#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ozx n ALA 2 N 0.00 -0.09 -1.77 -5.12 0.00 -0.58 -4.87 120.51 108.07 2ozx n ALA 2 Ca 0.00 -0.67 -0.40 0.00 0.00 0.00 0.00 53.44 52.37 2ozx n ALA 2 Cb 0.00 0.54 0.01 0.00 0.00 0.00 0.00 19.45 20.00 2ozx n ALA 2 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2ozx s VAL 3 N -2.58 2.06 0.29 0.00 -7.23 -1.26 -0.69 120.40 110.99 2ozx s VAL 3 Ca 0.12 0.06 -0.19 0.00 -1.81 0.00 0.00 61.98 60.16 2ozx s VAL 3 Cb -0.00 -3.03 0.02 0.00 0.56 0.00 0.00 36.38 33.92 2ozx s VAL 3 CO 0.09 0.01 0.68 0.00 -0.31 0.00 0.00 175.10 175.57 2ozx s ALA 4 N -1.18 -0.95 -0.01 1.32 0.00 -1.26 -4.83 121.76 114.85 2ozx s ALA 4 Ca 0.59 -0.49 -0.19 0.00 0.00 0.00 0.00 51.96 51.87 2ozx s ALA 4 Cb -0.44 0.87 0.03 0.00 0.00 0.00 0.00 23.12 23.58 2ozx s ALA 4 CO 0.58 -1.00 0.40 0.34 0.00 0.00 0.00 175.76 176.08 2ozx s ASP 5 N -2.96 -0.30 0.57 0.00 2.15 -1.26 -4.72 116.67 110.15 2ozx s ASP 5 Ca 0.14 0.20 0.26 0.00 0.43 0.00 0.00 52.55 53.58 2ozx s ASP 5 Cb -0.05 0.37 1.65 0.00 -0.30 0.00 0.00 42.92 44.59 2ozx s ASP 5 CO 0.08 -0.51 2.20 -0.07 -0.17 0.00 0.00 175.17 176.70 2ozx h LEU 6 N 3.57 0.00 -2.03 -1.34 3.38 -1.96 -1.12 115.31 115.82 2ozx h LEU 6 Ca -0.29 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 2ozx h LEU 6 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 2ozx h LEU 6 CO 0.40 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 178.84 2ozx h ALA 7 N 1.96 1.47 0.00 1.53 0.00 -2.02 -2.51 119.26 119.70 2ozx h ALA 7 Ca 0.02 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2ozx h ALA 7 Cb 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2ozx h ALA 7 CO -0.00 0.11 -0.42 -0.07 0.00 0.00 0.00 179.25 178.88 2ozx h LEU 8 N 0.00 0.00 -9.19 0.00 3.38 -1.62 -3.44 115.31 104.44 2ozx h LEU 8 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2ozx h LEU 8 Cb 0.22 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2ozx h LEU 8 CO 0.01 0.42 0.71 -0.63 0.09 0.00 0.00 178.44 179.04 2ozx s ILE 9 N -3.30 4.60 0.18 1.22 1.01 -0.95 -4.99 121.20 118.97 2ozx s ILE 9 Ca 0.02 1.90 -0.33 0.00 0.00 0.00 0.00 60.65 62.24 2ozx s ILE 9 Cb 0.09 -4.23 -0.15 0.00 0.01 0.00 0.00 42.46 38.19 2ozx s ILE 9 CO 0.71 -0.08 1.29 -2.65 0.00 0.00 0.00 174.94 174.21 2ozx n PRO 10 N 5.70 1.49 0.06 2.79 -0.02 -1.26 -4.90 135.00 138.85 2ozx n PRO 10 Ca 0.11 0.53 -0.05 0.00 -2.02 0.00 0.00 63.50 62.07 2ozx n PRO 10 Cb 0.47 -2.12 -0.09 0.00 -0.02 0.00 0.00 33.50 31.74 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 3.99 0.00 -3.67 2.55 3.58 -1.93 -3.44 116.42 117.49 2ozx h ASP 11 Ca -0.44 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 56.68 2ozx h ASP 11 Cb 1.32 0.00 -0.31 0.00 1.72 0.00 0.00 39.33 42.05 2ozx h ASP 11 CO 0.74 0.86 -0.75 -0.69 -2.88 0.00 0.00 179.24 176.53 2ozx s VAL 12 N -2.76 0.27 -0.22 2.25 1.01 -1.26 -1.81 120.40 117.89 2ozx s VAL 12 Ca 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 2ozx s VAL 12 Cb 0.09 -0.29 0.11 0.00 0.00 0.00 0.00 36.38 36.29 2ozx s VAL 12 CO 0.80 0.12 0.37 -0.62 0.00 0.00 0.00 175.10 175.77 2ozx s ASP 13 N 0.45 0.19 0.26 3.32 2.15 -0.77 -4.99 116.67 117.28 2ozx s ASP 13 Ca -0.05 0.45 0.01 0.00 0.43 0.00 0.00 52.55 53.40 2ozx s ASP 13 Cb -0.08 1.09 -0.05 0.00 -0.30 0.00 0.00 42.92 43.59 2ozx s ASP 13 CO -0.01 -0.28 0.11 0.27 -0.17 0.00 0.00 175.17 175.10 2ozx s ILE 14 N 2.54 0.42 -0.17 4.11 -4.36 -1.26 -2.69 121.20 