#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ozx s ALA 2 N 0.00 -0.92 0.88 -5.12 0.00 -1.26 -5.17 121.76 110.17 2ozx s ALA 2 Ca 0.00 -0.43 -0.10 0.00 0.00 0.00 0.00 51.96 51.43 2ozx s ALA 2 Cb 0.00 0.91 0.12 0.00 0.00 0.00 0.00 23.12 24.16 2ozx s ALA 2 CO 0.00 -0.94 1.12 0.14 0.00 0.00 0.00 175.76 176.07 2ozx s VAL 3 N -3.93 2.53 0.35 0.00 -7.23 -1.25 -4.65 120.40 106.22 2ozx s VAL 3 Ca 0.14 0.17 -0.09 0.00 -1.81 0.00 0.00 61.98 60.39 2ozx s VAL 3 Cb -0.04 -2.38 0.02 0.00 0.56 0.00 0.00 36.38 34.55 2ozx s VAL 3 CO 0.05 -0.22 0.61 0.00 -0.31 0.00 0.00 175.10 175.23 2ozx s ALA 4 N -2.74 0.04 -0.01 1.32 0.00 -1.26 -4.98 121.76 114.12 2ozx s ALA 4 Ca 0.65 -1.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.33 2ozx s ALA 4 Cb -0.21 0.95 0.02 0.00 0.00 0.00 0.00 23.12 23.89 2ozx s ALA 4 CO 0.58 -0.88 0.30 0.34 0.00 0.00 0.00 175.76 176.09 2ozx s ASP 5 N -3.15 -0.18 0.59 0.00 -1.08 -1.26 -4.76 116.67 106.84 2ozx s ASP 5 Ca 0.23 0.07 0.29 0.00 -0.52 0.00 0.00 52.55 52.63 2ozx s ASP 5 Cb -0.02 0.31 1.74 0.00 -1.46 0.00 0.00 42.92 43.49 2ozx s ASP 5 CO 0.16 -0.44 2.19 -0.07 0.52 0.00 0.00 175.17 177.53 2ozx h LEU 6 N 3.92 0.00 -2.46 -1.34 3.38 -1.96 -1.27 115.31 115.58 2ozx h LEU 6 Ca -0.30 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2ozx h LEU 6 Cb 1.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2ozx h LEU 6 CO 0.40 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.91 2ozx h ALA 7 N 1.90 1.39 0.00 1.53 0.00 -2.02 -2.03 119.26 120.04 2ozx h ALA 7 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2ozx h ALA 7 Cb 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2ozx h ALA 7 CO -0.00 0.02 0.00 -0.07 0.00 0.00 0.00 179.25 179.20 2ozx h LEU 8 N 0.00 0.00 -8.97 0.00 3.38 -1.66 -3.43 115.31 104.63 2ozx h LEU 8 Ca -0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 2ozx h LEU 8 Cb 0.06 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.68 2ozx h LEU 8 CO 0.00 0.00 -0.10 -0.63 0.09 0.00 0.00 178.44 177.80 2ozx s ILE 9 N -3.28 5.11 0.22 1.22 1.01 -0.76 -5.04 121.20 119.68 2ozx s ILE 9 Ca 0.06 0.76 -0.31 0.00 0.00 0.00 0.00 60.65 61.17 2ozx s ILE 9 Cb 0.09 -3.78 -0.15 0.00 0.01 0.00 0.00 42.46 38.64 2ozx s ILE 9 CO 0.54 0.12 1.17 -2.65 0.00 0.00 0.00 174.94 174.12 2ozx n PRO 10 N 5.42 1.42 0.11 2.79 -0.02 -1.26 -4.89 135.00 138.56 2ozx n PRO 10 Ca -0.06 0.50 -0.02 0.00 -2.02 0.00 0.00 63.50 61.90 2ozx n PRO 10 Cb 0.50 -2.00 0.01 0.00 -0.02 0.00 0.00 33.50 31.99 2ozx n PRO 10 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2ozx h ASP 11 N 3.13 0.00 -3.64 2.55 3.58 -1.94 -3.43 116.42 116.67 2ozx h ASP 11 Ca -0.43 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 56.74 2ozx h ASP 11 Cb 1.33 0.00 -0.31 0.00 1.72 0.00 0.00 39.33 42.07 2ozx h ASP 11 CO 0.68 0.74 -0.73 -0.69 -2.88 0.00 0.00 179.24 176.36 2ozx s VAL 12 N -3.00 0.05 -0.21 2.25 1.01 -1.26 -1.82 120.40 117.42 2ozx s VAL 12 Ca 0.01 0.06 -0.07 0.00 0.00 0.00 0.00 61.98 61.98 2ozx s VAL 12 Cb 0.10 -0.11 0.10 0.00 0.00 0.00 0.00 36.38 36.46 2ozx s VAL 12 CO 0.78 0.06 0.45 -0.62 0.00 0.00 0.00 175.10 175.78 2ozx s ASP 13 N 0.50 -0.39 0.09 3.32 2.15 -0.98 -4.99 116.67 116.38 2ozx s ASP 13 Ca -0.04 1.08 -0.05 0.00 0.43 0.00 0.00 52.55 53.96 2ozx s ASP 13 Cb -0.07 1.50 -0.02 0.00 -0.30 0.00 0.00 42.92 44.03 2ozx s ASP 13 CO -0.01 -0.23 0.11 0.27 -0.17 0.00 0.00 175.17 175.14 2ozx s ILE 14 N 2.66 0.15 -0.25 4.11 -4.36 -1.26 -3.31 121.20 118.94 2ozx s ILE 14 Ca -0.02 -1.52 -0.02 0.00 -0.26 0.00 0.00 60.65 58.83 2ozx s ILE 14 Cb -0.12 -1.56 0.14 0.00 1.25 0.00 0.00 42.46 42.16 2ozx s ILE 14 CO -0.14 -0.70 0.37 -0.62 0.24 0.00 0.00 174.94 174.09 2ozx s ASP 15 N -2.92 0.43 0.19 4.36 2.15 -0.34 -4.98 116.67 115.57 2ozx s ASP 15 Ca 0.10 0.03 -0.21 0.00 0.43 0.00 0.00 52.55 52.90 2ozx s ASP 15 Cb 0.06 1.03 0.05 0.00 -0.30 0.00 0.00 42.92 43.76 2ozx s ASP 15 CO -0.08 -0.32 0.61 -0.44 -0.17 0.00 0.00 175.17 174.78 2ozx s SER 16 N 2.52 -0.43 0.00 -0.34 0.01 -1.26 -0.61 113.70 113.59 2ozx s SER 16 Ca 0.12 -0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.14 2ozx s SER 16 Cb -0.15 0.62 0.00 0.00 0.21 0.00 0.00 