unn h ALA 114 N 1.61 1.00 -0.01 0.00 0.00 -1.93 0.33 119.26 120.27 1unn h ALA 114 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1unn h ALA 114 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1unn h ALA 114 CO -0.38 0.00 -0.21 -0.25 0.00 0.00 0.00 179.25 178.41 1unn n ASP 115 N -2.98 1.08 -4.76 0.00 8.00 -0.41 -4.90 116.55 112.58 1unn n ASP 115 Ca -0.01 -0.98 -0.39 0.00 0.71 0.00 0.00 54.79 54.11 1unn n ASP 115 Cb 0.17 0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.31 1unn n ASP 115 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1unn s PHE 116 N -2.41 3.89 0.09 1.24 5.36 0.12 -4.95 117.98 121.31 1unn s PHE 116 Ca 0.27 1.87 -0.31 0.00 -0.96 0.00 0.00 56.93 57.80 1unn s PHE 116 Cb 0.20 -3.00 -0.09 0.00 -0.34 0.00 0.00 43.02 39.78 1unn s PHE 116 CO 0.49 0.30 1.76 -2.14 -1.46 0.00 0.00 175.22 174.16 1unn s PRO 117 N -1.37 4.16 -0.34 10.12 0.02 -1.26 -4.97 135.00 141.36 1unn s PRO 117 Ca 0.43 2.48 -0.05 0.00 0.02 0.00 0.00 61.00 63.88 1unn s PRO 117 Cb -0.25 -3.62 0.05 0.00 0.02 0.00 0.00 34.50 30.69 1unn s PRO 117 CO 0.31 -0.80 0.09 0.54 -0.33 0.00 0.00 177.00 176.82 1unn s ASN 118 N 2.66 5.22 -0.04 2.53 4.22 -1.26 -5.04 114.94 123.22 1unn s ASN 118 Ca 0.78 -1.27 -0.35 0.00 -2.14 0.00 0.00 52.86 49.88 1unn s ASN 118 Cb -0.43 -1.83 -0.13 0.00 1.28 0.00 0.00 41.25 40.13 1unn s ASN 118 CO 0.35 -0.34 1.73 0.18 -2.04 0.00 0.00 177.10 176.97 1unn n LEU 119 N 4.75 2.99 -4.79 3.54 4.32 -1.26 -4.89 117.00 121.66 1unn n LEU 119 Ca -0.12 1.03 -0.31 0.00 -0.02 0.00 0.00 56.01 56.59 1unn n LEU 119 Cb 0.44 -1.33 0.06 0.00 -1.62 0.00 0.00 43.42 40.98 1unn n LEU 119 CO 0.31 -0.28 0.71 -0.62 -1.22 0.00 0.00 177.39 176.29 1unn s ASP 120 N 2.83 5.05 0.41 -1.43 -1.08 -1.26 -4.97 116.67 116.21 1unn s ASP 120 Ca 0.89 1.76 -0.25 0.00 -0.52 0.00 0.00 52.55 54.44 1unn s ASP 120 Cb -0.78 -2.51 -0.11 0.00 -1.46 0.00 0.00 42.92 38.06 1unn s ASP 120 CO 0.50 -1.67 1.04 0.47 0.52 0.00 0.00 175.17 176.04 1unn n ASP 121 N -3.10 1.43 -3.64 -0.34 8.00 -1.26 -5.02 116.55 112.61 1unn n ASP 121 Ca 0.09 1.05 -0.11 0.00 0.71 0.00 0.00 54.79 56.53 1unn n ASP 121 Cb 0.53 -1.37 -0.05 0.00 -0.02 0.00 0.00 41.12 40.21 1unn n ASP 121 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1unn s TRP 122 N -1.25 -0.21 -0.11 1.24 1.48 -1.26 -5.14 118.94 113.68 1unn s TRP 122 Ca 0.63 -0.07 -0.04 0.00 -1.06 0.00 0.00 56.10 55.56 1unn s TRP 122 Cb -0.56 0.25 -0.04 0.00 -1.16 0.00 0.00 33.47 31.96 1unn s TRP 122 CO 0.57 -0.68 0.04 1.14 -4.06 0.00 0.00 176.95 173.96 1unn s GLN 123 N -3.59 3.23 0.41 3.25 -2.07 -1.26 -5.07 119.66 114.57 1unn s GLN 123 Ca 0.02 -0.34 -0.26 0.00 -1.82 0.00 0.00 55.36 52.95 1unn s GLN 123 Cb 0.01 -2.94 -0.09 0.00 -1.09 0.00 0.00 33.01 28.90 1unn s GLN 123 CO -0.10 0.65 1.41 0.45 -1.32 0.00 0.00 175.29 176.38 1unn s SER 124 N -0.72 6.15 -0.10 12.60 0.15 -1.26 -4.27 113.70 126.24 1unn s SER 124 Ca 0.12 2.88 0.12 0.00 0.70 0.00 0.00 55.95 59.77 1unn s SER 124 Cb -0.12 -2.65 -0.17 0.00 -1.71 0.00 0.00 66.02 61.37 1unn s SER 124 CO 0.02 -0.98 0.10 -0.62 1.20 0.00 0.00 173.24 172.96 1unn n GLU 125 N 0.11 1.61 -3.90 5.44 1.02 0.37 -4.90 120.64 120.38 1unn n GLU 125 Ca 0.03 -0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 57.02 1unn n GLU 125 Cb 0.41 -1.33 -0.14 0.00 -0.02 0.00 0.00 31.44 30.37 1unn n GLU 125 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1unn s VAL 126 N -2.44 0.05 0.03 2.62 1.01 -0.51 -4.99 120.40 116.17 1unn s VAL 126 Ca -0.06 -0.02 -0.10 0.00 0.00 0.00 0.00 61.98 61.80 1unn s VAL 126 Cb 0.05 -0.05 0.01 0.00 0.00 0.00 0.00 36.38 36.38 1unn s VAL 126 CO 0.54 0.02 0.21 -1.83 0.00 0.00 0.00 175.10 174.03 1unn s GLU 127 N 0.00 0.65 0.05 2.72 -1.05 -1.26 -0.43 118.70 119.39 1unn s GLU 127 Ca 0.00 -0.52 -0.25 0.00 -0.15 0.00 0.00 54.97 54.05 1unn s GLU 127 Cb -0.00 0.27 0.06 0.00 -0.44 0.00 0.00 34.13 34.02 1unn s GLU 127 CO -0.00 -0.18 0.60 -0.59 0.95 0.00 0.00 175.26 176.03 1unn s PHE 128 N -2.16 -0.54 0.03 4.83 -0.71 -0.39 -5.00 117.98 114.05 1unn s PHE 128 Ca -0.08 0.64 0.07 0.00 -1.04 0.00 0.00 56.93 56.52 1unn s PHE 128 Cb -0.03 0.44 -0.02 0.00 -1.21 0.00 0.00 43.02 42.19 1unn s PHE 128 CO -0.02 -0.70 -0.22 -0.08 -1.34 0.00 0.00 175.22 172.87 1unn s THR 129 N -2.47 1.74 0.20 -4.49 -1.32 -1.26 0.12 115.64 108.16 1unn s THR 129 Ca -0.05 -1.18 -0.17 0.00 -1.21 0.00 0.00 61.69 59.07 1unn s THR 129 Cb -0.01 -1.50 0.03 0.00 -1.51 0.00 0.00 72.50 69.51 1unn s THR 129 CO -0.02 0.27 0.53 -1.48 -2.21 0.00 0.00 174.62 171.72 1unn s LEU 130 N -1.08 0.06 0.35 9.08 2.34 -0.42 -4.97 118.68 124.04 1unn s LEU 130 Ca 0.08 -0.52 -0.29 0.00 0.06 0.00 0.00 54.13 53.47 1unn s LEU 130 Cb -0.09 2.16 -0.11 0.00 -0.56 0.00 0.00 46.19 47.59 1unn s LEU 130 CO 0.01 -1.08 1.48 -2.84 -1.06 0.00 0.00 176.35 172.87 1unn s PRO 131 N -3.89 4.15 0.29 1.48 0.02 -1.26 -0.32 135.00 135.48 1unn s PRO 131 Ca 0.10 2.52 0.03 0.00 0.02 0.00 0.00 61.00 63.67 1unn s PRO 131 Cb -0.01 -3.00 0.75 0.00 0.02 0.00 0.00 34.50 32.26 1unn s PRO 131 CO -0.01 -0.51 1.65 1.96 -0.33 0.00 0.00 177.00 179.76 1unn h GLN 132 N 3.55 0.21 -0.07 5.54 4.20 -1.79 -1.75 115.11 125.00 1unn h GLN 132 Ca -0.50 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.12 1unn h GLN 132 Cb 1.23 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.95 1unn h GLN 132 CO 0.68 0.14 -0.34 0.00 -0.67 0.00 0.00 178.83 178.65 1unn h ALA 133 N 1.79 1.31 -0.28 3.87 0.00 -1.90 -0.05 119.26 124.00 1unn h ALA 133 Ca 0.57 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1unn h ALA 133 Cb 1.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1unn h ALA 133 CO -0.65 0.49 0.10 1.15 0.00 0.00 0.00 179.25 180.34 1unn h THR 134 N 0.12 1.19 -0.90 0.00 2.02 -1.70 -0.56 112.91 113.08 1unn h THR 134 Ca 0.01 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 1unn h THR 134 Cb 0.66 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 68.07 1unn h THR 134 CO 0.05 0.20 0.55 -0.03 0.37 0.00 0.00 175.52 176.66 1unn h MET 135 N 0.30 1.21 -0.54 6.66 -1.53 -1.08 -0.55 114.93 119.41 1unn h MET 135 Ca 0.09 -0.11 -0.12 0.00 -3.44 0.00 0.00 59.70 56.13 1unn h MET 135 Cb 0.21 -0.26 -0.02 0.00 -0.55 0.00 0.00 31.60 30.99 1unn h MET 135 CO -0.01 0.85 -0.12 -0.22 0.14 0.00 0.00 176.91 177.55 1unn h LYS 136 N 1.23 1.04 -0.36 0.39 3.64 -0.89 0.75 116.57 122.38 1unn h LYS 136 Ca 0.32 -0.39 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1unn h LYS 136 Cb -0.06 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1unn h LYS 136 CO -0.06 1.09 0.16 -0.09 -2.27 0.00 0.00 179.45 178.27 1unn h ARG 137 N 0.92 0.53 -0.43 1.90 1.12 -0.59 0.12 114.38 117.94 1unn h ARG 137 Ca 0.14 -0.09 0.06 0.00 -1.11 0.00 0.00 59.98 58.98 1unn h ARG 137 Cb 0.70 -0.09 -0.05 0.00 -0.01 0.00 0.00 29.97 30.52 1unn h ARG 137 CO 0.05 0.50 0.14 -0.07 -3.11 0.00 0.00 179.97 177.48 1unn h LEU 138 N 0.43 0.13 -0.16 3.80 3.38 -0.73 -1.56 115.31 120.60 1unn h LEU 138 Ca 0.12 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 1unn h LEU 138 Cb 0.16 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1unn h LEU 138 CO -0.01 0.11 -0.32 0.40 0.09 0.00 0.00 178.44 178.70 1unn h ILE 139 N 0.30 1.35 -0.14 1.22 2.04 -0.52 -3.22 117.51 118.54 1unn h ILE 139 Ca 0.20 -1.57 0.00 0.00 1.00 0.00 0.00 64.86 64.49 1unn h ILE 139 Cb 0.21 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1unn h ILE 139 CO -0.22 0.47 0.09 -0.33 0.00 0.00 0.00 178.15 178.16 1unn h GLU 140 N 0.14 0.18 0.00 2.37 5.08 -0.74 0.34 114.58 121.96 1unn h GLU 140 Ca 0.01 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1unn h GLU 140 Cb 0.92 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1unn h GLU 140 CO 0.07 0.13 -0.23 0.00 -1.00 0.00 0.00 179.01 177.97 1unn h ALA 141 N 1.91 1.19 0.00 3.43 0.00 -1.29 -3.34 119.26 121.16 1unn h ALA 141 Ca 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1unn h ALA 141 Cb -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1unn h ALA 141 CO -0.01 0.29 -0.40 2.41 0.00 0.00 0.00 179.25 181.54 1unn n THR 142 N -3.65 0.00 -0.01 0.00 -1.04 -0.53 -4.78 114.28 104.27 1unn n THR 142 Ca -0.01 -0.20 0.08 0.00 -2.04 0.00 0.00 64.05 61.88 1unn n THR 142 Cb 0.36 0.70 0.49 0.00 -1.82 0.00 0.00 70.33 70.06 1unn n THR 142 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 1unn h GLN 143 N 0.00 0.40 0.00 -2.82 4.15 -0.50 -0.71 115.11 115.63 1unn h GLN 143 Ca 0.00 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.39 1unn h GLN 143 Cb 0.00 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1unn h GLN 143 CO 0.00 0.27 -0.00 0.27 -1.93 0.00 0.00 178.83 177.43 1unn h PHE 144 N 0.42 0.00 -0.04 3.99 -0.00 -1.83 -1.51 116.94 117.96 1unn h PHE 144 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.16 1unn h PHE 144 