119.79 2ozx s ILE 14 Ca 0.07 -2.00 0.19 0.00 -0.26 0.00 0.00 60.65 58.66 2ozx s ILE 14 Cb -0.14 -2.59 0.46 0.00 1.25 0.00 0.00 42.46 41.44 2ozx s ILE 14 CO -0.14 0.00 1.16 -0.67 0.24 0.00 0.00 174.94 175.53 2ozx n ASP 15 N -0.53 1.92 -4.60 4.36 2.03 -0.97 -4.96 116.55 113.81 2ozx n ASP 15 Ca 0.01 -2.61 -0.51 0.00 0.52 0.00 0.00 54.79 52.20 2ozx n ASP 15 Cb 0.66 -0.40 -0.05 0.00 -0.72 0.00 0.00 41.12 40.60 2ozx n ASP 15 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2ozx n SER 16 N -0.32 1.80 0.00 1.67 7.64 -1.26 -4.72 113.62 118.43 2ozx n SER 16 Ca 0.15 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.14 2ozx n SER 16 Cb 0.93 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2ozx n SER 16 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2ozx n ASP 17 N 2.54 0.00 0.00 6.43 2.03 -1.26 -5.13 116.55 121.15 2ozx n ASP 17 Ca 0.17 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.48 2ozx n ASP 17 Cb 0.21 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.61 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 -0.81 4.02 3.77 0.27 0.00 -1.26 -5.05 105.19 106.13 2ozx n GLY 18 Ca 0.00 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 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 -1.00 2.16 -0.03 1.61 1.01 -1.26 -4.60 120.40 118.29 2ozx s VAL 19 Ca 0.00 0.15 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 2ozx s VAL 19 Cb 0.00 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.30 2ozx s VAL 19 CO 0.00 0.03 0.21 0.72 0.00 0.00 0.00 175.10 176.06 2ozx s PHE 20 N -0.96 -0.10 0.47 5.22 -0.71 -0.52 -5.00 117.98 116.38 2ozx s PHE 20 Ca 0.54 0.18 -0.22 0.00 -1.04 0.00 0.00 56.93 56.38 2ozx s PHE 20 Cb -0.46 0.03 -0.07 0.00 -1.21 0.00 0.00 43.02 41.31 2ozx s PHE 20 CO 0.59 -0.26 1.15 0.15 -1.34 0.00 0.00 175.22 175.52 2ozx s LYS 21 N -0.93 3.72 0.06 1.99 1.02 -1.26 -0.86 119.74 123.48 2ozx s LYS 21 Ca -0.10 1.74 -0.04 0.00 0.02 0.00 0.00 55.97 57.58 2ozx s LYS 21 Cb -0.05 -2.36 -0.02 0.00 -0.52 0.00 0.00 37.83 34.88 2ozx s LYS 21 CO 0.02 -0.57 0.07 1.52 -0.92 0.00 0.00 175.35 175.46 2ozx s TYR 22 N -1.58 0.33 0.05 3.18 1.13 -0.50 -3.00 117.35 116.96 2ozx s TYR 22 Ca 0.65 -0.79 0.02 0.00 -1.41 0.00 0.00 57.07 55.54 2ozx s TYR 22 Cb -0.28 -0.23 -0.03 0.00 -1.10 0.00 0.00 41.96 40.33 2ozx s TYR 22 CO 0.33 -0.43 -0.08 0.54 -2.51 0.00 0.00 175.55 173.40 2ozx s VAL 23 N -3.59 0.57 -0.24 -3.49 0.11 0.20 -0.86 120.40 113.09 2ozx s VAL 23 Ca 0.03 -1.14 -0.02 0.00 -2.93 0.00 0.00 61.98 57.93 2ozx s VAL 23 Cb 0.05 -0.69 0.02 0.00 -1.53 0.00 0.00 36.38 34.23 2ozx s VAL 23 CO -0.09 -0.40 -0.06 -0.22 -3.33 0.00 0.00 175.10 170.99 2ozx s LEU 24 N -1.67 3.13 -0.03 2.54 2.96 -0.07 -2.22 118.68 123.33 2ozx s LEU 24 Ca -0.08 -0.83 0.06 0.00 -0.22 0.00 0.00 54.13 53.05 2ozx s LEU 24 Cb -0.09 -1.66 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 2ozx s LEU 24 CO 0.00 -0.12 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.09 2ozx s ILE 25 N 1.33 1.55 -0.05 6.68 1.01 -0.94 -1.06 121.20 129.72 2ozx s ILE 25 Ca 0.01 -0.82 -0.16 0.00 0.00 0.00 0.00 60.65 59.68 2ozx s ILE 25 Cb -0.16 -1.