66.02 66.71 2ozx s SER 16 CO -0.19 -1.07 0.66 -0.67 0.41 0.00 0.00 173.24 172.38 2ozx n ASP 17 N -0.39 0.00 0.00 2.44 2.03 -1.26 -4.89 116.55 114.48 2ozx n ASP 17 Ca -0.13 -1.42 0.00 0.00 0.52 0.00 0.00 54.79 53.76 2ozx n ASP 17 Cb 0.63 -0.08 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 2ozx n ASP 17 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ozx n GLY 18 N 0.00 -0.86 3.66 0.27 0.00 -1.26 -4.53 105.19 102.48 2ozx n GLY 18 Ca 0.00 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 2ozx n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ozx s VAL 19 N -3.00 3.17 -0.01 1.61 1.01 -1.25 -1.43 120.40 120.49 2ozx s VAL 19 Ca 0.00 0.25 -0.08 0.00 0.00 0.00 0.00 61.98 62.15 2ozx s VAL 19 Cb 0.00 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.23 2ozx s VAL 19 CO 0.00 -0.02 0.16 -0.36 0.00 0.00 0.00 175.10 174.88 2ozx s PHE 20 N 4.18 -0.02 0.63 5.22 0.08 -0.45 -4.97 117.98 122.65 2ozx s PHE 20 Ca 0.83 -0.00 -0.18 0.00 0.12 0.00 0.00 56.93 57.70 2ozx s PHE 20 Cb -0.40 -0.02 -0.02 0.00 -0.57 0.00 0.00 43.02 42.02 2ozx s PHE 20 CO 0.37 -0.27 1.23 0.15 -0.10 0.00 0.00 175.22 176.59 2ozx s LYS 21 N -1.18 2.71 0.20 0.44 1.02 -1.26 -0.78 119.74 120.90 2ozx s LYS 21 Ca -0.13 1.86 -0.08 0.00 0.02 0.00 0.00 55.97 57.65 2ozx s LYS 21 Cb -0.07 -1.89 -0.02 0.00 -0.52 0.00 0.00 37.83 35.34 2ozx s LYS 21 CO 0.02 -1.42 0.30 1.52 -0.92 0.00 0.00 175.35 174.85 2ozx s TYR 22 N -1.64 0.61 0.03 3.18 1.13 -0.37 -4.04 117.35 116.25 2ozx s TYR 22 Ca 0.78 -0.93 0.01 0.00 -1.41 0.00 0.00 57.07 55.51 2ozx s TYR 22 Cb -0.32 -0.12 -0.02 0.00 -1.10 0.00 0.00 41.96 40.40 2ozx s TYR 22 CO 0.37 -0.79 -0.05 0.54 -2.51 0.00 0.00 175.55 173.12 2ozx s VAL 23 N -4.04 0.25 -0.19 -3.49 0.11 -0.30 -2.21 120.40 110.52 2ozx s VAL 23 Ca 0.25 -0.97 -0.02 0.00 -2.93 0.00 0.00 61.98 58.31 2ozx s VAL 23 Cb 0.03 -0.38 -0.00 0.00 -1.53 0.00 0.00 36.38 34.50 2ozx s VAL 23 CO 0.07 -0.47 -0.09 -0.22 -3.33 0.00 0.00 175.10 171.05 2ozx s LEU 24 N -1.51 2.69 -0.03 2.54 2.96 -0.46 -2.22 118.68 122.66 2ozx s LEU 24 Ca -0.14 -0.44 0.03 0.00 -0.22 0.00 0.00 54.13 53.36 2ozx s LEU 24 Cb -0.10 -1.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.93 2ozx s LEU 24 CO -0.01 0.02 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.30 2ozx s ILE 25 N 1.22 0.98 0.02 6.68 1.01 -0.85 -1.03 121.20 129.23 2ozx s ILE 25 Ca 0.02 -0.48 -0.17 0.00 0.00 0.00 0.00 60.65 60.03 2ozx s ILE 25 Cb -0.14 -0.85 -0.06 0.00 0.01 0.00 0.00 42.46 41.41 2ozx s ILE 25 CO -0.04 0.29 0.47 -0.60 0.00 0.00 0.00 174.94 175.07 2ozx s ARG 26 N 0.07 4.06 0.00 2.79 3.52 0.37 -0.56 118.95 129.20 2ozx s ARG 26 Ca -0.02 0.54 0.07 0.00 -0.13 0.00 0.00 55.73 56.19 2ozx s ARG 26 Cb -0.09 -3.24 -0.02 0.00 -1.56 0.00 0.00 34.95 30.04 2ozx s ARG 26 CO 0.01 0.63 -0.23 0.08 -0.81 0.00 0.00 175.30 174.98 2ozx s VAL 27 N -0.95 1.82 -0.05 7.11 1.01 0.18 -0.85 120.40 128.67 2ozx s VAL 27 Ca 0.26 -1.06 0.06 0.00 0.00 0.00 0.00 61.98 61.23 2ozx s VAL 27 Cb -0.18 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 2ozx s VAL 27 CO 0.15 0.44 -0.22 -1.00 0.00 0.00 0.00 175.10 174.47 2ozx s HIS 28 N -0.61 2.14 0.27 5.22 0.09 0.18 -1.40 115.29 121.18 2ozx s HIS 28 Ca 0.09 -0.61 -0.30 0.00 -0.00 0.00 0.00 55.06 54.24 2ozx s HIS 28 Cb -0.09 -1.41 -0.11 0.00 -0.00 0.00 0.00 32.58 30.97 2ozx s HIS 28 CO -0.00 -0.18 1.51 -1.12 -0.00 0.00 0.00 174.74 174.95 2ozx s SER 29 N -0.14 6.52 -0.38 1.40 0.01 -0.21 -1.40 113.70 119.50 2ozx s SER 29 Ca -0.02 2.80 0.12 0.00 1.31 0.00 0.00 55.95 60.15 2ozx s SER 29 Cb -0.12 -2.63 0.40 0.00 0.21 0.00 0.00 66.02 63.87 2ozx s SER 29 CO 0.03 -0.80 1.12 0.00 0.41 0.00 0.00 173.24 174.00 2ozx n ALA 30 N 2.23 1.70 0.26 1.44 0.00 -0.09 -4.40 120.51 121.64 2ozx n ALA 30 Ca 0.07 -2.14 0.09 0.00 0.00 0.00 0.00 53.44 51.46 2ozx n ALA 30 Cb 0.39 -1.00 0.40 0.00 0.00 0.00 0.00 19.45 19.24 2ozx n ALA 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2ozx n PRO 31 N -0.18 0.11 -0.18 0.00 -0.04 -0.61 -1.96 135.00 132.13 2ozx n PRO 31 Ca 0.05 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 64.00 2ozx n PRO 31 Cb 0.80 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2ozx