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.19 1unn h PHE 144 CO -0.00 0.00 0.00 0.43 -0.00 0.00 0.00 178.31 178.74 1unn n SER 145 N -3.10 1.39 -4.77 -0.68 7.64 -0.27 -4.90 113.62 108.92 1unn n SER 145 Ca -0.01 -1.50 -0.38 0.00 1.01 0.00 0.00 58.87 57.99 1unn n SER 145 Cb 0.18 -0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.36 1unn n SER 145 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1unn s MET 146 N -1.96 3.81 0.84 1.43 -1.94 -0.57 -2.03 119.30 118.87 1unn s MET 146 Ca 0.38 1.90 -0.11 0.00 -1.71 0.00 0.00 55.69 56.15 1unn s MET 146 Cb 0.20 -2.52 0.10 0.00 2.01 0.00 0.00 34.83 34.62 1unn s MET 146 CO 0.32 -0.55 1.09 0.00 -0.01 0.00 0.00 175.02 175.88 1unn s ALA 147 N -1.44 1.88 -0.17 3.03 0.00 -0.84 -4.75 121.76 119.46 1unn s ALA 147 Ca 0.62 0.08 -0.16 0.00 0.00 0.00 0.00 51.96 52.49 1unn s ALA 147 Cb -0.32 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.52 1unn s ALA 147 CO 0.39 -2.08 -0.32 0.72 0.00 0.00 0.00 175.76 174.47 1unn n HIS 148 N -3.71 0.12 -2.74 0.00 8.25 -1.26 -4.32 115.22 111.55 1unn n HIS 148 Ca 0.08 0.05 -0.03 0.00 -0.26 0.00 0.00 57.72 57.56 1unn n HIS 148 Cb 0.54 -0.52 0.05 0.00 1.12 0.00 0.00 29.99 31.17 1unn n HIS 148 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1unn n GLN 149 N -4.43 1.88 -2.04 -0.41 6.02 -1.26 -4.85 117.38 112.29 1unn n GLN 149 Ca -0.13 -3.56 -0.41 0.00 -0.01 0.00 0.00 57.00 52.89 1unn n GLN 149 Cb 0.48 -1.65 -0.02 0.00 1.02 0.00 0.00 30.24 30.07 1unn n GLN 149 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1unn s ASP 150 N -3.74 6.67 0.56 1.08 -1.08 -1.26 -4.88 116.67 114.02 1unn s ASP 150 Ca 0.30 2.78 0.25 0.00 -0.52 0.00 0.00 52.55 55.35 1unn s ASP 150 Cb 0.34 -2.65 1.54 0.00 -1.46 0.00 0.00 42.92 40.69 1unn s ASP 150 CO -0.03 -0.62 2.12 -0.37 0.52 0.00 0.00 175.17 176.80 1unn h VAL 151 N 3.02 0.66 -0.92 1.11 -1.51 -2.03 -3.28 116.25 113.31 1unn h VAL 151 Ca -0.49 0.00 -0.50 0.00 -1.23 0.00 0.00 66.70 64.48 1unn h VAL 151 Cb 1.23 0.89 -0.08 0.00 -2.13 0.00 0.00 31.29 31.20 1unn h VAL 151 CO 0.65 0.00 1.32 -0.13 -1.23 0.00 0.00 177.57 178.18 1unn s ARG 152 N -4.81 3.24 0.57 5.19 0.52 -1.26 -4.81 118.95 117.59 1unn s ARG 152 Ca -0.05 -0.97 0.26 0.00 -0.52 0.00 0.00 55.73 54.45 1unn s ARG 152 Cb 0.16 -5.28 1.58 0.00 0.52 0.00 0.00 34.95 31.94 1unn s ARG 152 CO 0.61 -2.70 2.15 0.10 0.02 0.00 0.00 175.30 175.48 1unn h TYR 153 N 9.99 0.00 0.00 -0.53 -0.00 -1.95 0.06 116.97 124.55 1unn h TYR 153 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.93 1unn h TYR 153 Cb 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.72 1unn h TYR 153 CO 1.27 0.00 0.00 2.48 -0.00 0.00 0.00 178.16 181.91 1unn n TYR 154 N -4.06 0.64 0.53 0.10 0.18 -1.26 -1.98 117.16 111.31 1unn n TYR 154 Ca 0.00 0.23 0.13 0.00 1.88 0.00 0.00 57.90 60.13 1unn n TYR 154 Cb 0.23 -0.87 0.29 0.00 -0.38 0.00 0.00 39.34 38.60 1unn n TYR 154 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1unn h LEU 155 N 0.00 0.00 -4.63 -3.48 3.38 -1.30 -3.39 115.31 105.88 1unn h LEU 155 Ca 0.00 -0.06 -0.47 0.00 0.09 0.00 0.00 57.88 57.44 1unn h LEU 155 Cb 0.44 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.09 1unn h LEU 155 CO 0.00 0.03 1.07 0.59 0.09 0.00 0.00 178.44 180.22 1unn n ASN 156 N -2.35 6.73 0.00 -0.43 5.03 -0.84 -2.00 115.26 121.41 1unn n ASN 156 Ca 0.04 -2.85 0.00 0.00 0.87 0.00 0.00 54.58 52.64 1unn n ASN 156 Cb 0.45 -1.37 0.00 0.00 -1.02 0.00 0.00 39.78 37.84 1unn n ASN 156 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1unn n GLY 157 N 2.00 -0.87 2.95 7.41 0.00 -1.26 -1.25 105.19 114.17 1unn n GLY 157 Ca 0.54 -0.74 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1unn n GLY 157 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1unn s MET 158 N -0.24 0.67 0.16 1.61 1.75 0.72 -4.66 119.30 119.32 1unn s MET 158 Ca 0.00 -0.20 -0.26 0.00 -1.25 0.00 0.00 55.69 53.98 1unn s MET 158 Cb 0.00 -0.66 -0.08 0.00 2.84 0.00 0.00 34.83 36.93 1unn s MET 158 CO 0.00 0.07 0.80 -1.17 -0.65 0.00 0.00 175.02 174.07 1unn s LEU 159 N 0.23 4.59 -0.17 4.11 2.96 0.11 -1.02 118.68 129.48 1unn s LEU 159 Ca -0.03 1.67 0.01 0.00 -0.22 0.00 0.00 54.13 55.56 1unn s LEU 159 Cb -0.07 -3.34 0.01 0.00 0.50 0.00 0.00 46.19 43.29 1unn s LEU 159 CO -0.00 0.17 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.66 1unn s PHE 160 N -1.00 2.77 -0.02 5.38 0.40 0.99 -1.39 117.98 125.11 1unn s PHE 160 Ca 0.37 -1.42 0.04 0.00 -0.60 0.00 0.00 56.93 55.32 1unn s PHE 160 Cb -0.23 -1.91 -0.00 0.00 0.51 0.00 0.00 43.02 41.38 1unn s PHE 160 CO 0.27 -0.69 -0.13 -2.00 0.70 0.00 0.00 175.22 173.37 1unn s GLU 161 N 1.13 1.24 0.08 0.44 2.12 -0.13 -0.88 118.70 122.70 1unn s GLU 161 Ca 0.01 -0.47 0.10 0.00 0.36 0.00 0.00 54.97 54.96 1unn s GLU 161 Cb -0.14 -1.15 -0.03 0.00 0.26 0.00 0.00 34.13 33.07 1unn s GLU 161 CO -0.08 0.23 -0.25 0.95 -0.54 0.00 0.00 175.26 175.57 1unn s THR 162 N -0.09 2.28 -0.19 -1.70 -4.23 0.21 0.56 115.64 112.48 1unn s THR 162 Ca 0.01 -1.50 -0.30 0.00 -1.18 0.00 0.00 61.69 58.72 1unn s THR 162 Cb -0.08 -1.94 0.14 0.00 1.34 0.00 0.00 72.50 71.96 1unn s THR 162 CO 0.00 0.26 1.09 -1.83 -0.54 0.00 0.00 174.62 173.60 1unn s GLU 163 N -1.58 0.46 7.61 3.99 4.04 -0.77 -1.67 118.70 130.78 1unn s GLU 163 Ca 0.13 0.10 0.00 0.00 0.04 0.00 0.00 54.97 55.24 1unn s GLU 163 Cb -0.10 0.22 0.00 0.00 0.02 0.00 0.00 34.13 34.27 1unn s GLU 163 CO 0.04 -0.15 0.00 0.41 -1.84 0.00 0.00 175.26 173.72 1unn n GLY 164 N 0.63 3.80 0.64 -3.83 0.00 -1.25 -0.44 105.19 104.75 1unn n GLY 164 Ca -0.07 0.20 0.07 0.00 0.00 0.00 0.00 46.02 46.22 1unn n GLY 164 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1unn n GLU 165 N 11.27 2.07 -4.45 1.61 1.02 -1.26 0.46 120.64 131.35 1unn n GLU 165 Ca 0.00 -2.86 -0.32 0.00 -0.02 0.00 0.00 57.16 53.96 1unn n GLU 165 Cb 0.00 -1.71 -0.10 0.00 -0.02 0.00 0.00 31.44 29.61 1unn n GLU 165 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1unn s GLU 166 N -2.96 2.53 -0.04 3.49 2.56 0.42 -0.14 118.70 124.56 1unn s GLU 166 Ca 0.39 -0.73 0.06 0.00 0.00 0.00 0.00 54.97 54.68 1unn s GLU 166 Cb 0.34 -2.49 -0.02 0.00 2.00 0.00 0.00 34.13 33.95 1unn s GLU 166 CO 0.04 0.60 -0.22 -1.17 -0.56 0.00 0.00 175.26 173.95 1unn s LEU 167 N -1.44 2.28 0.04 2.70 2.96 -0.05 -1.85 118.68 123.32 1unn s LEU 167 Ca 0.17 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.71 1unn s LEU 167 Cb -0.11 -1.42 -0.02 0.00 0.50 0.00 0.00 46.19 45.14 1unn s LEU 167 CO 0.08 0.30 -0.09 -0.60 -1.32 0.00 0.00 176.35 174.72 1unn s ARG 168 N -0.49 0.60 0.07 1.98 3.52 0.19 -0.85 118.95 123.98 1unn s ARG 168 Ca 0.06 -0.71 0.10 0.00 -0.13 0.00 0.00 55.73 55.05 1unn s ARG 168 Cb -0.11 -0.46 -0.03 0.00 -1.56 0.00 0.00 34.95 32.78 1unn s ARG 168 CO 0.01 0.10 -0.26 0.95 -0.81 0.00 0.00 175.30 175.29 1unn s THR 169 N -1.13 2.22 -0.00 4.11 -4.23 0.03 -0.95 115.64 115.68 1unn s THR 169 Ca -0.06 -1.50 0.02 0.00 -1.18 0.00 0.00 61.69 58.97 1unn s THR 169 Cb -0.09 -1.91 -0.01 0.00 1.34 0.00 0.00 72.50 71.84 1unn s THR 169 CO 0.01 0.28 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.61 1unn s VAL 170 N -0.89 0.49 -0.05 2.29 1.01 -0.48 -1.45 120.40 121.32 1unn s VAL 170 Ca 0.13 -0.28 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1unn s VAL 170 Cb -0.10 -0.42 0.01 0.00 0.00 0.00 0.00 36.38 35.87 1unn s VAL 170 CO 0.04 0.13 0.13 0.00 0.00 0.00 0.00 175.10 175.40 1unn s ALA 171 N -0.16 -0.32 -0.04 5.51 0.00 -0.35 0.04 121.76 126.44 1unn s ALA 171 Ca 0.02 0.34 -0.17 0.00 0.00 0.00 0.00 51.96 52.15 1unn s ALA 171 Cb -0.02 -0.20 0.03 0.00 0.00 0.00 0.00 23.12 22.93 1unn s ALA 171 CO -0.00 -0.07 0.38 -0.08 0.00 0.00 0.00 175.76 175.99 1unn s THR 172 N -0.01 0.04 -0.07 0.00 -1.32 -1.10 -0.83 115.64 112.36 1unn s THR 172 Ca -0.01 -0.34 0.10 0.00 -1.21 0.00 0.00 61.69 60.24 1unn s THR 172 Cb -0.01 -0.67 0.16 0.00 -1.51 0.00 0.00 72.50 70.46 1unn s THR 172 CO 0.00 -0.18 1.05 -0.90 -2.21 0.00 0.00 174.62 172.37 1unn n ASP 173 N 1.43 1.70 0.00 8.08 5.68 -0.85 -3.02 116.55 129.56 1unn n ASP 173 Ca -0.20 -2.52 0.00 0.00 -0.50 0.00 0.00 54.79 51.57 1unn n ASP 173 Cb 0.56 -0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.27 1unn n ASP 173 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1unn n GLY 174 N -0.89 2.76 0.09 6.12 0.00 -1.26 -4.72 105.19 107.30 1unn n GLY 174 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1unn n GLY 174 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1unn n HIS 175 N -2.00 0.00 -3.81 1.61 8.25 -1.26 -4.93 115.22 113.08 1unn n HIS 175 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 1unn n HIS 175 Cb 0.00 -0.86 -0.04 0.00 1.12 0.00 0.00 29.99 30.21 1unn n HIS 175 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1unn s ARG 176 N -2.43 1.38 0.01 -0.41 3.03 -1.26 -1.15 118.95 118.12 