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.96 2ozx s ILE 25 CO -0.05 0.44 0.43 -0.60 0.00 0.00 0.00 174.94 175.16 2ozx s ARG 26 N -0.29 4.12 -0.08 2.79 3.52 0.36 -0.63 118.95 128.73 2ozx s ARG 26 Ca 0.03 0.41 -0.01 0.00 -0.13 0.00 0.00 55.73 56.04 2ozx s ARG 26 Cb -0.09 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 29.95 2ozx s ARG 26 CO 0.00 0.45 -0.02 0.08 -0.81 0.00 0.00 175.30 175.00 2ozx s VAL 27 N -0.31 4.11 -0.12 7.11 1.01 0.40 -1.18 120.40 131.40 2ozx s VAL 27 Ca 0.24 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.90 2ozx s VAL 27 Cb -0.16 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 2ozx s VAL 27 CO 0.12 0.60 -0.15 -1.00 0.00 0.00 0.00 175.10 174.67 2ozx s HIS 28 N -0.86 2.77 0.39 5.22 0.09 0.29 -1.55 115.29 121.64 2ozx s HIS 28 Ca 0.13 -0.71 -0.26 0.00 -0.00 0.00 0.00 55.06 54.22 2ozx s HIS 28 Cb -0.11 -1.82 -0.09 0.00 -0.00 0.00 0.00 32.58 30.56 2ozx s HIS 28 CO 0.02 -0.25 1.18 -1.54 -0.00 0.00 0.00 174.74 174.16 2ozx s SER 29 N 0.34 6.57 -0.44 1.40 1.04 0.03 -1.04 113.70 121.60 2ozx s SER 29 Ca -0.12 2.38 0.08 0.00 0.48 0.00 0.00 55.95 58.77 2ozx s SER 29 Cb -0.16 -2.62 0.32 0.00 0.10 0.00 0.00 66.02 63.66 2ozx s SER 29 CO 0.06 -0.65 0.97 0.00 0.98 0.00 0.00 173.24 174.61 2ozx n ALA 30 N 0.18 -0.00 -1.48 5.32 0.00 -0.54 -4.37 120.51 119.63 2ozx n ALA 30 Ca 0.04 -2.03 -0.36 0.00 0.00 0.00 0.00 53.44 51.09 2ozx n ALA 30 Cb 0.46 -1.10 0.09 0.00 0.00 0.00 0.00 19.45 18.89 2ozx n ALA 30 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2ozx n PRO 31 N 0.51 0.72 0.00 0.00 -0.02 -0.92 -3.79 135.00 131.51 2ozx n PRO 31 Ca 0.12 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2ozx n PRO 31 Cb 0.68 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 2ozx n PRO 31 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2ozx n ARG 32 N -2.22 0.00 0.00 -0.52 0.63 0.13 -0.99 116.66 113.68 2ozx n ARG 32 Ca 0.15 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 2ozx n ARG 32 Cb 0.49 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.40 2ozx n ARG 32 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2ozx n SER 33 N 1.18 0.00 -2.04 6.15 3.41 -1.25 -4.22 113.62 116.86 2ozx n SER 33 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 2ozx n SER 33 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 2ozx n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ozx n GLY 34 N -0.45 -0.25 3.59 5.00 0.00 -0.96 -4.99 105.19 107.13 2ozx n GLY 34 Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 2ozx n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozx n ALA 35 N -0.45 -0.95 -1.00 4.61 0.00 -0.16 -4.87 120.51 117.69 2ozx n ALA 35 Ca -0.10 -0.42 -0.29 0.00 0.00 0.00 0.00 53.44 52.63 2ozx n ALA 35 Cb 0.62 -2.08 -0.03 0.00 0.00 0.00 0.00 19.45 17.96 2ozx n ALA 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2ozx n PRO 36 N -2.75 2.81 -3.79 0.00 -0.04 -1.26 -4.66 135.00 125.31 2ozx n PRO 36 Ca 0.11 -1.76 -0.13 0.00 -0.04 0.00 0.00 63.50 61.68 2ozx n PRO 36 Cb 0.51 -2.58 -0.13 0.00 -0.04 0.00 0.00 33.50 31.26 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 2.73 -0.36 -0.01 0.55 0.00 -1.26 -5.05 121.76 118.36 2ozx s ALA 37 Ca 0.54 0.54 0.15 0.00 0.00 0.00 0.00 51.96 53.20 2ozx s ALA 37 Cb 0.15 -0.34 0.25 0.00 0.00 0.00 0.00 23.12 23.18 2ozx s ALA 37 CO -0.04 -0.11 1.10 0.00 0.00 0.00 0.00 175.76 176.71 2ozx n ALA 38 N 3.44 2.95 -0.95 0.00 0.00 -1.26 -4.37 120.51 120.32 2ozx n ALA 38 Ca -0.17 -1.66 -0.31 0.00 0.00 0.00 0.00 53.44 51.30 2ozx n ALA 38 Cb 0.56 -0.57 0.14 0.00 0.00 0.00 0.00 19.45 19.58 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 -0.05 1.38 0.05 0.00 0.41 -1.26 -4.71 118.70 114.52 2ozx