n PRO 31 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2ozx n ARG 32 N -1.99 0.06 -3.13 0.54 0.63 -1.26 -3.82 116.66 107.69 2ozx n ARG 32 Ca 0.01 -0.72 -0.19 0.00 -0.92 0.00 0.00 57.85 56.03 2ozx n ARG 32 Cb 0.11 -0.52 -0.01 0.00 0.45 0.00 0.00 32.46 32.50 2ozx n ARG 32 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2ozx n SER 33 N -0.02 -3.33 0.00 6.15 7.64 -0.83 -4.62 113.62 118.61 2ozx n SER 33 Ca 0.00 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.67 2ozx n SER 33 Cb 0.57 -2.80 0.00 0.00 -1.01 0.00 0.00 64.21 60.97 2ozx n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ozx n GLY 34 N -1.01 -1.57 3.16 0.23 0.00 -1.26 -5.15 105.19 99.59 2ozx n GLY 34 Ca -0.03 0.53 -0.12 0.00 0.00 0.00 0.00 46.02 46.39 2ozx n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozx s ALA 35 N 0.00 0.96 0.00 4.61 0.00 -1.26 -5.04 121.76 121.03 2ozx s ALA 35 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2ozx s ALA 35 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.22 2ozx s ALA 35 CO 0.00 -0.14 1.55 -0.35 0.00 0.00 0.00 175.76 176.82 2ozx n PRO 36 N 0.36 0.80 -3.43 0.00 -0.04 -1.26 -4.57 135.00 126.86 2ozx n PRO 36 Ca -0.15 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.15 2ozx n PRO 36 Cb 0.59 -1.10 -0.11 0.00 -0.04 0.00 0.00 33.50 32.84 2ozx n PRO 36 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ozx s ALA 37 N 0.40 -0.47 0.00 0.55 0.00 -1.26 -5.01 121.76 115.97 2ozx s ALA 37 Ca 0.00 0.04 0.22 0.00 0.00 0.00 0.00 51.96 52.23 2ozx s ALA 37 Cb 0.00 -1.61 0.37 0.00 0.00 0.00 0.00 23.12 21.88 2ozx s ALA 37 CO 0.00 -1.47 1.14 0.00 0.00 0.00 0.00 175.76 175.43 2ozx n ALA 38 N 5.32 2.37 -0.87 0.00 0.00 -1.26 -4.25 120.51 121.81 2ozx n ALA 38 Ca -0.04 -2.14 -0.29 0.00 0.00 0.00 0.00 53.44 50.97 2ozx n ALA 38 Cb 0.48 -0.70 0.24 0.00 0.00 0.00 0.00 19.45 19.47 2ozx n ALA 38 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2ozx s GLU 39 N 0.00 -1.13 0.11 0.00 2.02 -1.26 -4.68 118.70 113.76 2ozx s GLU 39 Ca 0.29 0.26 -0.15 0.00 0.02 0.00 0.00 54.97 55.39 2ozx s GLU 39 Cb 0.33 -1.58 0.03 0.00 0.10 0.00 0.00 34.13 33.01 2ozx s GLU 39 CO -0.15 -3.72 0.36 -1.12 0.02 0.00 0.00 175.26 170.66 2ozx s SER 40 N -3.40 -0.17 0.22 -0.19 0.01 -1.26 -1.05 113.70 107.86 2ozx s SER 40 Ca 0.69 -0.36 -0.11 0.00 1.31 0.00 0.00 55.95 57.48 2ozx s SER 40 Cb -0.15 0.45 -0.01 0.00 0.21 0.00 0.00 66.02 66.51 2ozx s SER 40 CO 0.58 -0.82 0.39 -1.59 0.41 0.00 0.00 173.24 172.22 2ozx s LYS 41 N -3.74 1.40 0.07 12.44 -2.85 -0.49 -4.99 119.74 121.58 2ozx s LYS 41 Ca 0.03 -1.25 0.00 0.00 -1.00 0.00 0.00 55.97 53.75 2ozx s LYS 41 Cb 0.02 0.43 -0.04 0.00 -2.06 0.00 0.00 37.83 36.18 2ozx s LYS 41 CO -0.11 -0.56 0.22 -1.21 0.10 0.00 0.00 175.35 173.79 2ozx s GLU 42 N -4.01 3.44 0.05 1.78 8.01 -1.26 -0.64 118.70 126.06 2ozx s GLU 42 Ca 0.22 -0.45 0.00 0.00 0.01 0.00 0.00 54.97 54.75 2ozx s GLU 42 Cb 0.01 -3.03 -0.03 0.00 -4.31 0.00 0.00 34.13 26.77 2ozx s GLU 42 CO 0.06 0.59 -0.04 0.96 0.01 0.00 0.00 175.26 176.85 2ozx s ILE 43 N -1.55 0.30 -0.15 -1.63 -4.36 0.27 -4.95 121.20 109.13 2ozx s ILE 43 Ca 0.35 -1.49 -0.03 0.00 -0.26 0.00 0.00 60.65 59.22 2ozx s ILE 43 Cb -0.13 -1.08 -0.03 0.00 1.25 0.00 0.00 42.46 42.47 2ozx s ILE 43 CO 0.28 -0.77 -0.04 -0.69 0.24 0.00 0.00 174.94 173.96 2ozx s VAL 44 N -2.89 3.84 0.00 8.37 1.01 -0.75 -2.01 120.40 127.96 2ozx s VAL 44 Ca -0.01 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 61.62 2ozx s VAL 44 Cb 0.00 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2ozx s VAL 44 CO -0.05 0.50 -0.09 -0.13 0.00 0.00 0.00 175.10 175.33 2ozx s ARG 45 N 0.31 0.70 -0.30 2.72 1.81 -0.94 -2.31 118.95 120.94 2ozx s ARG 45 Ca -0.04 -0.37 -0.10 0.00 -1.72 0.00 0.00 55.73 53.50 2ozx s ARG 45 Cb -0.14 -0.66 0.19 0.00 -0.45 0.00 0.00 34.95 33.88 2ozx s ARG 45 CO 0.03 0.18 1.01 0.20 -0.68 0.00 0.00 175.30 176.04 2ozx s GLY 46 N -0.37 -0.91 -0.05 -3.53 0.00 -1.21 -1.15 107.32 100.10 2ozx s GLY 46 Ca 0.02 2.09 0.02 0.00 0.00 0.00 0.00 44.72 46.85 2ozx s GLY 46 CO -0.00 4.05 -0.10 -0.19 0.00 0.00 0.00 173.10 176.86 2ozx s TYR 47 N 2.95 1.22 0.59 1.90 2.02 -1.26 -1.20 117.35 123.57 2ozx s TYR 47 Ca 0.24 -0.39 0.29 0.00 -0.37 0.00 0.00 57.07 56.84 2ozx s TYR 47 Cb -0.03 -0.90 1.78 0.00 -0.40 0.00 0.00 41.96 42.41 2ozx s TYR 47 CO -0.22 -0.21 2.23 1.57 -1.57 0.00 0.00 175.55 177.36 2ozx h LYS 48 N 6.80 0.00 0.00 -0.62 2.10 -1.18 -1.60 116.57 122.06 2ozx h LYS 48 Ca -0.33 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.31 2ozx h LYS 48 Cb 1.18 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.50 2ozx h LYS 48 CO 0.48 0.00 -0.03 0.11 -2.00 0.00 0.00 179.45 178.01 2ozx h TRP 49 N 0.00 0.00 -3.65 0.07 5.08 -1.96 -3.46 115.95 112.02 2ozx h TRP 49 Ca 0.01 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.45 2ozx h TRP 49 Cb 0.07 0.00 0.07 0.00 -3.00 0.00 0.00 29.16 26.30 2ozx h TRP 49 CO 0.00 0.03 0.74 0.00 -1.28 0.00 0.00 178.44 177.92 2ozx s ALA 50 N -3.78 3.58 0.16 0.11 0.00 -0.61 -4.93 121.76 116.30 2ozx s ALA 50 Ca -0.00 1.38 -0.11 0.00 0.00 0.00 0.00 51.96 53.23 2ozx s ALA 50 Cb 0.10 -3.55 0.02 0.00 0.00 0.00 0.00 23.12 19.69 2ozx s ALA 50 CO 0.53 -0.80 1.58 1.49 0.00 0.00 0.00 175.76 178.57 2ozx h GLU 51 N 4.06 0.95 -3.33 0.00 4.81 -1.90 -3.47 114.58 115.71 2ozx h GLU 51 Ca -0.48 -0.35 -0.00 0.00 -0.13 0.00 0.00 59.36 58.40 2ozx h GLU 51 Cb 1.22 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.47 2ozx h GLU 51 CO 0.71 1.01 0.06 0.71 -0.73 0.00 0.00 179.01 180.77 2ozx s TYR 52 N -4.87 0.11 0.40 0.92 2.02 -1.26 -5.00 117.35 109.68 2ozx s TYR 52 Ca -0.12 -0.53 0.19 0.00 -0.37 0.00 0.00 57.07 56.24 2ozx s TYR 52 Cb 0.12 0.46 1.12 0.00 -0.40 0.00 0.00 41.96 43.26 2ozx s TYR 52 CO 0.85 -1.14 1.76 1.12 -1.57 0.00 0.00 175.55 176.57 2ozx h HIS 53 N 2.12 0.64 0.00 2.71 2.07 -1.89 0.16 115.15 120.97 2ozx h HIS 53 Ca -0.23 0.02 -0.07 0.00 -2.85 0.00 0.00 60.37 57.24 2ozx h HIS 53 Cb 1.25 -0.19 -0.01 0.00 2.57 0.00 0.00 27.41 31.03 2ozx h HIS 53 CO 0.49 0.05 -0.34 0.00 -3.07 0.00 0.00 177.93 175.06 2ozx h ALA 54 N 1.62 1.24 -0.44 6.11 0.00 -1.95 -0.96 119.26 124.88 2ozx h ALA 54 Ca 0.60 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 2ozx h ALA 54 Cb 1.56 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2ozx h ALA 54 CO -0.30 0.43 -0.10 0.22 0.00 0.00 0.00 179.25 179.50 2ozx h ASP 55 N 0.00 0.85 0.12 0.00 3.58 -1.35 -1.27 116.42 118.36 2ozx h ASP 55 Ca -0.00 -0.36 -0.01 0.00 0.42 0.00 0.00 57.03 57.08 2ozx h ASP 55 Cb 0.69 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2ozx h ASP 55 CO 0.04 1.01 -0.06 0.40 -2.88 0.00 0.00 179.24 177.75 2ozx h ILE 56 N 0.67 0.93 -0.73 2.25 2.04 -1.37 -2.42 117.51 118.89 2ozx h ILE 56 Ca 0.11 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.84 2ozx h ILE 56 Cb 0.63 1.07 -0.07 0.00 -0.74 0.00 0.00 36.82 37.72 2ozx h ILE 56 CO 0.04 0.05 0.40 0.22 0.00 0.00 0.00 178.15 178.86 2ozx h TYR 57 N -0.27 0.72 -0.15 1.37 3.20 -0.96 0.25 116.97 121.13 2ozx h TYR 57 Ca -0.02 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 2ozx h TYR 57 Cb 0.22 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2ozx h TYR 57 CO -0.04 0.31 0.07 0.22 -1.64 0.00 0.00 178.16 177.08 2ozx h ASP 58 N 0.70 0.20 -0.05 -2.11 3.58 -1.16 -0.13 116.42 117.45 2ozx h ASP 58 Ca 0.35 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.66 2ozx h ASP 58 Cb 0.29 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.29 2ozx h ASP 58 CO -0.23 0.28 0.03 0.11 -2.88 0.00 0.00 179.24 176.55 2ozx h LYS 59 N 0.12 0.07 -0.40 0.28 1.79 -0.98 -1.94 116.57 115.50 2ozx h LYS 59 Ca 0.05 -0.01 -0.09 0.00 -2.18 0.00 0.00 60.65 58.43 2ozx h LYS 59 Cb 0.13 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 2ozx h LYS 59 CO -0.01 0.07 -0.09 0.28 -1.08 0.00 0.00 179.45 178.62 2ozx h VAL 60 N 0.04 1.27 -0.69 0.50 2.07 -0.88 -0.93 116.25 117.63 2ozx h VAL 60 Ca 0.02 -1.18 0.04 0.00 0.82 0.00 0.00 66.70 66.40 2ozx h VAL 60 Cb 0.02 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2ozx h VAL 60 CO -0.00 0.40 0.46 0.28 0.02 0.00 0.00 177.57 178.72 2ozx h SER 61 N 0.58 0.70 -0.24 0.57 0.02 -0.90 0.09 113.55 114.37 2ozx h SER 61 Ca 0.10 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2ozx h SER 61 Cb 0.62 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2ozx