1unn s ARG 176 Ca -0.14 -0.97 -0.01 0.00 2.03 0.00 0.00 55.73 56.64 1unn s ARG 176 Cb 0.06 0.49 -0.01 0.00 -1.03 0.00 0.00 34.95 34.46 1unn s ARG 176 CO 0.66 -0.57 -0.00 -1.17 -1.13 0.00 0.00 175.30 173.09 1unn s LEU 177 N -2.91 2.11 -0.01 -1.89 0.20 0.79 -2.01 118.68 114.97 1unn s LEU 177 Ca 0.12 -0.35 0.04 0.00 0.69 0.00 0.00 54.13 54.63 1unn s LEU 177 Cb -0.00 0.14 -0.01 0.00 -0.43 0.00 0.00 46.19 45.89 1unn s LEU 177 CO -0.01 -0.24 -0.12 0.00 -0.29 0.00 0.00 176.35 175.69 1unn s ALA 178 N -1.12 1.02 -0.04 5.97 0.00 -0.01 -0.81 121.76 126.76 1unn s ALA 178 Ca -0.12 -0.54 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 1unn s ALA 178 Cb -0.08 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.81 1unn s ALA 178 CO -0.01 0.25 0.10 0.54 0.00 0.00 0.00 175.76 176.65 1unn s VAL 179 N -0.31 -0.03 0.00 0.00 0.11 -0.32 -1.22 120.40 118.64 1unn s VAL 179 Ca 0.05 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.19 1unn s VAL 179 Cb -0.05 -0.17 -0.00 0.00 -1.53 0.00 0.00 36.38 34.63 1unn s VAL 179 CO -0.00 0.04 -0.00 0.00 -3.33 0.00 0.00 175.10 171.80 1unn s SER 181 N -0.09 0.14 0.02 0.00 1.04 0.14 -0.79 113.70 114.16 1unn s SER 181 Ca -0.01 -0.31 0.01 0.00 0.48 0.00 0.00 55.95 56.12 1unn s SER 181 Cb -0.01 0.10 -0.01 0.00 0.10 0.00 0.00 66.02 66.20 1unn s SER 181 CO -0.00 -0.23 -0.05 -0.04 0.98 0.00 0.00 173.24 173.90 1unn s MET 182 N -1.04 0.38 0.23 4.02 -1.94 -0.03 -4.70 119.30 116.22 1unn s MET 182 Ca -0.11 -0.45 -0.30 0.00 -1.71 0.00 0.00 55.69 53.12 1unn s MET 182 Cb -0.07 -0.21 -0.09 0.00 2.01 0.00 0.00 34.83 36.48 1unn s MET 182 CO -0.00 0.04 1.04 -1.25 -0.01 0.00 0.00 175.02 174.83 1unn s PRO 183 N -0.90 4.71 -0.08 2.03 0.04 -1.26 -0.87 135.00 138.67 1unn s PRO 183 Ca -0.06 1.66 0.12 0.00 0.04 0.00 0.00 61.00 62.75 1unn s PRO 183 Cb -0.06 -3.25 0.18 0.00 0.04 0.00 0.00 34.50 31.40 1unn s PRO 183 CO -0.00 0.29 1.07 0.44 0.04 0.00 0.00 177.00 178.83 1unn n ILE 184 N 1.64 1.35 -2.41 0.56 -5.35 0.80 -4.93 119.36 111.02 1unn n ILE 184 Ca -0.00 -1.58 -0.09 0.00 -0.27 0.00 0.00 62.75 60.80 1unn n ILE 184 Cb 0.46 0.07 0.01 0.00 -1.74 0.00 0.00 39.64 38.44 1unn n ILE 184 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1unn n GLY 185 N -0.98 0.11 3.44 3.28 0.00 -1.25 -4.93 105.19 104.86 1unn n GLY 185 Ca 0.10 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 1unn n GLY 185 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1unn s GLN 186 N -4.78 1.21 -0.07 1.61 -2.07 -1.26 -5.12 119.66 109.17 1unn s GLN 186 Ca 0.08 -0.34 -0.30 0.00 -1.82 0.00 0.00 55.36 52.98 1unn s GLN 186 Cb -0.03 0.56 -0.02 0.00 -1.09 0.00 0.00 33.01 32.43 1unn s GLN 186 CO 0.09 -0.51 1.01 -1.12 -1.32 0.00 0.00 175.29 173.44 1unn s SER 187 N -2.47 7.27 0.19 12.60 0.01 -1.26 -4.14 113.70 125.91 1unn s SER 187 Ca -0.01 1.58 0.08 0.00 1.31 0.00 0.00 55.95 58.91 1unn s SER 187 Cb -0.01 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 1unn s SER 187 CO -0.09 -0.40 -0.02 -0.76 0.41 0.00 0.00 173.24 172.38 1unn s LEU 188 N 1.74 3.21 0.80 2.44 1.43 0.17 -5.00 118.68 123.47 1unn s LEU 188 Ca 0.50 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 53.00 1unn s LEU 188 Cb -0.19 -1.85 0.07 0.00 0.03 0.00 0.00 46.19 44.25 1unn s LEU 188 CO 0.21 0.08 1.09 -2.16 0.23 0.00 0.00 176.35 175.79 1unn s PRO 189 N -3.04 2.10 -0.36 1.29 0.04 -1.26 -3.75 135.00 130.02 1unn s PRO 189 Ca 0.27 0.78 -0.20 0.00 0.04 0.00 0.00 61.00 61.89 1unn s PRO 189 Cb -0.09 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1unn s PRO 189 CO 0.18 -1.64 0.61 -1.12 0.04 0.00 0.00 177.00 175.06 1unn s SER 190 N -3.75 6.39 0.06 6.66 0.01 -1.26 -3.88 113.70 117.94 1unn s SER 190 Ca 0.61 0.08 -0.26 0.00 1.31 0.00 0.00 55.95 57.68 1unn s SER 190 Cb -0.15 -2.31 0.07 0.00 0.21 0.00 0.00 66.02 63.83 1unn s SER 190 CO 0.55 -0.58 0.62 -2.28 0.41 0.00 0.00 173.24 171.96 1unn s HIS 191 N 2.64 -0.56 0.04 2.43 5.04 -0.67 -4.98 115.29 119.22 1unn s HIS 191 Ca 0.23 0.65 -0.21 0.00 -1.54 0.00 0.00 55.06 54.19 1unn s HIS 191 Cb -0.15 0.47 0.05 0.00 0.04 0.00 0.00 32.58 32.99 1unn s HIS 191 CO 0.15 -0.73 0.48 -1.54 -2.34 0.00 0.00 174.74 170.77 1unn s SER 192 N -2.04 -0.39 0.15 9.88 1.04 -1.26 -0.62 113.70 120.47 1unn s SER 192 Ca -0.04 0.15 -0.06 0.00 0.48 0.00 0.00 55.95 56.47 1unn s SER 192 Cb -0.01 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.56 1unn s SER 192 CO -0.03 -0.68 0.21 0.68 0.98 0.00 0.00 173.24 174.40 1unn s VAL 193 N -2.32 0.08 -0.18 5.02 -7.23 -0.06 -4.97 120.40 110.73 1unn s VAL 193 Ca -0.06 -1.56 -0.02 0.00 -1.81 0.00 0.00 61.98 58.53 1unn s VAL 193 Cb -0.01 -1.91 -0.01 0.00 0.56 0.00 0.00 36.38 35.02 1unn s VAL 193 CO -0.01 -0.35 -0.10 -0.63 -0.31 0.00 0.00 175.10 173.71 1unn s ILE 194 N -3.99 3.06 -0.17 -0.62 1.01 -1.26 -0.01 121.20 119.22 1unn s ILE 194 Ca 0.19 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 60.14 1unn s ILE 194 Cb 0.05 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 1unn s ILE 194 CO 0.01 0.48 0.11 -0.69 0.00 0.00 0.00 174.94 174.84 1unn s VAL 195 N 1.08 5.26 0.60 2.92 1.01 -0.19 -0.17 120.40 130.91 1unn s VAL 195 Ca 0.00 0.13 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 1unn s VAL 195 Cb -0.15 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 1unn s VAL 195 CO -0.02 0.50 1.26 -2.16 0.00 0.00 0.00 175.10 174.69 1unn s PRO 196 N -0.09 2.87 0.29 2.72 0.04 -1.26 -0.20 135.00 139.36 1unn s PRO 196 Ca 0.09 1.98 -0.01 0.00 0.04 0.00 0.00 61.00 63.10 1unn s PRO 196 Cb -0.12 -1.97 0.45 0.00 0.04 0.00 0.00 34.50 32.91 1unn s PRO 196 CO 0.00 -1.33 1.93 0.07 0.04 0.00 0.00 177.00 177.71 1unn h ARG 197 N 0.89 1.09 0.00 4.56 0.11 -1.49 0.16 114.38 119.70 1unn h ARG 197 Ca -0.51 -0.07 -0.07 0.00 0.10 0.00 0.00 59.98 59.43 1unn h ARG 197 Cb 1.31 -0.25 -0.01 0.00 1.11 0.00 0.00 29.97 32.14 1unn h ARG 197 CO 0.55 0.72 -0.36 0.87 0.10 0.00 0.00 179.97 181.85 1unn h LYS 198 N 1.12 0.00 -0.58 0.08 1.57 -1.90 -0.51 116.57 116.35 1unn h LYS 198 Ca 0.36 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 59.03 1unn h LYS 198 Cb 0.03 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1unn h LYS 198 CO -0.11 0.36 -0.06 0.78 -0.57 0.00 0.00 179.45 179.85 1unn h GLY 199 N 1.24 1.15 1.03 3.86 0.00 -1.10 -1.36 103.07 107.89 1unn h GLY 199 Ca -0.00 -0.89 -0.02 0.00 0.00 0.00 0.00 47.33 46.42 1unn h GLY 199 CO 0.05 0.82 0.48 -2.08 0.00 0.00 0.00 176.54 175.80 1unn h VAL 200 N 0.96 1.26 -0.51 4.60 2.07 -0.50 0.25 116.25 124.37 1unn h VAL 200 Ca 0.16 -0.64 -0.12 0.00 0.82 0.00 0.00 66.70 66.92 1unn h VAL 200 Cb 0.63 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1unn h VAL 200 CO 0.04 0.29 -0.14 0.40 0.02 0.00 0.00 177.57 178.18 1unn h ILE 201 N 1.23 1.27 -0.40 4.57 2.04 -0.89 -0.14 117.51 125.19 1unn h ILE 201 Ca 0.31 -1.29 -0.15 0.00 1.00 0.00 0.00 64.86 64.73 1unn h ILE 201 Cb 0.03 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1unn h ILE 201 CO -0.05 0.45 -0.34 -0.08 0.00 0.00 0.00 178.15 178.13 1unn h GLU 202 N 0.87 0.91 -0.60 2.37 4.57 -0.97 0.10 114.58 121.83 1unn h GLU 202 Ca 0.13 -0.45 0.01 0.00 -1.18 0.00 0.00 59.36 57.87 1unn h GLU 202 Cb 0.70 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.26 1unn h GLU 202 CO 0.05 1.10 0.40 1.25 -1.18 0.00 0.00 179.01 180.63 1unn h LEU 203 N 0.76 0.68 -1.36 1.64 5.85 -0.11 0.32 115.31 123.08 1unn h LEU 203 Ca 0.07 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.83 1unn h LEU 203 Cb 0.92 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 1unn h LEU 203 CO 0.09 0.49 0.48 0.24 -0.34 0.00 0.00 178.44 179.39 1unn h MET 204 N 0.80 0.77 -0.82 1.25 2.86 -0.38 -2.05 114.93 117.35 1unn h MET 204 Ca 0.22 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.86 1unn h MET 204 Cb -0.08 -0.17 -0.05 0.00 0.06 0.00 0.00 31.60 31.36 1unn h MET 204 CO -0.06 0.51 0.54 0.00 1.06 0.00 0.00 176.91 178.96 1unn h ARG 205 N 0.79 0.96 -0.05 1.72 2.47 0.21 -3.03 114.38 117.45 1unn h ARG 205 Ca 0.31 -0.06 -0.17 0.00 -1.26 0.00 0.00 59.98 58.80 1unn h ARG 205 Cb 0.21 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.30 1unn h ARG 205 CO -0.10 0.63 -0.72 1.98 0.56 0.00 0.00 179.97 182.32 1unn h MET 206 N 0.99 0.29 -6.06 0.04 4.05 -0.46 -3.44 114.93 110.34 1unn h MET 206 Ca 0.34 -0.24 -0.56 0.00 -0.28 0.00 0.00 59.70 58.95 1unn h MET 206 Cb 0.09 0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 30.89 1unn h MET 206 CO -0.11 0.89 0.04 -0.51 0.23 0.00 0.00 176.91 177.45 1unn s LEU 207 N -7.81 4.37 0.00 3.39 1.43 -0.99 -4.90 118.68 114.17 1unn s LEU 207 Ca -0.04 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 1unn s LEU 207 Cb 0.11 -3.00 0.00 0.00 0.03 0.00 0.00 46.19 43.32 1unn s LEU 207 CO 0.82 0.00 0.00 0.47 0.23 0.00 0.00 176.35 177.87 1unn n ASP 208 N 3.21 0.00 -4.72 2.29 8.00 -1.26 -4.94 116.55 119.12 1unn n ASP 208 Ca -0.04 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.05 1unn n ASP 208 Cb 0.51 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.57 1unn n ASP 208 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1unn s GLY 209 N -0.32 2.78 -0.27 0.44 0.00 -1.26 -4.91 107.32 103.77 1unn s GLY 209 Ca 0.00 0.32 0.11 0.00 0.00 0.00 0.00 44.72 45.16 1unn s GLY 209 CO 0.00 1.34 1.56 0.61 0.00 0.00 0.00 173.10 176.61 1unn n GLY 210 N 2.82 4.32 0.00 0.20 0.00 -1.26 -4.53 105.19 106.75 1unn n GLY 210 Ca 0.01 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1unn n GLY 210 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1unn n ASP 211 N -0.72 0.00 -4.60 1.61 10.43 -1.26 -4.49 116.55 117.51 1unn n ASP 211 Ca 0.33 0.48 -0.44 0.00 2.57 0.00 0.00 54.79 57.74 1unn n ASP 211 Cb 1.12 -0.10 -0.01 0.00 1.84 0.00 0.00 41.12 43.97 1unn n ASP 211 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1unn n ASN 212 N -0.81 1.36 -4.71 -2.24 3.02 -1.26 -4.79 115.26 105.82 1unn n ASN 212 Ca 0.00 1.14 -0.33 0.00 -0.03 0.00 0.00 54.58 55.37 1unn n ASN 212 Cb 0.00 -1.32 0.11 0.00 -0.61 0.00 0.00 39.78 37.97 1unn n ASN 212 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1unn s PRO 213 N -1.68 1.82 -0.23 3.52 0.04 -1.26 -3.89 135.00 133.31 1unn s PRO 213 Ca 0.59 1.59 -0.06 0.00 0.04 0.00 0.00 61.00 63.16 1unn s PRO 213 Cb -0.65 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.05 1unn s PRO 213 CO 0.60 -2.04 0.03 -1.17 0.04 0.00 0.00 177.00 174.46 1unn s LEU 214 N -5.73 3.34 -0.21 -3.56 2.96 0.56 -4.41 118.68 111.63 1unn s LEU 214 Ca 0.70 -0.21 -0.13 0.00 -0.22 0.00 0.00 54.13 54.26 1unn s LEU 214 Cb -0.25 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 1unn s LEU 214 CO 0.51 0.01 0.28 -0.60 -1.32 0.00 0.00 176.35 175.23 1unn s ARG 215 N 1.34 4.14 -0.09 1.98 3.52 -0.10 -1.30 118.95 128.45 1unn s ARG 215 Ca 0.05 -0.01 0.02 0.00 -0.13 0.00 0.00 55.73 55.65 1unn s ARG 215 Cb -0.15 -3.53 -0.02 0.00 -1.56 0.00 0.00 34.95 29.70 1unn s ARG 215 CO 0.02 0.03 -0.13 0.08 -0.81 0.00 0.00 175.30 174.49 1unn s VAL 216 N 1.11 3.11 -0.05 7.11 1.01 0.12 -0.11 120.40 132.70 1unn s VAL 216 Ca 0.14 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.50 1unn s VAL 216 Cb -0.14 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1unn s VAL 216 CO 0.06 0.56 -0.22 -1.10 0.00 0.00 0.00 175.10 174.40 1unn s GLN 217 N -0.24 2.44 -0.11 2.72 -0.21 0.98 -1.27 119.66 123.96 1unn s GLN 217 Ca 0.01 -0.85 0.02 0.00 0.02 0.00 0.00 55.36 54.57 1unn s GLN 217 Cb -0.13 -2.21 0.01 0.00 1.00 0.00 0.00 33.01 31.69 1unn s GLN 217 CO 0.03 0.50 -0.17 0.42 -2.12 0.00 0.00 175.29 173.95 1unn s ILE 218 N -0.44 1.62 0.38 1.08 1.01 0.43 -0.21 121.20 125.07 1unn s ILE 218 Ca 0.05 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 60.04 1unn s ILE 218 Cb -0.12 -1.46 0.06 0.00 0.01 0.00 0.00 42.46 40.96 1unn s ILE 218 CO 0.01 0.46 0.52 0.61 0.00 0.00 0.00 174.94 176.55 1unn n GLY 219 N 4.10 1.95 0.33 6.18 0.00 0.93 0.14 105.19 118.82 1unn n GLY 219 Ca -0.19 -2.19 -0.03 0.00 0.00 0.00 0.00 46.02 43.60 1unn n GLY 219 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1unn h SER 220 N 0.06 0.97 0.00 1.61 0.87 -1.96 -3.34 113.55 111.77 1unn h SER 220 Ca -0.18 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 1unn h SER 220 Cb 0.81 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 1unn h SER 220 CO 0.25 0.70 0.00 0.59 -0.53 0.00 0.00 176.83 177.84 1unn n ASN 221 N -4.50 1.13 -3.79 6.23 4.13 -1.26 -4.96 115.26 112.24 1unn n ASN 221 Ca 0.10 -1.51 -0.10 0.00 1.68 0.00 0.00 54.58 54.75 1unn n ASN 221 Cb 0.03 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.20 1unn n ASN 221 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1unn s ASN 222 N -0.51 -0.03 0.08 6.41 -0.87 -1.25 -1.39 114.94 117.38 1unn s ASN 222 Ca 0.00 -0.39 0.07 0.00 -1.57 0.00 0.00 52.86 50.97 1unn s ASN 222 Cb 0.00 0.35 -0.03 0.00 -0.02 0.00 0.00 41.25 41.55 1unn s ASN 222 CO 0.00 -0.67 -0.18 -0.51 -2.57 0.00 0.00 177.10 173.17 1unn s ILE 223 N -3.13 1.45 -0.00 0.60 2.07 -0.20 -0.05 121.20 121.94 1unn s ILE 223 Ca -0.01 -1.36 0.00 0.00 -1.41 0.00 0.00 60.65 57.88 1unn s ILE 223 Cb 0.01 -1.33 0.00 0.00 0.13 0.00 0.00 42.46 41.28 1unn s ILE 223 CO -0.07 -0.07 -0.00 -0.60 -1.91 0.00 0.00 174.94 172.29 1unn s ARG 224 N -1.67 0.08 -0.05 3.50 3.52 0.71 -0.70 118.95 124.34 1unn s ARG 224 Ca 0.03 -0.00 0.02 0.00 -0.13 0.00 0.00 55.73 55.66 1unn s ARG 224 Cb -0.10 -0.12 0.01 0.00 -1.56 0.00 0.00 34.95 33.18 1unn s ARG 224 CO 0.03 -0.01 -0.11 0.00 -0.81 0.00 0.00 175.30 174.40 1unn s ALA 225 N 0.18 1.13 -0.11 6.12 0.00 0.14 -0.02 121.76 129.21 1unn s ALA 225 Ca -0.01 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.59 1unn s ALA 225 Cb -0.03 -0.48 -0.00 0.00 0.00 0.00 0.00 23.12 22.61 1unn s ALA 225 CO -0.01 0.13 -0.22 -1.58 0.00 0.00 0.00 175.76 174.08 1unn s HIS 226 N 0.49 2.60 -0.06 0.00 2.46 0.84 -0.49 115.29 121.14 1unn s HIS 226 Ca -0.10 -1.01 -0.02 0.00 0.47 0.00 0.00 55.06 54.40 1unn s HIS 226 Cb -0.13 -1.73 0.03 0.00 -0.13 0.00 0.00 32.58 30.61 1unn s HIS 226 CO 0.02 -0.40 0.05 0.08 -2.47 0.00 0.00 174.74 172.03 1unn s VAL 227 N 0.37 -0.03 0.00 0.89 1.01 -0.61 -0.92 120.40 121.10 1unn s VAL 227 Ca -0.17 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1unn s VAL 227 Cb -0.18 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 35.95 1unn s VAL 227 CO 0.08 0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1unn n GLY 228 N 5.27 4.06 1.53 4.51 0.00 -1.26 -0.66 105.19 118.64 1unn n GLY 228 Ca -0.04 0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.12 1unn n GLY 228 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1unn n ASP 229 N 7.35 5.00 -4.52 1.61 8.00 -1.26 -4.94 116.55 127.79 1unn n ASP 229 Ca 0.00 -3.00 -0.30 0.00 0.71 0.00 0.00 54.79 52.20 1unn n ASP 229 Cb 0.00 -0.64 -0.11 0.00 -0.02 0.00 0.00 41.12 40.35 1unn n ASP 229 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1unn s PHE 230 N -2.82 2.66 -0.05 1.24 0.08 0.17 -1.15 117.98 118.10 1unn s PHE 230 Ca 0.50 -0.19 -0.02 0.00 0.12 0.00 0.00 56.93 57.34 1unn s PHE 230 Cb 0.39 -1.46 0.04 0.00 -0.57 0.00 0.00 43.02 41.42 1unn s PHE 230 CO 0.13 0.35 0.09 0.42 -0.10 0.00 0.00 175.22 176.11 1unn s ILE 231 N -1.06 -0.15 -0.15 0.64 1.01 0.70 -1.58 121.20 120.61 1unn s ILE 231 Ca 0.18 0.38 -0.05 0.00 0.00 0.00 0.00 60.65 61.15 1unn s ILE 231 Cb -0.11 -0.19 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 1unn s ILE 231 CO 0.09 0.16 0.02 0.12 0.00 0.00 0.00 174.94 175.33 1unn s PHE 232 N 2.07 3.18 -0.02 3.97 5.36 0.36 0.13 117.98 133.03 1unn s PHE 232 Ca 0.03 -0.00 0.02 0.00 -0.96 0.00 0.00 56.93 56.02 1unn s PHE 232 Cb -0.12 -1.98 0.00 0.00 -0.34 0.00 0.00 43.02 40.58 1unn s PHE 232 CO -0.04 0.18 -0.07 0.99 -1.46 0.00 0.00 175.22 174.82 1unn s THR 233 N 0.07 0.61 0.08 0.12 2.01 -0.20 0.27 115.64 118.60 1unn s THR 233 Ca 0.03 -0.29 0.03 0.00 0.31 0.00 0.00 61.69 61.78 1unn s THR 233 Cb -0.13 -0.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 1unn s THR 233 CO 0.02 0.19 -0.10 -0.55 -0.69 0.00 0.00 174.62 173.49 1unn s SER 234 N 0.12 1.32 0.88 3.53 0.15 0.13 -0.41 113.70 119.41 1unn s SER 234 Ca -0.01 -0.74 -0.11 0.00 0.70 0.00 0.00 55.95 55.79 1unn s SER 234 Cb -0.06 0.01 0.12 0.00 -1.71 0.00 0.00 66.02 64.38 1unn s SER 234 CO -0.00 -0.24 1.10 -0.54 1.20 0.00 0.00 173.24 174.76 1unn s LYS 235 N -2.44 1.40 0.41 5.44 1.02 -0.34 -1.03 119.74 124.19 1unn s LYS 235 Ca 0.01 1.07 0.08 0.00 0.02 0.00 0.00 55.97 57.15 1unn s LYS 235 Cb -0.05 -1.81 -0.02 0.00 -0.52 0.00 0.00 37.83 35.44 1unn s LYS 235 CO 0.00 -2.21 0.39 -0.51 -0.92 0.00 0.00 175.35 172.09 1unn s LEU 236 N -6.26 3.45 -0.14 3.17 1.43 -0.49 -4.35 118.68 115.49 1unn s LEU 236 Ca 0.64 -0.68 -0.06 0.00 -1.03 0.00 0.00 54.13 53.00 1unn s LEU 236 Cb -0.19 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 1unn s LEU 236 CO 0.57 -0.63 0.06 -0.69 0.23 0.00 0.00 176.35 175.90 1unn s VAL 237 N -2.44 4.78 0.85 -1.59 1.01 0.76 -4.92 120.40 118.84 1unn s VAL 237 Ca 0.48 -0.05 -0.12 0.00 0.00 0.00 0.00 61.98 62.29 1unn s VAL 237 Cb -0.04 -3.09 0.10 0.00 0.00 0.00 0.00 36.38 33.34 1unn s VAL 237 CO 0.28 0.54 1.10 -1.81 0.00 0.00 0.00 175.10 175.21 1unn s ASP 238 N -0.31 4.02 0.00 3.32 1.11 -1.26 -4.29 116.67 119.25 1unn s ASP 238 Ca 0.08 1.34 0.00 0.00 0.18 0.00 0.00 52.55 54.15 1unn s ASP 238 Cb -0.12 -2.04 0.00 0.00 1.07 0.00 0.00 42.92 41.83 1unn s ASP 238 CO 0.02 -2.27 0.00 0.61 1.18 0.00 0.00 175.17 174.70 1unn n GLY 239 N -1.75 2.28 3.50 0.21 0.00 -1.26 -4.41 105.19 103.77 1unn n GLY 239 Ca 0.07 -2.12 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 1unn n GLY 239 