s GLU 39 Ca 0.20 1.29 -0.02 0.00 -0.41 0.00 0.00 54.97 56.03 2ozx s GLU 39 Cb 0.23 -1.79 -0.03 0.00 -1.78 0.00 0.00 34.13 30.76 2ozx s GLU 39 CO -0.10 -2.30 0.00 -1.12 -0.49 0.00 0.00 175.26 171.26 2ozx s SER 40 N -3.00 0.42 0.24 -0.19 0.01 -1.26 -0.79 113.70 109.12 2ozx s SER 40 Ca 0.64 -0.92 -0.11 0.00 1.31 0.00 0.00 55.95 56.88 2ozx s SER 40 Cb -0.20 0.22 -0.01 0.00 0.21 0.00 0.00 66.02 66.23 2ozx s SER 40 CO 0.58 -0.61 0.42 -1.59 0.41 0.00 0.00 173.24 172.45 2ozx s LYS 41 N -3.79 1.50 0.14 12.44 -2.85 -0.59 -5.00 119.74 121.59 2ozx s LYS 41 Ca 0.06 -1.32 0.02 0.00 -1.00 0.00 0.00 55.97 53.72 2ozx s LYS 41 Cb 0.07 0.44 -0.04 0.00 -2.06 0.00 0.00 37.83 36.24 2ozx s LYS 41 CO -0.10 -0.61 0.28 -1.21 0.10 0.00 0.00 175.35 173.81 2ozx s GLU 42 N -4.02 3.44 0.05 1.78 8.01 -1.26 -0.45 118.70 126.25 2ozx s GLU 42 Ca 0.25 -0.58 0.01 0.00 0.01 0.00 0.00 54.97 54.67 2ozx s GLU 42 Cb 0.01 -2.97 -0.03 0.00 -4.31 0.00 0.00 34.13 26.82 2ozx s GLU 42 CO 0.10 0.53 -0.06 0.96 0.01 0.00 0.00 175.26 176.80 2ozx s ILE 43 N -1.72 0.47 -0.18 -1.63 -4.36 0.20 -4.93 121.20 109.04 2ozx s ILE 43 Ca 0.35 -1.38 -0.05 0.00 -0.26 0.00 0.00 60.65 59.31 2ozx s ILE 43 Cb -0.11 -0.96 -0.03 0.00 1.25 0.00 0.00 42.46 42.61 2ozx s ILE 43 CO 0.28 -0.62 -0.01 -0.69 0.24 0.00 0.00 174.94 174.15 2ozx s VAL 44 N -2.34 3.99 0.01 8.37 1.01 -0.75 -2.22 120.40 128.48 2ozx s VAL 44 Ca -0.03 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.67 2ozx s VAL 44 Cb -0.04 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2ozx s VAL 44 CO -0.03 0.45 -0.09 -0.13 0.00 0.00 0.00 175.10 175.31 2ozx s ARG 45 N 0.73 0.64 -0.29 2.72 1.81 -0.94 -1.84 118.95 121.77 2ozx s ARG 45 Ca -0.00 -0.45 -0.16 0.00 -1.72 0.00 0.00 55.73 53.40 2ozx s ARG 45 Cb -0.14 -0.58 0.18 0.00 -0.45 0.00 0.00 34.95 33.95 2ozx s ARG 45 CO 0.02 0.15 1.11 0.20 -0.68 0.00 0.00 175.30 176.10 2ozx s GLY 46 N -0.63 0.29 -0.06 -3.53 0.00 -1.10 -0.63 107.32 101.67 2ozx s GLY 46 Ca -0.00 3.47 -0.06 0.00 0.00 0.00 0.00 44.72 48.13 2ozx s GLY 46 CO 0.00 2.71 0.18 -0.19 0.00 0.00 0.00 173.10 175.80 2ozx s TYR 47 N 1.25 -0.16 0.13 1.90 2.02 -1.16 -2.28 117.35 119.05 2ozx s TYR 47 Ca -0.08 0.39 0.29 0.00 -0.37 0.00 0.00 57.07 57.30 2ozx s TYR 47 Cb -0.03 0.05 1.17 0.00 -0.40 0.00 0.00 41.96 42.75 2ozx s TYR 47 CO -0.13 -0.12 1.92 0.87 -1.57 0.00 0.00 175.55 176.52 2ozx h LYS 48 N 5.62 0.00 0.00 -0.62 1.57 -1.85 -3.09 116.57 118.19 2ozx h LYS 48 Ca -0.26 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.48 2ozx h LYS 48 Cb 1.20 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 2ozx h LYS 48 CO 0.40 0.10 -0.17 0.11 -0.57 0.00 0.00 179.45 179.33 2ozx h TRP 49 N 0.00 0.00 -3.02 -1.35 5.08 -1.98 -3.43 115.95 111.25 2ozx h TRP 49 Ca -0.00 0.00 -0.54 0.00 1.08 0.00 0.00 58.89 59.43 2ozx h TRP 49 Cb 0.61 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.76 2ozx h TRP 49 CO 0.00 0.17 0.74 0.00 -1.28 0.00 0.00 178.44 178.06 2ozx s ALA 50 N -4.08 3.52 0.24 0.11 0.00 -1.17 -4.91 121.76 115.47 2ozx s ALA 50 Ca -0.02 0.81 0.06 0.00 0.00 0.00 0.00 51.96 52.81 2ozx s ALA 50 Cb 0.13 -3.54 0.25 0.00 0.00 0.00 0.00 23.12 19.96 2ozx s ALA 50 CO 0.61 -0.77 1.56 0.93 0.00 0.00 0.00 175.76 178.09 2ozx h GLU 51 N 7.47 0.16 -3.49 0.00 5.08 -1.91 -3.47 114.58 118.43 2ozx h GLU 51 Ca -0.38 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 57.74 2ozx h GLU 51 Cb 1.18 0.02 -0.19 