h SER 61 CO 0.04 0.48 0.10 1.23 -1.14 0.00 0.00 176.83 177.53 2ozx h GLY 62 N 0.81 0.38 0.97 -3.77 0.00 -0.79 -2.72 103.07 97.95 2ozx h GLY 62 Ca 0.28 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 2ozx h GLY 62 CO -0.08 0.19 0.15 -1.80 0.00 0.00 0.00 176.54 175.00 2ozx h ASP 63 N 0.23 0.31 -0.57 0.19 3.58 -0.03 -2.61 116.42 117.53 2ozx h ASP 63 Ca 0.08 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.45 2ozx h ASP 63 Cb 0.17 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.11 2ozx h ASP 63 CO -0.01 0.28 0.29 0.24 -2.88 0.00 0.00 179.24 177.16 2ozx h MET 64 N 0.31 0.85 -0.48 0.28 2.86 -1.05 -0.19 114.93 117.51 2ozx h MET 64 Ca 0.09 -0.11 -0.06 0.00 -2.06 0.00 0.00 59.70 57.56 2ozx h MET 64 Cb 0.03 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 2ozx h MET 64 CO -0.02 0.66 0.06 1.96 1.06 0.00 0.00 176.91 180.63 2ozx h GLN 65 N 0.85 0.77 -0.09 1.72 4.20 -1.26 0.14 115.11 121.43 2ozx h GLN 65 Ca 0.21 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.65 2ozx h GLN 65 Cb 0.09 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2ozx h GLN 65 CO -0.03 0.74 -0.36 0.87 -0.67 0.00 0.00 178.83 179.38 2ozx h LYS 66 N 0.73 0.18 0.43 1.46 1.57 -0.72 -3.21 116.57 117.00 2ozx h LYS 66 Ca 0.15 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 2ozx h LYS 66 Cb 0.36 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2ozx h LYS 66 CO 0.01 0.52 -0.21 1.96 -0.57 0.00 0.00 179.45 181.16 2ozx h GLN 67 N 0.15 -0.56 0.00 3.15 1.08 -0.34 -3.44 115.11 115.15 2ozx h GLN 67 Ca 0.02 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 2ozx h GLN 67 Cb 0.72 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.27 2ozx h GLN 67 CO 0.05 -0.25 0.00 0.41 -0.95 0.00 0.00 178.83 178.09 2ozx n GLY 68 N -0.27 0.36 3.35 3.46 0.00 0.06 -4.37 105.19 107.79 2ozx n GLY 68 Ca -0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2ozx n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozx s ASP 70 N -3.19 0.47 0.24 0.00 2.15 -0.50 -2.95 116.67 112.90 2ozx s ASP 70 Ca 0.34 -1.17 0.08 0.00 0.43 0.00 0.00 52.55 52.24 2ozx s ASP 70 Cb 0.03 0.25 -0.05 0.00 -0.30 0.00 0.00 42.92 42.85 2ozx s ASP 70 CO 0.16 -0.68 -0.13 0.00 -0.17 0.00 0.00 175.17 174.36 2ozx s GLU 72 N -3.65 0.29 0.31 0.00 2.12 -0.03 -4.99 118.70 112.76 2ozx s GLU 72 Ca 0.26 0.41 -0.29 0.00 0.36 0.00 0.00 54.97 55.70 2ozx s GLU 72 Cb 0.00 -0.74 -0.11 0.00 0.26 0.00 0.00 34.13 33.54 2ozx s GLU 72 CO 0.10 -0.66 1.53 0.00 -0.54 0.00 0.00 175.26 175.69 2ozx n LEU 74 N 1.60 0.38 0.00 0.00 4.77 -0.20 -4.88 117.00 118.68 2ozx n LEU 74 Ca 0.05 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 2ozx n LEU 74 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2ozx n LEU 74 CO 0.63 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 2ozx n GLY 75 N 1.39 -1.39 3.21 -0.72 0.00 -1.20 -4.55 105.19 101.93 2ozx n GLY 75 Ca 0.01 -1.54 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 2ozx n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ozx n GLY 76 N -1.15 2.29 0.00 -0.02 0.00 -0.46 -1.35 105.19 104.50 2ozx n GLY 76 Ca 0.00 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.36 2ozx n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ozx n GLY 77 N -0.56 1.57 2.92 -0.02 0.00 -0.94 -1.50 105.19 106.66 2ozx n GLY 77 Ca 0.02 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 2ozx n GLY 77 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ozx s ARG 78 N 1.65 0.72 -0.28 1.61 0.52 0.03 -1.23 118.95 121.97 2ozx s ARG 78 Ca 0.00 -0.14 -0.10 0.00 -0.52 0.00 0.00 55.73 54.97 2ozx s ARG 78 Cb 0.00 -0.73 -0.04 0.00 0.52 0.00 0.00 34.95 34.70 2ozx s ARG 78 CO 0.00 -0.02 0.17 0.42 0.02 0.00 0.00 175.30 175.90 2ozx s ILE 79 N 0.60 5.12 -1.15 1.52 1.01 0.04 -1.09 121.20 127.25 2ozx s ILE 79 Ca -0.08 0.07 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 2ozx s ILE 79 Cb -0.11 -3.45 0.10 0.00 0.01 0.00 0.00 42.46 39.01 2ozx s ILE 79 CO 0.00 0.24 1.49 -0.44 0.00 0.00 0.00 174.94 176.23 2ozx s SER 80 N 1.73 6.79 0.95 3.58 0.01 0.58 -1.34 113.70 126.01 2ozx s SER 80 Ca 0.07 -2.31 -0.11 0.00 1.31 0.00 0.00 55.95 54.91 