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1unn s ARG 240 N -1.99 3.55 0.47 1.61 6.06 -1.26 -5.00 118.95 122.40 1unn s ARG 240 Ca 0.00 -0.59 -0.20 0.00 -2.50 0.00 0.00 55.73 52.45 1unn s ARG 240 Cb 0.00 -3.64 -0.09 0.00 0.06 0.00 0.00 34.95 31.28 1unn s ARG 240 CO 0.00 -0.35 1.00 0.12 -2.50 0.00 0.00 175.30 173.57 1unn s PHE 241 N 1.68 3.16 0.58 5.12 2.19 -1.26 -4.99 117.98 124.46 1unn s PHE 241 Ca 0.06 1.58 -0.20 0.00 0.33 0.00 0.00 56.93 58.70 1unn s PHE 241 Cb -0.17 -2.96 -0.04 0.00 -1.31 0.00 0.00 43.02 38.54 1unn s PHE 241 CO 0.08 -0.53 1.21 -2.30 1.83 0.00 0.00 175.22 175.51 1unn n PRO 242 N -0.95 1.30 -3.26 10.12 -0.02 -1.26 -4.95 135.00 135.97 1unn n PRO 242 Ca 0.08 0.49 -0.41 0.00 -2.02 0.00 0.00 63.50 61.64 1unn n PRO 242 Cb 0.53 -2.41 -0.08 0.00 -0.02 0.00 0.00 33.50 31.52 1unn n PRO 242 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1unn s ASP 243 N -1.11 6.34 0.48 2.55 -1.08 -1.26 -4.91 116.67 117.67 1unn s ASP 243 Ca 0.75 0.14 0.16 0.00 -0.52 0.00 0.00 52.55 53.08 1unn s ASP 243 Cb -0.42 -2.26 1.14 0.00 -1.46 0.00 0.00 42.92 39.92 1unn s ASP 243 CO 0.47 -0.40 2.05 0.10 0.52 0.00 0.00 175.17 177.91 1unn h TYR 244 N 8.32 0.00 -0.23 -5.34 -0.00 -1.99 -0.37 116.97 117.37 1unn h TYR 244 Ca -0.29 0.00 0.07 0.00 0.00 0.00 0.00 58.73 58.51 1unn h TYR 244 Cb 1.13 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.85 1unn h TYR 244 CO 0.73 0.12 0.19 0.00 -0.00 0.00 0.00 178.16 179.20 1unn h ARG 245 N 0.00 0.00 0.00 0.10 3.08 -1.95 0.75 114.38 116.35 1unn h ARG 245 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1unn h ARG 245 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1unn h ARG 245 CO 0.02 0.00 -0.83 0.00 -1.07 0.00 0.00 179.97 178.09 1unn h ARG 246 N 0.00 0.00 0.15 0.04 2.47 -1.48 -3.32 114.38 112.24 1unn h ARG 246 Ca 0.11 0.00 -0.31 0.00 -1.26 0.00 0.00 59.98 58.52 1unn h ARG 246 Cb 0.49 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.81 1unn h ARG 246 CO -0.00 0.00 -1.44 0.28 0.56 0.00 0.00 179.97 179.36 1unn h VAL 247 N 0.00 1.28 -2.61 2.04 2.07 -0.75 -3.46 116.25 114.82 1unn h VAL 247 Ca 0.00 -2.85 -0.60 0.00 0.82 0.00 0.00 66.70 64.08 1unn h VAL 247 Cb 0.87 2.88 0.09 0.00 -1.52 0.00 0.00 31.29 33.61 1unn h VAL 247 CO 0.00 0.85 0.44 0.18 0.02 0.00 0.00 177.57 179.05 1unn n LEU 248 N -3.54 2.63 -4.66 2.57 4.77 0.05 -4.88 117.00 113.93 1unn n LEU 248 Ca -0.14 1.16 -0.44 0.00 -0.03 0.00 0.00 56.01 56.56 1unn n LEU 248 Cb 1.05 -1.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.75 1unn n LEU 248 CO 0.54 -0.82 0.88 -2.65 -1.33 0.00 0.00 177.39 174.01 1unn n PRO 249 N 1.47 1.92 -0.05 3.23 -0.02 -1.26 -4.90 135.00 135.39 1unn n PRO 249 Ca 0.11 0.68 -0.13 0.00 -2.02 0.00 0.00 63.50 62.14 1unn n PRO 249 Cb 0.31 -2.25 -0.07 0.00 -0.02 0.00 0.00 33.50 31.47 1unn n PRO 249 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1unn h LYS 250 N 3.11 0.33 -1.92 -0.52 6.56 -1.93 -3.39 116.57 118.81 1unn h LYS 250 Ca -0.44 -0.16 -0.45 0.00 -1.06 0.00 0.00 60.65 58.54 1unn h LYS 250 Cb 1.29 -0.00 -0.31 0.00 -0.57 0.00 0.00 32.23 32.64 1unn h LYS 250 CO 0.67 0.69 -0.82 1.21 -2.06 0.00 0.00 179.45 179.14 1unn s ASN 251 N -6.04 0.49 -1.27 0.86 2.47 -1.26 -5.03 114.94 105.16 1unn s ASN 251 Ca -0.14 -2.62 -0.14 0.00 0.42 0.00 0.00 52.86 50.38 1unn s ASN 251 Cb 0.05 0.32 0.14 0.00 -1.45 0.00 0.00 41.25 40.31 1unn s ASN 251 CO 0.74 -0.13 1.69 -0.81 -3.72 0.00 0.00 177.10 174.87 1unn n PRO 252 N 2.90 3.34 0.17 0.43 -0.04 -1.26 -4.79 135.00 135.75 1unn n PRO 252 Ca 0.26 -3.52 0.11 0.00 -0.04 0.00 0.00 63.50 60.30 1unn n PRO 252 Cb 0.50 -3.14 0.64 0.00 -0.04 0.00 0.00 33.50 31.47 1unn n PRO 252 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1unn h ASP 253 N 6.78 0.03 -3.36 3.54 2.03 -1.86 -3.34 116.42 120.24 1unn h ASP 253 Ca 0.39 -0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 56.11 1unn h ASP 253 Cb 0.79 -0.01 -0.07 0.00 -0.83 0.00 0.00 39.33 39.21 1unn h ASP 253 CO 1.45 0.02 0.18 -0.54 -1.03 0.00 0.00 179.24 179.31 1unn s LYS 254 N -5.08 4.32 -0.11 4.15 1.02 -0.78 -4.94 119.74 118.32 1unn s LYS 254 Ca -0.05 0.82 0.01 0.00 0.02 0.00 0.00 55.97 56.76 1unn s LYS 254 Cb 0.18 -3.53 0.02 0.00 -0.52 0.00 0.00 37.83 33.98 1unn s LYS 254 CO 0.69 -0.15 -0.11 -1.01 -0.92 0.00 0.00 175.35 173.85 1unn s HIS 255 N 1.55 1.71 0.06 3.18 3.76 -1.26 0.23 115.29 124.51 1unn s HIS 255 Ca 0.34 -0.83 0.09 0.00 -0.15 0.00 0.00 55.06 54.51 1unn s HIS 255 Cb -0.17 -1.31 -0.03 0.00 1.11 0.00 0.00 32.58 32.18 1unn s HIS 255 CO 0.14 -0.50 -0.26 -1.17 -0.85 0.00 0.00 174.74 172.10 1unn s LEU 256 N 1.34 2.20 -0.00 0.89 2.96 0.84 -4.57 118.68 122.33 1unn s LEU 256 Ca -0.01 -0.62 0.05 0.00 -0.22 0.00 0.00 54.13 53.33 1unn s LEU 256 Cb -0.14 -1.25 -0.01 0.00 0.50 0.00 0.00 46.19 45.29 1unn s LEU 256 CO -0.05 0.23 -0.15 -0.70 -1.32 0.00 0.00 176.35 174.36 1unn s GLU 257 N -1.39 1.16 0.12 1.98 2.12 -0.48 0.04 118.70 122.24 1unn s GLU 257 Ca 0.12 -0.56 -0.15 0.00 0.36 0.00 0.00 54.97 54.73 1unn s GLU 257 Cb -0.10 -1.13 0.03 0.00 0.26 0.00 0.00 34.13 33.19 1unn s GLU 257 CO 0.03 0.31 0.37 0.00 -0.54 0.00 0.00 175.26 175.43 1unn s ALA 258 N -0.42 -0.85 0.19 6.30 0.00 -0.21 0.72 121.76 127.49 1unn s ALA 258 Ca 0.05 -0.10 -0.32 0.00 0.00 0.00 0.00 51.96 51.60 1unn s ALA 258 Cb -0.06 0.65 -0.11 0.00 0.00 0.00 0.00 23.12 23.60 1unn s ALA 258 CO -0.00 -0.62 1.63 0.20 0.00 0.00 0.00 175.76 176.97 1unn s GLY 259 N -2.77 1.45 0.11 0.00 0.00 -1.26 0.26 107.32 105.11 1unn s GLY 259 Ca 0.03 1.46 -0.15 0.00 0.00 0.00 0.00 44.72 46.05 1unn s GLY 259 CO -0.11 2.72 1.50 0.00 0.00 0.00 0.00 173.10 177.21 1unn h ASP 261 N 0.44 0.78 -0.10 0.00 3.58 -1.80 -0.44 116.42 118.88 1unn h ASP 261 Ca 0.08 -0.53 0.01 0.00 0.42 0.00 0.00 57.03 57.01 1unn h ASP 261 Cb 0.60 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.42 1unn h ASP 261 CO 0.04 1.31 0.05 -0.07 -2.88 0.00 0.00 179.24 177.68 1unn h LEU 262 N 0.43 0.07 -0.12 2.28 3.38 -1.88 -0.42 115.31 119.05 1unn h LEU 262 Ca -0.05 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.96 1unn h LEU 262 Cb 1.41 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 42.10 1unn h LEU 262 CO 0.15 0.06 -0.20 0.25 0.09 0.00 0.00 178.44 178.79 1unn h LEU 263 N 0.11 -0.61 -0.45 1.67 5.85 -0.83 -1.44 115.31 119.61 1unn h LEU 263 Ca 0.04 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.91 1unn h LEU 263 Cb 0.01 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1unn h LEU 263 CO -0.03 -0.25 0.18 0.50 -0.34 0.00 0.00 178.44 178.50 1unn h LYS 264 N -0.26 0.36 -0.38 1.25 3.64 -0.82 -0.79 116.57 119.57 1unn h LYS 264 Ca 0.09 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1unn h LYS 264 Cb 0.40 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1unn h LYS 264 CO -0.27 0.24 -0.05 1.96 -2.27 0.00 0.00 179.45 179.05 1unn h GLN 265 N 0.37 0.62 -0.39 1.90 1.08 -0.96 0.24 115.11 117.98 1unn h GLN 265 Ca 0.21 -0.17 -0.07 0.00 -1.45 0.00 0.00 58.65 57.17 1unn h GLN 265 Cb 0.17 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 1unn h GLN 265 CO -0.19 0.68 -0.03 0.00 -0.95 0.00 0.00 178.83 178.35 1unn h ALA 266 N 1.36 0.52 -0.45 3.87 0.00 -0.70 -1.10 119.26 122.76 1unn h ALA 266 Ca 0.11 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1unn h ALA 266 Cb 0.45 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1unn h ALA 266 CO 0.02 0.32 -0.05 0.74 0.00 0.00 0.00 179.25 180.28 1unn h PHE 267 N 0.52 0.84 -0.33 0.00 0.04 -0.97 -0.50 116.94 116.53 1unn h PHE 267 Ca 0.11 -0.13 -0.12 0.00 2.80 0.00 0.00 57.97 60.63 1unn h PHE 267 Cb 0.51 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1unn h PHE 267 CO 0.04 0.80 -0.28 0.00 -0.60 0.00 0.00 178.31 178.27 1unn h ALA 268 N 1.23 0.89 -0.17 2.45 0.00 -0.78 0.96 119.26 123.84 1unn h ALA 268 Ca 0.13 -0.39 -0.21 0.00 0.00 0.00 0.00 54.91 54.44 1unn h ALA 268 Cb 0.51 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1unn h ALA 268 CO 0.03 0.62 -0.74 0.00 0.00 0.00 0.00 179.25 179.16 1unn h ARG 269 N 0.58 0.77 -0.61 0.00 3.08 -1.07 -3.08 114.38 114.05 1unn h ARG 269 Ca 0.07 -0.60 0.03 0.00 0.07 0.00 0.00 59.98 59.55 1unn h ARG 269 Cb 0.78 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 1unn h ARG 269 CO 0.06 1.22 0.40 0.00 -1.07 0.00 0.00 179.97 180.58 1unn h ALA 270 N 0.62 1.65 0.00 0.04 0.00 -0.85 -2.07 119.26 118.65 1unn h ALA 270 Ca -0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1unn h ALA 270 Cb 1.36 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1unn h ALA 270 CO 0.15 0.29 -0.02 0.00 0.00 0.00 0.00 179.25 179.67 1unn h ALA 271 N 1.64 1.78 -0.83 0.00 0.00 -0.72 -1.58 119.26 119.55 1unn h ALA 271 Ca 0.24 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1unn h ALA 271 Cb 0.04 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1unn h