0.00 0.50 0.00 0.00 28.75 30.26 2ozx h GLU 51 CO 0.88 0.74 -0.43 0.71 -1.00 0.00 0.00 179.01 179.92 2ozx s TYR 52 N -3.66 0.03 0.49 4.33 2.02 -1.26 -5.06 117.35 114.24 2ozx s TYR 52 Ca -0.03 -0.17 0.18 0.00 -0.37 0.00 0.00 57.07 56.68 2ozx s TYR 52 Cb 0.12 -0.03 1.21 0.00 -0.40 0.00 0.00 41.96 42.86 2ozx s TYR 52 CO 0.79 -0.36 2.03 0.45 -1.57 0.00 0.00 175.55 176.89 2ozx h HIS 53 N 3.85 0.18 -0.23 2.71 3.86 -1.89 -1.12 115.15 122.51 2ozx h HIS 53 Ca -0.31 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 58.93 2ozx h HIS 53 Cb 1.19 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.59 2ozx h HIS 53 CO 0.55 0.09 0.15 0.00 0.86 0.00 0.00 177.93 179.58 2ozx h ALA 54 N 1.79 1.96 -0.38 2.45 0.00 -1.97 -1.18 119.26 121.93 2ozx h ALA 54 Ca 0.19 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 2ozx h ALA 54 Cb 0.53 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2ozx h ALA 54 CO -0.03 0.01 -0.23 0.22 0.00 0.00 0.00 179.25 179.22 2ozx h ASP 55 N 0.20 0.86 0.06 0.00 3.58 -1.63 -0.55 116.42 118.95 2ozx h ASP 55 Ca 0.09 -0.42 -0.00 0.00 0.42 0.00 0.00 57.03 57.12 2ozx h ASP 55 Cb 0.12 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 40.94 2ozx h ASP 55 CO -0.02 1.09 -0.03 0.40 -2.88 0.00 0.00 179.24 177.81 2ozx h ILE 56 N 0.63 1.03 -0.72 2.25 2.04 -1.50 -0.85 117.51 120.39 2ozx h ILE 56 Ca 0.08 -0.31 0.08 0.00 1.00 0.00 0.00 64.86 65.71 2ozx h ILE 56 Cb 0.79 1.24 -0.07 0.00 -0.74 0.00 0.00 36.82 38.04 2ozx h ILE 56 CO 0.06 0.08 0.38 0.22 0.00 0.00 0.00 178.15 178.89 2ozx h TYR 57 N -0.23 0.69 -0.26 1.37 3.20 -1.16 -0.21 116.97 120.38 2ozx h TYR 57 Ca -0.01 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 2ozx h TYR 57 Cb 0.20 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 2ozx h TYR 57 CO -0.03 0.28 0.08 0.22 -1.64 0.00 0.00 178.16 177.07 2ozx h ASP 58 N 0.66 0.37 -0.13 -2.11 3.58 -0.85 0.22 116.42 118.16 2ozx h ASP 58 Ca 0.35 -0.21 0.02 0.00 0.42 0.00 0.00 57.03 57.61 2ozx h ASP 58 Cb 0.32 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2ozx h ASP 58 CO -0.24 0.48 -0.02 0.11 -2.88 0.00 0.00 179.24 176.69 2ozx h LYS 59 N 0.25 0.01 -0.30 0.28 1.79 -0.78 -1.51 116.57 116.30 2ozx h LYS 59 Ca 0.08 -0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.48 2ozx h LYS 59 Cb 0.24 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 2ozx h LYS 59 CO -0.00 0.01 -0.08 0.28 -1.08 0.00 0.00 179.45 178.58 2ozx h VAL 60 N 0.01 1.28 -0.80 0.50 2.07 -0.91 -1.21 116.25 117.20 2ozx h VAL 60 Ca 0.06 -1.12 0.07 0.00 0.82 0.00 0.00 66.70 66.52 2ozx h VAL 60 Cb 0.09 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 2ozx h VAL 60 CO -0.12 0.36 0.47 0.28 0.02 0.00 0.00 177.57 178.58 2ozx h SER 61 N 0.36 0.72 -0.19 0.57 0.02 -0.80 -0.03 113.55 114.20 2ozx h SER 61 Ca 0.08 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2ozx h SER 61 Cb 0.57 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2ozx h SER 61 CO 0.03 0.45 0.10 1.23 -1.14 0.00 0.00 176.83 177.51 2ozx h GLY 62 N 0.85 0.25 0.93 -3.77 0.00 -0.93 -1.64 103.07 98.76 2ozx h GLY 62 Ca 0.36 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.60 2ozx h GLY 62 CO -0.19 0.07 0.11 -1.80 0.00 0.00 0.00 176.54 174.73 2ozx h ASP 63 N 0.22 0.29 -0.94 0.19 1.82 -0.27 -1.61 116.42 116.12 2ozx h ASP 63 Ca 0.07 -0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.60 2ozx h ASP 63 Cb -0.00 -0.08 -0.05 0.00 0.68 0.00 0.00 