2ozx s SER 80 Cb -0.16 -2.50 0.16 0.00 0.21 0.00 0.00 66.02 63.73 2ozx s SER 80 CO 0.10 -1.11 1.09 -2.28 0.41 0.00 0.00 173.24 171.45 2ozx s HIS 81 N 3.41 1.89 0.48 2.43 2.46 -0.52 -1.41 115.29 124.04 2ozx s HIS 81 Ca 0.46 1.46 -0.22 0.00 0.47 0.00 0.00 55.06 57.22 2ozx s HIS 81 Cb -0.00 -3.19 -0.09 0.00 -0.13 0.00 0.00 32.58 29.17 2ozx s HIS 81 CO -0.01 -2.81 0.98 0.94 -2.47 0.00 0.00 174.74 171.37 2ozx n GLN 82 N -4.21 1.21 0.17 2.88 -0.06 -1.26 -4.03 117.38 112.08 2ozx n GLN 82 Ca 0.08 0.44 0.00 0.00 -2.00 0.00 0.00 57.00 55.52 2ozx n GLN 82 Cb 0.54 -2.08 0.00 0.00 -4.06 0.00 0.00 30.24 24.63 2ozx n GLN 82 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 2ozx n SER 83 N 0.11 -1.89 -2.89 1.69 3.41 -1.26 -4.05 113.62 108.75 2ozx n SER 83 Ca 0.11 0.61 -0.12 0.00 -0.26 0.00 0.00 58.87 59.20 2ozx n SER 83 Cb 0.42 1.89 0.05 0.00 -0.26 0.00 0.00 64.21 66.31 2ozx n SER 83 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2ozx n GLN 84 N -3.34 1.03 -3.50 4.33 -0.06 -1.26 -4.96 117.38 109.62 2ozx n GLN 84 Ca 0.00 -2.52 -0.23 0.00 -2.00 0.00 0.00 57.00 52.25 2ozx n GLN 84 Cb 0.00 -1.20 0.05 0.00 -4.06 0.00 0.00 30.24 25.03 2ozx n GLN 84 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 2ozx n ASP 85 N 0.22 -5.96 0.00 1.69 2.03 -1.26 -4.95 116.55 108.32 2ozx n ASP 85 Ca 0.12 -0.84 0.00 0.00 0.52 0.00 0.00 54.79 54.59 2ozx n ASP 85 Cb 0.71 -4.05 0.00 0.00 -0.72 0.00 0.00 41.12 37.05 2ozx n ASP 85 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2ozx n LYS 86 N -3.61 2.60 -1.28 -0.67 4.76 -1.26 -5.15 118.16 113.54 2ozx n LYS 86 Ca -0.09 -0.15 0.16 0.00 -2.87 0.00 0.00 58.31 55.36 2ozx n LYS 86 Cb 0.60 -0.57 -0.08 0.00 -1.84 0.00 0.00 35.03 33.13 2ozx n LYS 86 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2ozx n LYS 87 N -0.42 -2.93 -2.46 1.97 0.00 -1.26 -4.83 118.16 108.23 2ozx n LYS 87 Ca 0.00 2.36 -0.41 0.00 0.00 0.00 0.00 58.31 60.26 2ozx n LYS 87 Cb 0.03 -3.44 -0.04 0.00 0.00 0.00 0.00 35.03 31.58 2ozx n LYS 87 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2ozx s ILE 88 N -3.93 3.81 0.12 3.15 1.01 -1.09 -4.02 121.20 120.25 2ozx s ILE 88 Ca 0.00 1.51 0.03 0.00 0.00 0.00 0.00 60.65 62.19 2ozx s ILE 88 Cb 0.00 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 2ozx s ILE 88 CO 0.00 0.24 -0.09 -2.28 0.00 0.00 0.00 174.94 172.81 2ozx s HIS 89 N -0.00 1.09 -0.00 3.97 2.46 -0.50 -1.84 115.29 120.46 2ozx s HIS 89 Ca 0.52 -0.82 -0.00 0.00 0.47 0.00 0.00 55.06 55.23 2ozx s HIS 89 Cb -0.30 -0.58 -0.00 0.00 -0.13 0.00 0.00 32.58 31.57 2ozx s HIS 89 CO 0.35 -0.02 0.01 0.08 -2.47 0.00 0.00 174.74 172.69 2ozx s VAL 90 N -3.37 0.01 0.31 0.89 1.01 -0.48 -0.31 120.40 118.45 2ozx s VAL 90 Ca 0.14 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.97 2ozx s VAL 90 Cb 0.03 -0.05 0.03 0.00 0.00 0.00 0.00 36.38 36.40 2ozx s VAL 90 CO -0.02 -0.03 0.56 0.00 0.00 0.00 0.00 175.10 175.61 2ozx n TYR 91 N 2.97 -1.83 -4.02 5.22 4.11 -0.25 -1.52 117.16 121.85 2ozx n TYR 91 Ca -0.13 -1.63 0.00 0.00 -0.00 0.00 0.00 57.90 56.14 2ozx n TYR 91 Cb 0.60 0.65 0.00 0.00 -0.00 0.00 0.00 39.34 40.58 2ozx n TYR 91 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2ozx n GLY 92 N -0.44 -1.86 3.75 -7.48 0.00 -1.22 -0.79 105.19 97.15 2ozx n GLY 92 Ca -0.05 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.51 2ozx n GLY 92 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ozx s TYR 93 N 0.00 0.13 -0.28 1.61 1.13 -1.26 -4.72 117.35 113.96 2ozx s TYR 93 Ca 0.00 -0.62 0.00 0.00 -1.41 0.00 0.00 57.07 55.04 2ozx s TYR 93 Cb 0.00 0.57 0.08 0.00 -1.10 0.00 0.00 41.96 41.51 2ozx s TYR 93 CO 0.00 -1.28 0.04 -1.12 -2.51 0.00 0.00 175.55 170.68 2ozx s SER 94 N -3.01 3.97 0.61 -0.18 0.01 -1.08 -4.53 113.70 109.48 2ozx s SER 94 Ca 0.17 -1.50 0.31 0.00 1.31 0.00 0.00 55.95 56.24 2ozx s SER 94 Cb -0.04 -1.06 1.78 0.00 0.21 0.00 0.00 66.02 66.91 2ozx s SER 94 CO 0.10 -0.35 2.14 0.24 0.41 0.00 0.00 173.24 175.78 2ozx h MET 95 N 7.98 0.00 0.00 12.44 0.00 -1.93 0.13 114.93 133.55 2ozx h MET 95 Ca -0.13 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.55 2ozx h MET 95 Cb 1.04 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.64 