ALA 271 CO -0.06 0.03 0.55 0.82 0.00 0.00 0.00 179.25 180.58 1unn h ILE 272 N 0.00 1.19 -0.60 0.00 2.04 -1.41 -1.74 117.51 116.99 1unn h ILE 272 Ca -0.00 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 1unn h ILE 272 Cb 0.05 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.10 1unn h ILE 272 CO 0.00 0.20 0.07 0.18 0.00 0.00 0.00 178.15 178.60 1unn n LEU 273 N -4.42 5.78 -4.94 1.44 4.77 -0.60 -4.94 117.00 114.08 1unn n LEU 273 Ca 0.10 -3.02 -0.25 0.00 -0.03 0.00 0.00 56.01 52.82 1unn n LEU 273 Cb 0.05 -0.70 0.02 0.00 -2.33 0.00 0.00 43.42 40.47 1unn n LEU 273 CO 0.36 0.68 0.41 -0.94 -1.33 0.00 0.00 177.39 176.56 1unn s SER 274 N -0.90 5.68 0.05 -1.43 1.04 -0.66 -2.78 113.70 114.70 1unn s SER 274 Ca 0.54 0.47 -0.32 0.00 0.48 0.00 0.00 55.95 57.13 1unn s SER 274 Cb 0.42 -1.57 -0.11 0.00 0.10 0.00 0.00 66.02 64.86 1unn s SER 274 CO 0.15 -0.90 1.88 -3.20 0.98 0.00 0.00 173.24 172.15 1unn n ASN 275 N -2.34 3.89 -0.15 7.02 2.85 -1.26 -4.81 115.26 120.47 1unn n ASN 275 Ca 0.03 0.96 0.13 0.00 -0.11 0.00 0.00 54.58 55.59 1unn n ASN 275 Cb 0.58 -1.49 0.47 0.00 1.24 0.00 0.00 39.78 40.58 1unn n ASN 275 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1unn h GLU 276 N 9.21 0.47 0.07 1.20 5.08 -1.94 0.39 114.58 129.07 1unn h GLU 276 Ca -0.48 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 57.67 1unn h GLU 276 Cb 1.24 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 1unn h GLU 276 CO 0.94 0.31 -0.95 -0.22 -1.00 0.00 0.00 179.01 178.09 1unn h LYS 277 N 0.48 0.15 0.00 2.33 3.64 -2.03 -3.41 116.57 117.73 1unn h LYS 277 Ca 0.34 -0.26 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 1unn h LYS 277 Cb 0.67 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 1unn h LYS 277 CO -0.11 1.12 -1.93 1.19 -2.27 0.00 0.00 179.45 177.45 1unn n PHE 278 N -4.22 0.17 -2.71 1.91 3.72 -1.11 -4.99 117.46 110.23 1unn n PHE 278 Ca -0.21 0.05 -0.21 0.00 -0.05 0.00 0.00 57.45 57.04 1unn n PHE 278 Cb 0.75 -0.67 0.01 0.00 -0.94 0.00 0.00 39.48 38.62 1unn n PHE 278 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1unn n ARG 279 N -2.43 -3.10 -2.63 -1.08 1.74 0.14 -4.75 116.66 104.55 1unn n ARG 279 Ca -0.09 0.88 -0.41 0.00 -0.77 0.00 0.00 57.85 57.46 1unn n ARG 279 Cb 0.69 -5.62 -0.04 0.00 -1.02 0.00 0.00 32.46 26.47 1unn n ARG 279 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1unn s GLY 280 N -2.34 2.95 0.09 -0.13 0.00 -1.26 -0.39 107.32 106.24 1unn s GLY 280 Ca 0.14 0.70 0.02 0.00 0.00 0.00 0.00 44.72 45.59 1unn s GLY 280 CO 0.18 1.51 -0.08 -1.34 0.00 0.00 0.00 173.10 173.37 1unn s VAL 281 N -0.33 0.76 0.01 1.40 -7.23 0.21 -4.49 120.40 110.73 1unn s VAL 281 Ca 0.47 -1.76 0.08 0.00 -1.81 0.00 0.00 61.98 58.96 1unn s VAL 281 Cb -0.27 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.17 1unn s VAL 281 CO 0.33 -0.73 -0.24 -0.13 -0.31 0.00 0.00 175.10 174.01 1unn s ARG 282 N -3.30 2.03 -0.06 4.82 0.52 0.35 -1.43 118.95 121.88 1unn s ARG 282 Ca 0.08 -0.98 0.03 0.00 -0.52 0.00 0.00 55.73 54.34 1unn s ARG 282 Cb 0.01 -2.07 -0.03 0.00 0.52 0.00 0.00 34.95 33.39 1unn s ARG 282 CO -0.03 0.55 -0.13 -0.51 0.02 0.00 0.00 175.30 175.20 1unn s LEU 283 N -0.94 2.79 -0.15 2.53 1.02 0.13 -0.89 118.68 123.16 1unn s LEU 283 Ca 0.11 -0.19 0.00 0.00 0.02 0.00 0.00 54.13 54.08 1unn s LEU 283 Cb -0.10 -1.58 0.03 0.00 0.02 0.00 0.00 46.19 44.56 1unn s LEU 283 CO 0.01 0.33 -0.12 -0.31 0.02 0.00 0.00 176.35 176.28 1unn s TYR 284 N -0.63 2.05 -0.17 0.29 1.51 0.10 -0.61 117.35 119.89 1unn s TYR 284 Ca 0.09 -1.18 -0.04 0.00 -1.01 0.00 0.00 57.07 54.93 1unn s TYR 284 Cb -0.11 -1.52 -0.02 0.00 -0.11 0.00 0.00 41.96 40.20 1unn s TYR 284 CO 0.01 -0.65 -0.03 0.08 -1.11 0.00 0.00 175.55 173.85 1unn s VAL 285 N 1.52 3.82 0.33 0.71 1.01 0.91 -1.36 120.40 127.35 1unn s VAL 285 Ca 0.04 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1unn s VAL 285 Cb -0.13 -2.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 1unn s VAL 285 CO -0.10 0.48 0.40 -1.54 0.00 0.00 0.00 175.10 174.34 1unn n SER 286 N 3.77 -1.09 -4.61 3.32 3.41 -0.03 -1.76 113.62 116.63 1unn n SER 286 Ca -0.17 -2.94 -0.51 0.00 -0.26 0.00 0.00 58.87 54.98 1unn n SER 286 Cb 0.52 2.16 -0.06 0.00 -0.26 0.00 0.00 64.21 66.57 1unn n SER 286 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1unn n GLU 287 N -0.58 1.56 -2.86 4.33 4.07 -1.26 -0.78 120.64 125.13 1unn n GLU 287 Ca 0.03 0.53 -0.15 0.00 -0.06 0.00 0.00 57.16 57.52 1unn n GLU 287 Cb 0.57 -2.48 -0.01 0.00 -0.06 0.00 0.00 31.44 29.47 1unn n GLU 287 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1unn n ASN 288 N 7.57 -3.13 -3.70 4.31 5.03 0.21 -4.94 115.26 120.61 1unn n ASN 288 Ca 0.30 0.00 -0.14 0.00 0.87 0.00 0.00 54.58 55.61 1unn n ASN 288 Cb 0.24 -2.66 -0.08 0.00 -1.02 0.00 0.00 39.78 36.26 1unn n ASN 288 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 1unn s GLN 289 N -5.45 0.78 -0.06 3.52 0.74 0.04 -1.72 119.66 117.51 1unn s GLN 289 Ca 0.17 -0.11 0.01 0.00 0.05 0.00 0.00 55.36 55.48 1unn s GLN 289 Cb -0.09 0.35 0.02 0.00 1.10 0.00 0.00 33.01 34.39 1unn s GLN 289 CO 0.21 -0.23 -0.07 -1.17 -0.55 0.00 0.00 175.29 173.48 1unn s LEU 290 N -1.36 1.37 -0.07 3.68 2.96 -0.56 -0.85 118.68 123.84 1unn s LEU 290 Ca -0.12 -0.20 0.04 0.00 -0.22 0.00 0.00 54.13 53.62 1unn s LEU 290 Cb -0.04 -0.62 -0.02 0.00 0.50 0.00 0.00 46.19 46.02 1unn s LEU 290 CO 0.05 -0.04 -0.18 -0.75 -1.32 0.00 0.00 176.35 174.11 1unn s LYS 291 N 0.98 2.74 -0.09 1.98 2.20 -0.47 0.29 119.74 127.37 1unn s LYS 291 Ca -0.10 -0.77 0.03 0.00 -0.36 0.00 0.00 55.97 54.78 1unn s LYS 291 Cb -0.15 -2.37 -0.01 0.00 -1.51 0.00 0.00 37.83 33.80 1unn s LYS 291 CO 0.00 0.44 -0.20 0.42 -0.36 0.00 0.00 175.35 175.65 1unn s ILE 292 N -0.26 2.45 0.09 5.43 1.01 0.22 0.02 121.20 130.16 1unn s ILE 292 Ca 0.01 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 59.80 1unn s ILE 292 Cb -0.13 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 1unn s ILE 292 CO 0.03 0.55 -0.11 0.42 0.00 0.00 0.00 174.94 175.83 1unn s THR 293 N 0.12 1.01 0.01 2.92 -4.23 -0.07 -0.58 115.64 114.82 1unn s THR 293 Ca -0.10 -1.56 -0.01 0.00 -1.18 0.00 0.00 61.69 58.84 1unn s THR 293 Cb -0.16 -1.29 -0.01 0.00 1.34 0.00 0.00 72.50 72.38 1unn s THR 293 CO 0.06 -0.46 0.00 0.00 -0.54 0.00 0.00 174.62 173.68 1unn s ALA 294 N -2.12 0.03 0.05 3.99 0.00 -0.39 -0.50 121.76 122.83 1unn s ALA 294 Ca 0.04 -0.41 -0.16 0.00 0.00 0.00 0.00 51.96 51.43 1unn s ALA 294 Cb -0.05 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.21 1unn s ALA 294 CO 0.01 -0.14 0.36 0.54 0.00 0.00 0.00 175.76 176.53 1unn s ASN 295 N -1.17 -0.20 0.44 0.00 4.22 -1.18 -0.60 114.94 116.45 1unn s ASN 295 Ca -0.13 -0.13 0.03 0.00 -2.14 0.00 0.00 52.86 50.49 1unn s ASN 295 Cb -0.08 0.39 -0.03 0.00 1.28 0.00 0.00 41.25 42.81 1unn s ASN 295 CO -0.00 -0.66 0.05 0.54 -2.04 0.00 0.00 177.10 174.99 1unn s ASN 296 N -2.11 3.40 0.60 3.54 2.20 -0.91 -4.09 114.94 117.57 1unn s ASN 296 Ca -0.04 -1.59 0.30 0.00 -0.94 0.00 0.00 52.86 50.59 1unn s ASN 296 Cb -0.00 0.33 1.77 0.00 -2.00 0.00 0.00 41.25 41.34 1unn s ASN 296 CO -0.04 -0.80 2.18 -0.65 -2.94 0.00 0.00 177.10 174.85 1unn h PRO 297 N 1.65 0.00 -0.19 3.55 0.11 -1.91 -0.28 132.00 134.94 1unn h PRO 297 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1unn h PRO 297 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1unn h PRO 297 CO 0.68 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.86 1unn n GLU 298 N -3.76 1.48 -3.51 1.05 4.71 -1.26 -4.86 120.64 114.49 1unn n GLU 298 Ca -0.01 -0.74 -0.19 0.00 -0.01 0.00 0.00 57.16 56.22 1unn n GLU 298 Cb 0.21 -1.21 0.07 0.00 -1.01 0.00 0.00 31.44 29.51 1unn n GLU 298 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1unn n GLN 299 N 0.06 -6.29 -4.17 3.49 6.02 -0.11 -5.03 117.38 111.36 1unn n GLN 299 Ca 0.09 0.79 -0.28 0.00 -0.01 0.00 0.00 57.00 57.59 1unn n GLN 299 Cb 0.19 -5.70 -0.08 0.00 1.02 0.00 0.00 30.24 25.67 1unn n GLN 299 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1unn s GLU 300 N -5.59 2.49 0.06 -1.09 2.02 -1.26 -4.95 118.70 110.39 1unn s GLU 300 Ca 0.05 -0.99 -0.09 0.00 0.02 0.00 0.00 54.97 53.95 1unn s GLU 300 Cb -0.02 -2.44 0.00 0.00 0.10 0.00 0.00 34.13 31.77 1unn s GLU 300 CO 0.75 0.49 0.19 -1.83 0.02 0.00 0.00 175.26 174.88 1unn s GLU 301 N -2.73 0.77 0.10 1.61 -1.05 -1.26 -2.13 118.70 114.00 1unn s GLU 301 Ca 0.27 -0.79 0.05 0.00 -0.15 0.00 0.00 54.97 54.35 1unn s GLU 301 Cb -0.10 0.32 -0.03 0.00 -0.44 0.00 0.00 34.13 33.87 1unn s GLU 301 CO 0.19 -0.23 -0.12 0.00 0.95 0.00 0.00 175.26 176.05 1unn s ALA 302 N -3.19 1.23 -0.11 -0.84 0.00 0.23 -4.98 121.76 114.09 1unn s ALA 302 Ca -0.00 -1.18 -0.07 0.00 0.00 0.00 0.00 51.96 50.71 1unn s ALA 302 Cb 0.02 -0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.16 