39.33 39.89 2ozx h ASP 63 CO -0.04 0.33 0.60 0.24 -1.61 0.00 0.00 179.24 178.76 2ozx h MET 64 N 0.24 1.25 -0.25 0.28 2.86 -0.95 -0.67 114.93 117.69 2ozx h MET 64 Ca 0.08 -0.09 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 2ozx h MET 64 Cb 0.11 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 2ozx h MET 64 CO -0.01 0.85 -0.14 1.96 1.06 0.00 0.00 176.91 180.62 2ozx h GLN 65 N 1.28 0.42 -0.25 1.72 4.20 -0.96 0.94 115.11 122.47 2ozx h GLN 65 Ca 0.34 -0.12 -0.08 0.00 0.06 0.00 0.00 58.65 58.85 2ozx h GLN 65 Cb -0.11 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2ozx h GLN 65 CO -0.07 0.56 -0.18 0.87 -0.67 0.00 0.00 178.83 179.35 2ozx h LYS 66 N 0.39 0.44 0.22 1.46 1.57 -0.18 -3.28 116.57 117.19 2ozx h LYS 66 Ca 0.07 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2ozx h LYS 66 Cb 0.49 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2ozx h LYS 66 CO 0.03 0.60 -0.11 1.96 -0.57 0.00 0.00 179.45 181.37 2ozx h GLN 67 N 0.40 -0.29 0.00 3.15 1.08 -0.31 -2.34 115.11 116.80 2ozx h GLN 67 Ca 0.07 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 2ozx h GLN 67 Cb 0.54 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2ozx h GLN 67 CO 0.04 -0.19 0.00 0.41 -0.95 0.00 0.00 178.83 178.14 2ozx n GLY 68 N 0.23 0.00 3.44 3.46 0.00 0.12 -1.53 105.19 110.91 2ozx n GLY 68 Ca -0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.21 0.12 0.12 0.00 2.15 -0.20 -2.45 116.67 113.19 2ozx s ASP 70 Ca 0.32 -1.00 0.05 0.00 0.43 0.00 0.00 52.55 52.36 2ozx s ASP 70 Cb 0.01 0.40 -0.04 0.00 -0.30 0.00 0.00 42.92 42.99 2ozx s ASP 70 CO 0.18 -0.85 -0.13 0.00 -0.17 0.00 0.00 175.17 174.20 2ozx s GLU 72 N -2.75 0.05 0.28 0.00 2.56 -0.33 -5.00 118.70 113.51 2ozx s GLU 72 Ca 0.09 0.14 -0.28 0.00 0.00 0.00 0.00 54.97 54.91 2ozx s GLU 72 Cb -0.04 -0.04 -0.09 0.00 2.00 0.00 0.00 34.13 35.95 2ozx s GLU 72 CO 0.02 -0.06 0.97 0.00 -0.56 0.00 0.00 175.26 175.64 2ozx n LEU 74 N 1.07 0.00 0.00 0.00 4.77 -0.22 -4.86 117.00 117.76 2ozx n LEU 74 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2ozx n LEU 74 Cb 0.48 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2ozx n LEU 74 CO 0.49 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 2ozx n GLY 75 N 1.49 -2.22 3.71 -0.72 0.00 -1.15 -4.75 105.19 101.55 2ozx n GLY 75 Ca -0.04 -1.38 -0.11 0.00 0.00 0.00 0.00 46.02 44.49 2ozx n GLY 75 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ozx s GLY 76 N 0.00 0.71 0.00 -0.02 0.00 -0.36 -0.89 107.32 106.77 2ozx s GLY 76 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.74 2ozx s GLY 76 CO 0.00 -0.52 0.00 0.61 0.00 0.00 0.00 173.10 173.19 2ozx n GLY 77 N -0.54 1.45 3.16 0.20 0.00 -0.04 -1.87 105.19 107.55 2ozx n GLY 77 Ca -0.05 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 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 3.32 0.80 0.03 1.61 0.52 0.13 -1.41 118.95 123.95 2ozx s ARG 78 Ca 0.00 -1.20 0.04 0.00 -0.52 0.00 0.00 55.73 54.05 2ozx s ARG 78 Cb 0.00 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.72 2ozx s ARG 78 CO 0.00 -0.22 -0.11 0.42 0.02 0.00 0.00 175.30 175.41 2ozx s ILE 79 N -3.94 0.87 0.31 1.52 1.01 -0.04 -2.01 121.20 118.92 2ozx s ILE 79 Ca 0.11 -0.86 -0.12 0.00 0.00 0.00 0.00 60.65 59.78 2ozx s ILE 79 Cb 0.07 -0.80 0.02 0.00 0.01 0.00 0.00 42.46 41.75 2ozx s ILE 79 CO -0.07 -0.04 0.59 -0.94 0.00 0.00 0.00 174.94 174.49 2ozx s SER 80 N -1.01 0.18 0.01 3.58 