2ozx h MET 95 CO 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 176.91 177.30 2ozx h ALA 96 N 1.78 1.89 0.00 6.32 0.00 -2.01 -3.38 119.26 123.87 2ozx h ALA 96 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ozx h ALA 96 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2ozx h ALA 96 CO -0.00 0.08 -0.54 0.66 0.00 0.00 0.00 179.25 179.44 2ozx n TYR 97 N -4.46 0.00 0.00 0.00 4.01 -0.54 -5.13 117.16 111.05 2ozx n TYR 97 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 2ozx n TYR 97 Cb 0.14 0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 2ozx n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ozx n GLY 98 N 2.43 2.18 3.68 2.72 0.00 0.33 -4.75 105.19 111.78 2ozx n GLY 98 Ca 0.00 -1.91 -0.46 0.00 0.00 0.00 0.00 46.02 43.65 2ozx n GLY 98 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ozx n PRO 99 N -1.80 2.33 -0.82 1.61 -0.02 -1.26 -1.35 135.00 133.69 2ozx n PRO 99 Ca 0.00 0.85 -0.31 0.00 -2.02 0.00 0.00 63.50 62.02 2ozx n PRO 99 Cb 0.00 -2.69 0.15 0.00 -0.02 0.00 0.00 33.50 30.95 2ozx n PRO 99 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ozx s ALA 100 N 2.80 1.62 -1.35 3.55 0.00 -0.56 -4.63 121.76 123.19 2ozx s ALA 100 Ca 0.86 0.58 -0.12 0.00 0.00 0.00 0.00 51.96 53.28 2ozx s ALA 100 Cb -0.63 -3.43 0.11 0.00 0.00 0.00 0.00 23.12 19.16 2ozx s ALA 100 CO 0.44 -2.57 1.96 1.04 0.00 0.00 0.00 175.76 176.62 2ozx n GLN 101 N -4.02 3.26 0.10 0.00 3.00 -1.26 -4.83 117.38 113.63 2ozx n GLN 101 Ca 0.12 -3.17 0.20 0.00 -0.01 0.00 0.00 57.00 54.13 2ozx n GLN 101 Cb 0.52 -3.14 0.74 0.00 0.00 0.00 0.00 30.24 28.36 2ozx n GLN 101 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2ozx h HIS 102 N 6.16 0.00 -0.69 1.08 3.86 -1.97 0.61 115.15 124.20 2ozx h HIS 102 Ca 0.46 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.64 2ozx h HIS 102 Cb 0.68 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.12 2ozx h HIS 102 CO 1.34 0.00 0.31 0.00 0.86 0.00 0.00 177.93 180.43 2ozx h ALA 103 N 1.43 0.89 0.08 2.45 0.00 -1.99 0.11 119.26 122.23 2ozx h ALA 103 Ca 0.19 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2ozx h ALA 103 Cb 1.12 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2ozx h ALA 103 CO -0.00 0.48 -0.04 0.82 0.00 0.00 0.00 179.25 180.51 2ozx h ILE 104 N 0.97 1.04 -0.29 0.00 2.04 -1.29 -2.30 117.51 117.68 2ozx h ILE 104 Ca 0.23 -0.42 0.04 0.00 1.00 0.00 0.00 64.86 65.72 2ozx h ILE 104 Cb 0.16 1.31 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 2ozx h ILE 104 CO -0.03 0.10 0.07 0.28 0.00 0.00 0.00 178.15 178.57 2ozx h SER 105 N -0.29 0.03 -0.20 1.72 0.02 -1.38 -1.41 113.55 112.03 2ozx h SER 105 Ca -0.01 0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.85 2ozx h SER 105 Cb 0.25 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2ozx h SER 105 CO 0.02 0.05 -0.33 0.71 -1.14 0.00 0.00 176.83 176.14 2ozx h THR 106 N 0.18 1.28 -0.64 -2.27 1.35 -0.77 -0.23 112.91 111.82 2ozx h THR 106 Ca 0.13 -1.48 -0.09 0.00 -0.55 0.00 0.00 66.41 64.43 2ozx h THR 106 Cb 0.13 1.39 -0.02 0.00 -1.73 0.00 0.00 68.15 67.92 2ozx h THR 106 CO -0.17 0.48 0.05 -0.33 -0.25 0.00 0.00 175.52 175.31 2ozx h GLU 107 N 0.60 1.09 -0.11 4.72 4.39 -1.20 0.12 114.58 124.19 2ozx h GLU 107 Ca 0.06 -0.32 -0.00 0.00 0.34 0.00 0.00 59.36 59.44 2ozx h GLU 107 Cb 0.85 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.39 2ozx h GLU 107 CO 0.07 1.02 0.05 0.87 -1.16 0.00 0.00 179.01 179.87 2ozx h LYS 108 N 1.00 0.16 -0.79 2.33 1.57 -0.97 0.22 116.57 120.09 2ozx h LYS 108 Ca 0.19 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.99 2ozx h LYS 108 Cb 0.50 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 2ozx h LYS 108 CO 0.02 0.24 0.49 0.82 -0.57 0.00 0.00 179.45 180.45 2ozx h ILE 109 N 0.04 1.07 -0.58 1.86 2.04 -0.84 -0.81 117.51 120.29 2ozx h ILE 109 Ca 0.04 -0.32 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 2ozx h ILE 109 Cb 0.13 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.25 2ozx h ILE 109 CO -0.00 0.17 0.13 0.50 0.00 0.00 0.00 178.15 178.95 2ozx h LYS 110 N 0.93 0.89 -0.53 2.37 3.64 -0.26 0.78 116.57 124.39 2ozx h LYS 110 Ca 0.33 