1unn s ALA 302 CO -0.07 0.04 0.28 -2.00 0.00 0.00 0.00 175.76 174.00 1unn s GLU 303 N -2.55 0.27 -0.06 0.00 2.12 -1.26 -1.26 118.70 115.97 1unn s GLU 303 Ca 0.05 0.52 0.06 0.00 0.36 0.00 0.00 54.97 55.95 1unn s GLU 303 Cb -0.05 -0.02 -0.01 0.00 0.26 0.00 0.00 34.13 34.32 1unn s GLU 303 CO 0.01 -0.12 -0.23 -1.21 -0.54 0.00 0.00 175.26 173.17 1unn s GLU 304 N 0.92 2.39 -0.05 4.30 0.41 0.25 -4.98 118.70 121.95 1unn s GLU 304 Ca -0.06 -0.83 0.06 0.00 -0.41 0.00 0.00 54.97 53.72 1unn s GLU 304 Cb -0.07 -2.02 -0.02 0.00 -1.78 0.00 0.00 34.13 30.24 1unn s GLU 304 CO -0.06 0.34 -0.22 0.42 -0.49 0.00 0.00 175.26 175.24 1unn s ILE 305 N -0.08 2.33 0.09 -1.63 1.01 -1.26 -0.61 121.20 121.05 1unn s ILE 305 Ca -0.05 -0.98 0.07 0.00 0.00 0.00 0.00 60.65 59.69 1unn s ILE 305 Cb -0.13 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1unn s ILE 305 CO 0.04 0.58 -0.19 -0.76 0.00 0.00 0.00 174.94 174.60 1unn s LEU 306 N -0.41 2.29 -0.01 2.97 1.43 0.15 -4.99 118.68 120.10 1unn s LEU 306 Ca 0.04 -0.67 -0.25 0.00 -1.03 0.00 0.00 54.13 52.23 1unn s LEU 306 Cb -0.12 -0.77 -0.04 0.00 0.03 0.00 0.00 46.19 45.29 1unn s LEU 306 CO 0.01 0.01 0.76 -1.81 0.23 0.00 0.00 176.35 175.56 1unn s ASP 307 N -1.86 7.13 0.35 2.29 1.11 -1.26 -1.50 116.67 122.93 1unn s ASP 307 Ca 0.04 1.36 0.04 0.00 0.18 0.00 0.00 52.55 54.17 1unn s ASP 307 Cb -0.10 -2.45 -0.03 0.00 1.07 0.00 0.00 42.92 41.41 1unn s ASP 307 CO 0.04 -0.07 0.17 0.68 1.18 0.00 0.00 175.17 177.16 1unn s VAL 308 N 0.44 0.40 -0.23 -1.27 -7.23 -0.70 -4.86 120.40 106.96 1unn s VAL 308 Ca 0.40 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.45 1unn s VAL 308 Cb -0.19 -2.45 -0.05 0.00 0.56 0.00 0.00 36.38 34.25 1unn s VAL 308 CO 0.21 0.00 0.22 0.42 -0.31 0.00 0.00 175.10 175.64 1unn s THR 309 N -3.40 5.32 -0.28 5.32 -4.23 0.22 -4.23 115.64 114.36 1unn s THR 309 Ca 0.32 0.30 -0.20 0.00 -1.18 0.00 0.00 61.69 60.93 1unn s THR 309 Cb 0.04 -3.55 0.12 0.00 1.34 0.00 0.00 72.50 70.44 1unn s THR 309 CO 0.18 0.32 0.90 -0.47 -0.54 0.00 0.00 174.62 175.01 1unn s TYR 310 N 1.15 -0.67 0.00 3.99 5.04 -1.26 -1.38 117.35 124.21 1unn s TYR 310 Ca 0.10 1.45 0.00 0.00 -2.44 0.00 0.00 57.07 56.18 1unn s TYR 310 Cb -0.14 0.40 0.00 0.00 0.35 0.00 0.00 41.96 42.57 1unn s TYR 310 CO 0.05 -0.33 0.67 -1.13 -1.34 0.00 0.00 175.55 173.48 1unn n SER 311 N 3.25 0.00 -2.72 4.32 3.41 -1.26 0.66 113.62 121.27 1unn n SER 311 Ca -0.16 -1.38 -0.05 0.00 -0.26 0.00 0.00 58.87 57.01 1unn n SER 311 Cb 0.57 -0.08 0.02 0.00 -0.26 0.00 0.00 64.21 64.47 1unn n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1unn n GLY 312 N 0.00 1.45 3.76 5.00 0.00 -1.26 -5.04 105.19 109.10 1unn n GLY 312 Ca 0.00 -2.08 -0.39 0.00 0.00 0.00 0.00 46.02 43.55 1unn n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1unn s ALA 313 N -2.46 3.10 0.39 4.61 0.00 -1.26 -4.72 121.76 121.42 1unn s ALA 313 Ca 0.16 1.17 -0.27 0.00 0.00 0.00 0.00 51.96 53.03 1unn s ALA 313 Cb -0.01 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 1unn s ALA 313 CO 0.11 -0.89 1.33 -1.21 0.00 0.00 0.00 175.76 175.09 1unn s GLU 314 N -2.49 4.03 0.29 0.00 2.02 -1.26 -4.85 118.70 116.43 1unn s GLU 314 Ca 0.62 2.22 -0.19 0.00 0.02 0.00 0.00 54.97 57.64 1unn s GLU 314 Cb -0.36 -2.82 0.02 0.00 0.10 0.00 0.00 34.13 31.07 1unn s GLU 314 CO 0.45 -0.46 0.68 0.00 0.02 0.00 0.00 175.26 175.94 1unn s MET 315 N -2.17 1.80 -0.01 1.61 0.23 -0.72 -5.00 119.30 115.04 1unn s MET 315 Ca 0.55 -1.10 0.03 0.00 -1.03 0.00 0.00 55.69 54.14 1unn s MET 315 Cb -0.39 0.58 -0.00 0.00 -1.53 0.00 0.00 34.83 33.49 1unn s MET 315 CO 0.51 -0.81 -0.09 -2.00 -2.03 0.00 0.00 175.02 170.59 1unn s GLU 316 N -3.74 0.82 -0.05 3.16 2.12 -1.26 -0.06 118.70 119.69 1unn s GLU 316 Ca 0.14 -0.33 -0.14 0.00 0.36 0.00 0.00 54.97 54.99 1unn s GLU 316 Cb -0.05 -0.79 0.03 0.00 0.26 0.00 0.00 34.13 33.58 1unn s GLU 316 CO 0.08 0.19 0.32 -1.50 -0.54 0.00 0.00 175.26 173.81 1unn s ILE 317 N -0.13 0.04 0.11 -3.70 2.07 0.21 -4.26 121.20 115.54 1unn s ILE 317 Ca 0.02 -0.33 0.04 0.00 -1.41 0.00 0.00 60.65 58.97 1unn s ILE 317 Cb -0.05 -0.58 -0.04 0.00 0.13 0.00 0.00 42.46 41.93 1unn s ILE 317 CO -0.00 -0.18 0.08 -0.83 -1.91 0.00 0.00 174.94 172.09 1unn s GLY 318 N -0.88 1.92 0.03 1.50 0.00 -1.26 0.17 107.32 108.81 1unn s GLY 318 Ca -0.10 -1.09 -0.08 0.00 0.00 0.00 0.00 44.72 43.45 1unn s GLY 318 CO 0.03 -1.08 0.16 -1.36 0.00 0.00 0.00 173.10 170.86 1unn s PHE 319 N -1.47 0.08 -0.16 1.90 0.08 -0.51 -0.72 117.98 117.17 1unn s PHE 319 Ca 0.29 -0.30 -0.29 0.00 0.12 0.00 0.00 56.93 56.75 1unn s PHE 319 Cb -0.11 -0.06 -0.03 0.00 -0.57 0.00 0.00 43.02 42.25 1unn s PHE 319 CO 0.22 -0.39 1.44 1.21 -0.10 0.00 0.00 175.22 177.59 1unn s ASN 320 N -1.97 6.74 0.41 1.36 3.84 -1.26 -0.62 114.94 123.45 1unn s ASN 320 Ca -0.07 1.78 0.19 0.00 0.21 0.00 0.00 52.86 54.97 1unn s ASN 320 Cb -0.02 -2.54 0.90 0.00 -0.55 0.00 0.00 41.25 39.05 1unn s ASN 320 CO -0.03 -0.93 1.86 1.62 -2.79 0.00 0.00 177.10 176.83 1unn h VAL 321 N 5.68 0.93 -0.89 -5.21 3.04 -1.04 -1.68 116.25 117.09 1unn h VAL 321 Ca -0.31 -1.16 -0.00 0.00 -1.01 0.00 0.00 66.70 64.22 1unn h VAL 321 Cb 1.13 1.68 -0.04 0.00 -2.01 0.00 0.00 31.29 32.05 1unn h VAL 321 CO 0.98 0.30 0.56 0.28 -1.01 0.00 0.00 177.57 178.67 1unn h SER 322 N 0.00 1.06 -0.66 3.17 0.02 -1.91 0.10 113.55 115.33 1unn h SER 322 Ca -0.00 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.82 1unn h SER 322 Cb 0.66 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1unn h SER 322 CO 0.04 0.80 0.15 1.88 -1.14 0.00 0.00 176.83 178.55 1unn h TYR 323 N 1.22 1.13 -0.35 3.45 0.05 -1.70 0.15 116.97 120.92 1unn h TYR 323 Ca 0.32 -0.14 -0.13 0.00 0.05 0.00 0.00 58.73 58.83 1unn h TYR 323 Cb -0.08 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.34 1unn h TYR 323 CO -0.00 0.94 -0.29 0.28 -1.05 0.00 0.00 178.16 178.04 1unn h VAL 324 N 1.00 1.29 -0.12 -2.88 2.07 -1.19 -2.61 116.25 113.80 1unn h VAL 324 Ca 0.21 -1.45 -0.12 0.00 0.82 0.00 0.00 66.70 66.16 1unn h VAL 324 Cb 0.39 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 1unn h VAL 324 CO 0.01 0.48 -0.45 -0.07 0.02 0.00 0.00 177.57 177.55 1unn h LEU 325 N 0.60 0.29 -1.04 2.57 3.38 -0.48 -1.29 115.31 119.34 1unn h LEU 325 Ca 0.06 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.95 1unn h LEU 325 Cb 0.86 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.47 1unn h LEU 325 CO 0.07 0.71 0.64 0.44 0.09 0.00 0.00 178.44 180.39 1unn h ASP 326 N 0.23 1.05 -0.19 -0.43 3.32 -0.55 0.21 116.42 120.06 1unn h ASP 326 Ca 0.02 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1unn h ASP 326 Cb 0.88 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1unn h ASP 326 CO 0.07 0.71 -0.08 0.58 -1.72 0.00 0.00 179.24 178.80 1unn h VAL 327 N 1.21 1.31 -0.03 -1.35 2.07 -1.04 -1.57 116.25 116.85 1unn h VAL 327 Ca 0.40 -1.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.72 1unn h VAL 327 Cb 0.05 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1unn h VAL 327 CO -0.13 0.34 -0.33 -0.07 0.02 0.00 0.00 177.57 177.39 1unn h LEU 328 N 0.08 0.05 -0.58 2.57 3.38 -0.81 0.48 115.31 120.48 1unn h LEU 328 Ca 0.04 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1unn h LEU 328 Cb 0.56 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1unn h LEU 328 CO 0.03 0.38 -0.67 0.78 0.09 0.00 0.00 178.44 179.04 1unn h ASN 329 N 0.04 0.21 0.98 -0.43 -0.26 -0.46 -2.78 115.58 112.89 1unn h ASN 329 Ca 0.00 -0.13 -0.12 0.00 -0.56 0.00 0.00 56.30 55.49 1unn h ASN 329 Cb 0.61 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.79 1unn h ASN 329 CO 0.04 0.82 -0.58 0.00 -1.06 0.00 0.00 177.43 176.66 1unn h ALA 330 N 1.18 0.79 0.01 -0.83 0.00 -0.58 -3.32 119.26 116.51 1unn h ALA 330 Ca -0.01 -0.52 -0.09 0.00 0.00 0.00 0.00 54.91 54.29 1unn h ALA 330 Cb 1.20 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1unn h ALA 330 CO 0.10 0.72 -0.34 -0.07 0.00 0.00 0.00 179.25 179.66 1unn h LEU 331 N 0.00 0.29 -3.79 0.00 3.38 -0.81 -3.46 115.31 110.91 1unn h LEU 331 Ca -0.01 -0.80 -0.48 0.00 0.09 0.00 0.00 57.88 56.69 1unn h LEU 331 Cb 1.22 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1unn h LEU 331 CO 0.07 1.05 -0.85 2.29 0.09 0.00 0.00 178.44 181.09 1unn n LYS 332 N -4.43 -0.55 -4.14 1.13 2.85 -1.06 -4.93 118.16 107.03 1unn n LYS 332 Ca -0.10 0.09 -0.21 0.00 -1.05 0.00 0.00 58.31 57.04 1unn n LYS 332 Cb 0.56 -1.81 -0.07 0.00 -0.65 0.00 0.00 35.03 33.06 1unn n LYS 332 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1unn h GLU 334 N 0.00 -0.08 -6.28 0.00 4.39 -1.97 -3.41 114.58 107.23 1unn h GLU 334 Ca -0.26 0.01 -0.63 0.00 0.34 0.00 0.00 59.36 58.82 1unn h GLU 334 Cb 1.11 0.02 -0.27 0.00 -0.10 0.00 0.00 28.75 29.50 1unn h GLU 334 CO 0.41 0.50 -0.86 -0.80 -1.16 0.00 0.00 179.01 177.10 