1.04 -0.36 -1.44 113.70 115.70 2ozx s SER 80 Ca -0.01 -1.09 -0.14 0.00 0.48 0.00 0.00 55.95 55.20 2ozx s SER 80 Cb -0.07 0.70 0.02 0.00 0.10 0.00 0.00 66.02 66.77 2ozx s SER 80 CO 0.01 -1.36 0.30 -2.28 0.98 0.00 0.00 173.24 170.89 2ozx s HIS 81 N -3.30 -0.14 0.00 5.02 2.46 -1.26 -0.88 115.29 117.18 2ozx s HIS 81 Ca 0.21 0.11 0.00 0.00 0.47 0.00 0.00 55.06 55.85 2ozx s HIS 81 Cb -0.03 0.09 0.00 0.00 -0.13 0.00 0.00 32.58 32.52 2ozx s HIS 81 CO 0.12 -0.44 0.00 1.04 -2.47 0.00 0.00 174.74 172.99 2ozx n GLN 82 N 0.93 3.60 -1.70 2.88 6.02 -1.26 -4.87 117.38 122.99 2ozx n GLN 82 Ca -0.20 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.61 2ozx n GLN 82 Cb 0.58 -0.38 -0.07 0.00 1.02 0.00 0.00 30.24 31.39 2ozx n GLN 82 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2ozx n SER 83 N -0.60 -4.90 0.00 1.08 7.64 -1.26 -4.56 113.62 111.02 2ozx n SER 83 Ca 0.00 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.26 2ozx n SER 83 Cb 0.00 -4.33 0.00 0.00 -1.01 0.00 0.00 64.21 58.87 2ozx n SER 83 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ozx n GLN 84 N -2.35 0.61 -3.55 1.43 10.64 -1.26 -5.14 117.38 117.76 2ozx n GLN 84 Ca -0.19 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 54.81 2ozx n GLN 84 Cb 0.61 -0.05 -0.06 0.00 -0.86 0.00 0.00 30.24 29.88 2ozx n GLN 84 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2ozx s ASP 85 N 0.00 -0.66 0.69 2.61 2.15 -1.26 -5.12 116.67 115.08 2ozx s ASP 85 Ca 0.00 0.84 0.00 0.00 0.43 0.00 0.00 52.55 53.82 2ozx s ASP 85 Cb 0.00 0.71 0.00 0.00 -0.30 0.00 0.00 42.92 43.33 2ozx s ASP 85 CO 0.00 -0.53 0.00 0.29 -0.17 0.00 0.00 175.17 174.76 2ozx n LYS 86 N 1.28 0.00 0.00 4.34 4.76 -1.26 -4.26 118.16 123.01 2ozx n LYS 86 Ca -0.18 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.26 2ozx n LYS 86 Cb 0.57 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.76 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 -0.37 0.79 -1.78 1.97 0.00 -1.26 -4.87 118.16 112.65 2ozx n LYS 87 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 58.31 57.88 2ozx n LYS 87 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 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 1.86 3.22 0.05 3.15 -1.09 -1.25 -4.39 121.20 122.76 2ozx s ILE 88 Ca 0.00 0.24 0.08 0.00 -2.23 0.00 0.00 60.65 58.74 2ozx s ILE 88 Cb 0.00 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.61 2ozx s ILE 88 CO 0.00 -0.12 -0.21 -2.28 -1.23 0.00 0.00 174.94 171.10 2ozx s HIS 89 N 6.58 2.47 -0.04 3.97 2.46 -0.06 -0.07 115.29 130.60 2ozx s HIS 89 Ca 0.89 -0.31 0.01 0.00 0.47 0.00 0.00 55.06 56.12 2ozx s HIS 89 Cb -0.32 -1.42 0.02 0.00 -0.13 0.00 0.00 32.58 30.73 2ozx s HIS 89 CO 0.35 0.23 -0.04 0.08 -2.47 0.00 0.00 174.74 172.90 2ozx s VAL 90 N -0.92 0.45 0.14 0.89 1.01 -0.58 -1.22 120.40 120.18 2ozx s VAL 90 Ca 0.14 -0.09 -0.25 0.00 0.00 0.00 0.00 61.98 61.78 2ozx s VAL 90 Cb -0.10 -0.49 0.07 0.00 0.00 0.00 0.00 36.38 35.86 2ozx s VAL 90 CO 0.05 0.20 0.97 -0.72 0.00 0.00 0.00 175.10 175.59 2ozx s TYR 91 N 0.85 -0.14 -2.76 5.22 1.13 -0.85 -1.53 117.35 119.27 2ozx s TYR 91 Ca -0.11 -0.16 0.00 0.00 -1.41 0.00 0.00 57.07 55.40 2ozx s TYR 91 Cb -0.14 0.63 0.00 0.00 -1.10 0.00 0.00 41.96 41.36 2ozx s TYR 91 CO -0.00 -0.80 0.00 0.41 -2.51 0.00 0.00 175.55 172.65 2ozx n GLY 92 N -0.46 0.79 0.00 5.49 0.00 -1.26 0.18 105.19 109.93 2ozx n GLY 92 Ca -0.06 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.85 