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 2ozx h LYS 110 Cb 0.10 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2ozx h LYS 110 CO -0.15 0.81 0.06 0.00 -2.27 0.00 0.00 179.45 177.90 2ozx h ALA 111 N 1.28 0.70 -0.03 5.00 0.00 -0.43 -2.53 119.26 123.26 2ozx h ALA 111 Ca 0.18 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2ozx h ALA 111 Cb 0.32 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2ozx h ALA 111 CO 0.00 0.46 -0.09 -0.22 0.00 0.00 0.00 179.25 179.41 2ozx h LYS 112 N 0.77 0.05 -6.35 0.00 1.63 -0.52 -3.48 116.57 108.68 2ozx h LYS 112 Ca 0.16 -0.01 -0.47 0.00 -0.85 0.00 0.00 60.65 59.48 2ozx h LYS 112 Cb 0.44 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.07 2ozx h LYS 112 CO 0.01 0.14 -0.90 0.98 -3.45 0.00 0.00 179.45 176.24 2ozx n TYR 113 N -4.41 -1.77 0.46 1.91 9.36 0.21 -4.91 117.16 118.01 2ozx n TYR 113 Ca -0.02 0.66 0.12 0.00 3.32 0.00 0.00 57.90 61.98 2ozx n TYR 113 Cb 0.18 -3.74 0.47 0.00 -0.63 0.00 0.00 39.34 35.61 2ozx n TYR 113 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2ozx n PRO 114 N -4.32 0.20 -3.90 2.98 -0.04 -1.26 -4.85 135.00 123.81 2ozx n PRO 114 Ca -0.24 0.37 -0.09 0.00 -0.04 0.00 0.00 63.50 63.49 2ozx n PRO 114 Cb 0.65 -1.84 -0.06 0.00 -0.04 0.00 0.00 33.50 32.21 2ozx n PRO 114 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2ozx s ASP 115 N -4.24 -0.03 0.40 3.54 2.15 -1.26 -5.08 116.67 112.15 2ozx s ASP 115 Ca 0.06 -0.76 0.08 0.00 0.43 0.00 0.00 52.55 52.36 2ozx s ASP 115 Cb 0.10 0.47 0.85 0.00 -0.30 0.00 0.00 42.92 44.04 2ozx s ASP 115 CO 0.43 -0.93 2.00 0.22 -0.17 0.00 0.00 175.17 176.73 2ozx h TYR 116 N 2.46 0.59 -3.20 -5.34 3.20 -2.01 -3.45 116.97 109.23 2ozx h TYR 116 Ca -0.31 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.50 2ozx h TYR 116 Cb 1.24 -0.20 -0.16 0.00 1.54 0.00 0.00 36.73 39.15 2ozx h TYR 116 CO 0.39 0.33 -0.16 -2.00 -1.64 0.00 0.00 178.16 175.08 2ozx s GLU 117 N -5.54 0.90 -0.03 1.82 2.56 -1.26 -5.11 118.70 112.04 2ozx s GLU 117 Ca -0.09 -0.48 -0.02 0.00 0.00 0.00 0.00 54.97 54.38 2ozx s GLU 117 Cb 0.19 0.40 0.01 0.00 2.00 0.00 0.00 34.13 36.73 2ozx s GLU 117 CO 0.75 -0.31 0.07 0.08 -0.56 0.00 0.00 175.26 175.29 2ozx s VAL 118 N -2.74 -0.02 0.22 3.70 1.01 -1.26 -2.69 120.40 118.63 2ozx s VAL 118 Ca -0.04 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.97 2ozx s VAL 118 Cb -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 36.38 36.23 2ozx s VAL 118 CO -0.04 0.02 0.21 0.42 0.00 0.00 0.00 175.10 175.71 2ozx s THR 119 N 0.35 0.00 0.19 3.92 -4.23 -0.77 -5.00 115.64 110.10 2ozx s THR 119 Ca -0.03 -1.87 -0.09 0.00 -1.18 0.00 0.00 61.69 58.52 2ozx s THR 119 Cb -0.04 -2.44 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 2ozx s THR 119 CO -0.01 0.00 0.31 -1.66 -0.54 0.00 0.00 174.62 172.72 2ozx s TRP 120 N -4.09 0.46 0.33 3.99 1.48 -1.26 -1.38 118.94 118.47 2ozx s TRP 120 Ca 0.36 -0.80 -0.06 0.00 -1.06 0.00 0.00 56.10 54.53 2ozx s TRP 120 Cb 0.05 -0.05 0.01 0.00 -1.16 0.00 0.00 33.47 32.32 2ozx s TRP 120 CO 0.12 -0.77 0.51 0.00 -4.06 0.00 0.00 176.95 172.75 2ozx s ALA 121 N -4.00 0.41 -0.23 2.67 0.00 -0.57 -4.90 121.76 115.14 2ozx s ALA 121 Ca 0.20 -1.31 0.17 0.00 0.00 0.00 0.00 51.96 51.02 2ozx s ALA 121 Cb 0.03 1.08 0.40 0.00 0.00 0.00 0.00 23.12 24.63 2ozx s ALA 121 CO 0.03 -0.82 1.28 -1.71 0.00 0.00 0.00 175.76 174.53 2ozx n ASN 122 N -1.21 0.00 0.26 0.00 2.85 -1.26 -4.18 115.26 111.72 2ozx n ASN 122 Ca -0.01 -2.09 0.14 0.00 -0.11 0.00 0.00 54.58 52.51 2ozx n ASN 122 Cb 0.61 0.09 0.83 0.00 1.24 0.00 0.00 39.78 42.56 2ozx n ASN 122 CO 0.00 0.00 0.00 -0.78 -2.11 0.00 0.00 177.26 174.37 2ozx h ASP 123 N 1.48 0.00 -5.70 1.20 3.58 -1.97 -3.46 116.42 111.55 2ozx h ASP 123 Ca -0.32 0.00 0.29 0.00 0.42 0.00 0.00 57.03 57.42 2ozx h ASP 123 Cb 1.37 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.35 2ozx h ASP 123 CO -0.03 0.00 0.80 -0.83 -2.88 0.00 0.00 179.24 176.30 2ozx s GLY 124 N -4.08 -0.10 0.00 -0.78 0.00 -1.26 -5.14 107.32 95.97 2ozx s GLY 124 Ca -0.05 0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.69 2ozx s GLY 124 CO 0.58 3.94 0.48 2.98 0.00 0.00 0.00 173.10 181.07