1unn s ASN 335 N -5.76 2.69 0.24 1.42 0.01 -1.26 -0.09 114.94 112.19 1unn s ASN 335 Ca -0.14 -0.50 0.09 0.00 -0.71 0.00 0.00 52.86 51.59 1unn s ASN 335 Cb -0.00 -0.25 -0.04 0.00 0.41 0.00 0.00 41.25 41.36 1unn s ASN 335 CO 0.55 0.22 -0.01 0.68 -1.51 0.00 0.00 177.10 177.03 1unn s VAL 336 N -0.71 3.51 -0.14 1.60 -7.23 0.14 -0.85 120.40 116.71 1unn s VAL 336 Ca 0.09 -1.78 0.03 0.00 -1.81 0.00 0.00 61.98 58.51 1unn s VAL 336 Cb -0.09 -2.84 0.01 0.00 0.56 0.00 0.00 36.38 34.02 1unn s VAL 336 CO 0.01 -0.30 -0.22 -0.60 -0.31 0.00 0.00 175.10 173.69 1unn s ARG 337 N -3.45 3.03 -0.11 4.82 3.52 0.71 -1.05 118.95 126.43 1unn s ARG 337 Ca 0.30 -0.85 -0.03 0.00 -0.13 0.00 0.00 55.73 55.01 1unn s ARG 337 Cb -0.07 -2.43 -0.03 0.00 -1.56 0.00 0.00 34.95 30.86 1unn s ARG 337 CO 0.19 0.00 0.03 -1.64 -0.81 0.00 0.00 175.30 173.07 1unn s MET 338 N 0.77 3.21 -0.19 5.12 -1.94 0.11 -1.21 119.30 125.17 1unn s MET 338 Ca -0.08 -0.37 0.01 0.00 -1.71 0.00 0.00 55.69 53.54 1unn s MET 338 Cb -0.16 -2.90 0.03 0.00 2.01 0.00 0.00 34.83 33.81 1unn s MET 338 CO -0.01 0.63 -0.17 -1.64 -0.01 0.00 0.00 175.02 173.82 1unn s MET 339 N -0.67 2.69 0.26 2.03 1.00 0.18 -0.11 119.30 124.67 1unn s MET 339 Ca 0.11 -0.85 0.11 0.00 0.00 0.00 0.00 55.69 55.06 1unn s MET 339 Cb -0.12 -2.52 -0.05 0.00 0.00 0.00 0.00 34.83 32.15 1unn s MET 339 CO 0.02 -0.28 -0.14 -0.51 0.00 0.00 0.00 175.02 174.11 1unn s LEU 340 N 1.31 2.78 0.08 -0.03 1.02 0.13 -1.38 118.68 122.59 1unn s LEU 340 Ca 0.03 -0.87 0.00 0.00 0.02 0.00 0.00 54.13 53.30 1unn s LEU 340 Cb -0.14 -1.32 0.00 0.00 0.02 0.00 0.00 46.19 44.75 1unn s LEU 340 CO -0.11 0.04 0.00 0.41 0.02 0.00 0.00 176.35 176.71 1unn n THR 341 N -0.57 0.56 -3.90 5.49 -1.04 -1.26 -1.87 114.28 111.69 1unn n THR 341 Ca -0.06 0.19 -0.03 0.00 -2.04 0.00 0.00 64.05 62.11 1unn n THR 341 Cb 0.59 -1.34 0.02 0.00 -1.82 0.00 0.00 70.33 67.78 1unn n THR 341 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1unn s ASP 342 N -5.45 0.01 0.32 8.00 1.47 -1.26 -4.94 116.67 114.81 1unn s ASP 342 Ca 0.00 -0.65 0.26 0.00 1.18 0.00 0.00 52.55 53.34 1unn s ASP 342 Cb 0.00 0.47 0.96 0.00 -0.34 0.00 0.00 42.92 44.02 1unn s ASP 342 CO 0.00 -0.94 1.77 0.77 0.68 0.00 0.00 175.17 177.45 1unn h SER 343 N 2.00 0.00 -0.30 2.11 4.64 -2.00 -2.92 113.55 117.08 1unn h SER 343 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1unn h SER 343 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1unn h SER 343 CO 0.36 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.65 1unn n VAL 344 N -2.48 0.92 -4.20 0.95 0.24 -1.26 -4.60 118.33 107.90 1unn n VAL 344 Ca 0.03 -0.96 -0.26 0.00 -2.04 0.00 0.00 64.34 61.11 1unn n VAL 344 Cb 0.32 0.56 -0.07 0.00 -1.47 0.00 0.00 33.84 33.17 1unn n VAL 344 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1unn s SER 345 N -0.99 4.81 0.93 -1.34 0.01 -1.10 -4.88 113.70 111.14 1unn s SER 345 Ca 0.21 -0.40 -0.11 0.00 1.31 0.00 0.00 55.95 56.97 1unn s SER 345 Cb 0.11 -1.03 0.15 0.00 0.21 0.00 0.00 66.02 65.46 1unn s SER 345 CO 0.15 0.08 1.10 -0.94 0.41 0.00 0.00 173.24 174.04 1unn s SER 346 N -3.03 2.96 0.11 2.44 1.04 -1.26 -4.41 113.70 111.55 1unn s SER 346 Ca 0.28 1.85 0.09 0.00 0.48 0.00 0.00 55.95 58.65 1unn s SER 346 Cb -0.09 -2.43 -0.04 0.00 0.10 0.00 0.00 66.02 63.56 1unn s SER 346 CO 0.19 -3.02 -0.19 0.68 0.98 0.00 0.00 173.24 171.89 1unn s VAL 347 N -2.72 2.79 -0.11 5.02 -7.23 -0.18 -4.46 120.40 113.52 1unn s VAL 347 Ca 0.65 -1.47 -0.01 0.00 -1.81 0.00 0.00 61.98 59.34 1unn s VAL 347 Cb -0.21 -2.26 -0.03 0.00 0.56 0.00 0.00 36.38 34.44 1unn s VAL 347 CO 0.59 0.14 -0.06 -1.58 -0.31 0.00 0.00 175.10 173.87 1unn s GLN 348 N -2.03 3.15 -0.01 4.82 0.74 -0.48 -0.97 119.66 124.88 1unn s GLN 348 Ca 0.17 -0.54 0.06 0.00 0.05 0.00 0.00 55.36 55.10 1unn s GLN 348 Cb -0.11 -2.72 -0.01 0.00 1.10 0.00 0.00 33.01 31.27 1unn s GLN 348 CO 0.09 0.48 -0.18 0.42 -0.55 0.00 0.00 175.29 175.54 1unn s ILE 349 N -0.29 1.46 0.15 -2.34 1.01 0.50 0.49 121.20 122.17 1unn s ILE 349 Ca 0.04 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.79 1unn s ILE 349 Cb -0.13 -1.22 0.00 0.00 0.01 0.00 0.00 42.46 41.13 1unn s ILE 349 CO 0.02 0.40 0.30 -1.61 0.00 0.00 0.00 174.94 174.05 1unn s GLU 350 N -0.46 1.10 0.15 2.79 2.02 -0.35 -0.95 118.70 123.00 1unn s GLU 350 Ca 0.07 -1.04 -0.31 0.00 0.02 0.00 0.00 54.97 53.70 1unn s GLU 350 Cb -0.07 0.39 -0.10 0.00 0.10 0.00 0.00 34.13 34.45 1unn s GLU 350 CO -0.01 -0.40 1.71 0.34 0.02 0.00 0.00 175.26 176.92 1unn s ASP 351 N -2.92 6.48 0.59 -0.19 -1.08 -1.25 -0.21 116.67 118.10 1unn s ASP 351 Ca 0.12 2.71 0.33 0.00 -0.52 0.00 0.00 52.55 55.19 1unn s ASP 351 Cb 0.03 -2.58 1.87 0.00 -1.46 0.00 0.00 42.92 40.78 1unn s ASP 351 CO -0.04 -0.94 2.23 0.00 0.52 0.00 0.00 175.17 176.94 1unn h ALA 352 N 7.68 1.30 -0.02 3.66 0.00 -1.25 -2.65 119.26 127.98 1unn h ALA 352 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1unn h ALA 352 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1unn h ALA 352 CO 0.94 0.04 -0.33 0.00 0.00 0.00 0.00 179.25 179.90 1unn n ALA 353 N -2.24 3.23 -3.27 0.00 0.00 -1.26 -4.96 120.51 112.01 1unn n ALA 353 Ca -0.03 -0.65 -0.13 0.00 0.00 0.00 0.00 53.44 52.64 1unn n ALA 353 Cb 0.13 -0.77 -0.10 0.00 0.00 0.00 0.00 19.45 18.71 1unn n ALA 353 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1unn s SER 354 N -2.27 -0.38 -0.02 0.00 0.15 -1.00 -5.02 113.70 105.16 1unn s SER 354 Ca 0.20 0.74 0.18 0.00 0.70 0.00 0.00 55.95 57.77 1unn s SER 354 Cb 0.18 0.74 0.55 0.00 -1.71 0.00 0.00 66.02 65.78 1unn s SER 354 CO 0.48 -0.13 1.46 0.00 1.20 0.00 0.00 173.24 176.25 1unn n GLN 355 N 2.93 2.60 -0.36 5.44 6.02 -1.26 -3.83 117.38 128.91 1unn n GLN 355 Ca -0.13 -2.23 0.03 0.00 -0.01 0.00 0.00 57.00 54.66 1unn n GLN 355 Cb 0.57 -1.54 0.19 0.00 1.02 0.00 0.00 30.24 30.49 1unn n GLN 355 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 1unn h SER 356 N 3.52 1.01 -4.15 1.08 0.02 -1.94 -3.43 113.55 109.66 1unn h SER 356 Ca 0.00 0.01 -0.48 0.00 -0.84 0.00 0.00 61.79 60.48 1unn h SER 356 Cb 0.91 -0.20 -0.20 0.00 0.14 0.00 0.00 62.40 63.04 1unn h SER 356 CO 0.04 0.63 -0.79 0.00 -1.14 0.00 0.00 176.83 175.57 1unn s ALA 357 N -6.01 1.60 -0.02 3.77 0.00 -1.26 -0.68 121.76 119.16 1unn s ALA 357 Ca -0.12 -1.22 -0.11 0.00 0.00 0.00 0.00 51.96 50.51 1unn s ALA 357 Cb 0.20 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.18 1unn s ALA 357 CO 0.81 0.24 0.23 0.00 0.00 0.00 0.00 175.76 177.04 1unn s ALA 358 N -1.51 -0.56 0.01 0.00 0.00 -0.04 -4.46 121.76 115.20 1unn s ALA 358 Ca 0.06 0.18 0.04 0.00 0.00 0.00 0.00 51.96 52.24 1unn s ALA 358 Cb -0.08 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 1unn s ALA 358 CO 0.04 -0.22 -0.13 0.71 0.00 0.00 0.00 175.76 176.16 1unn s TYR 359 N -1.13 1.17 -0.07 0.00 1.51 -0.12 -1.17 117.35 117.54 1unn s TYR 359 Ca -0.12 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 55.71 1unn s TYR 359 Cb -0.06 -0.74 0.00 0.00 -0.11 0.00 0.00 41.96 41.06 1unn s TYR 359 CO 0.02 -0.00 -0.17 0.08 -1.11 0.00 0.00 175.55 174.37 1unn s VAL 360 N -0.48 1.53 -0.07 0.71 1.01 0.01 -0.37 120.40 122.73 1unn s VAL 360 Ca 0.04 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1unn s VAL 360 Cb -0.06 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 34.99 1unn s VAL 360 CO 0.00 0.44 -0.11 -0.69 0.00 0.00 0.00 175.10 174.74 1unn s VAL 361 N 0.41 1.10 0.10 2.92 1.01 -0.14 -0.15 120.40 125.65 1unn s VAL 361 Ca -0.14 -0.44 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 1unn s VAL 361 Cb -0.16 -1.02 -0.06 0.00 0.00 0.00 0.00 36.38 35.14 1unn s VAL 361 CO 0.05 0.35 0.85 -0.32 0.00 0.00 0.00 175.10 176.03 1unn s MET 362 N 0.80 4.60 0.87 2.72 1.75 -0.30 -1.01 119.30 128.73 1unn s MET 362 Ca -0.12 1.24 -0.12 0.00 -1.25 0.00 0.00 55.69 55.44 1unn s MET 362 Cb -0.15 -3.34 0.11 0.00 2.84 0.00 0.00 34.83 34.28 1unn s MET 362 CO 0.02 0.33 1.12 -1.25 -0.65 0.00 0.00 175.02 174.58 1unn s PRO 363 N -0.31 1.51 0.41 4.11 0.04 -1.26 -4.76 135.00 134.74 1unn s PRO 363 Ca 0.41 0.47 -0.01 0.00 0.04 0.00 0.00 61.00 61.91 1unn s PRO 363 Cb -0.22 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 1unn s PRO 363 CO 0.26 -1.98 0.65 -1.64 0.04 0.00 0.00 177.00 174.33 1unn s MET 364 N -5.19 3.36 0.29 4.56 -1.94 0.10 -4.95 119.30 115.52 1unn s MET 364 Ca 0.63 -0.25 -0.28 0.00 -1.71 0.00 0.00 55.69 54.07 1unn s MET 364 Cb -0.15 -2.56 -0.09 0.00 2.01 0.00 0.00 34.83 34.04 1unn s MET 364 CO 0.54 -0.08 1.01 1.03 -0.01 0.00 0.00 175.02 177.51 1unn s ARG 365 N -4.50 4.65 0.00 2.03 0.52 -1.26 -3.98 118.95 116.41 1unn s ARG 365 Ca 0.44 1.57 0.23 0.00 -0.52 0.00 0.00 55.73 57.45 1unn s ARG 365 Cb -0.10 -3.07 1.36 0.00 0.52 0.00 0.00 34.95 33.66 1unn s ARG 365 CO 0.39 0.29 1.73 1.28 0.02 0.00 0.00 175.30 179.01