2ozx n GLY 92 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2ozx n TYR 93 N 1.95 0.00 0.00 1.61 4.11 -1.21 -4.32 117.16 119.30 2ozx n TYR 93 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 2ozx n TYR 93 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.34 2ozx n TYR 93 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2ozx n SER 94 N 0.00 0.00 0.00 9.48 3.41 -1.16 -2.34 113.62 123.01 2ozx n SER 94 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2ozx n SER 94 Cb 0.28 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 2ozx n SER 94 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2ozx n MET 95 N -0.23 0.00 -0.02 4.33 1.56 -1.26 -4.57 117.12 116.93 2ozx n MET 95 Ca 0.00 0.00 0.07 0.00 -0.27 0.00 0.00 57.70 57.50 2ozx n MET 95 Cb 0.00 -0.05 0.46 0.00 2.15 0.00 0.00 33.22 35.78 2ozx n MET 95 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2ozx h ALA 96 N 0.00 1.84 0.00 -5.12 0.00 -2.00 -3.39 119.26 110.59 2ozx h ALA 96 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2ozx h ALA 96 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2ozx h ALA 96 CO 0.00 0.10 -0.30 0.66 0.00 0.00 0.00 179.25 179.71 2ozx n TYR 97 N -4.48 -0.05 0.00 0.00 4.01 -1.26 -5.07 117.16 110.31 2ozx n TYR 97 Ca 0.05 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2ozx n TYR 97 Cb 0.18 0.35 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 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 1.96 2.86 3.64 2.72 0.00 -0.99 -4.94 105.19 110.44 2ozx n GLY 98 Ca 0.00 -1.85 -0.47 0.00 0.00 0.00 0.00 46.02 43.69 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 -1.75 1.82 -1.18 1.61 -0.02 -1.18 -1.22 135.00 133.07 2ozx n PRO 99 Ca 0.00 0.66 -0.32 0.00 -2.02 0.00 0.00 63.50 61.82 2ozx n PRO 99 Cb 0.00 -2.36 0.11 0.00 -0.02 0.00 0.00 33.50 31.23 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 0.59 2.06 -1.26 3.55 0.00 -0.78 -4.46 121.76 121.47 2ozx s ALA 100 Ca 0.78 0.44 -0.17 0.00 0.00 0.00 0.00 51.96 53.01 2ozx s ALA 100 Cb -0.75 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.02 2ozx s ALA 100 CO 0.43 -1.98 2.02 1.04 0.00 0.00 0.00 175.76 177.27 2ozx n GLN 101 N -3.51 2.54 0.12 0.00 6.02 -1.26 -4.81 117.38 116.49 2ozx n GLN 101 Ca 0.10 -2.60 0.19 0.00 -0.01 0.00 0.00 57.00 54.69 2ozx n GLN 101 Cb 0.52 -3.31 0.77 0.00 1.02 0.00 0.00 30.24 29.25 2ozx n GLN 101 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2ozx h HIS 102 N 7.11 0.00 -0.77 1.08 3.86 -1.91 0.44 115.15 124.95 2ozx h HIS 102 Ca 0.48 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.66 2ozx h HIS 102 Cb 0.73 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.16 2ozx h HIS 102 CO 1.38 0.00 0.38 0.00 0.86 0.00 0.00 177.93 180.55 2ozx h ALA 103 N 1.63 1.00 0.02 2.45 0.00 -1.96 0.96 119.26 123.36 2ozx h ALA 103 Ca 0.16 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2ozx h ALA 103 Cb 0.84 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2ozx h ALA 103 CO -0.00 0.55 -0.01 0.82 0.00 0.00 0.00 179.25 180.61 2ozx h ILE 104 N 1.09 1.15 -0.64 0.00 2.04 -1.32 -2.12 117.51 117.71 2ozx h ILE 104 Ca 0.27 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.61 2ozx h ILE 104 Cb 0.11 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 2ozx h ILE 104 CO -0.03 0.13 0.42 0.28 0.00 0.00 0.00 178.15 178.95 2ozx h SER 105 N -0.25 0.74 -0.39 1.72 0.02 -1.33 -1.36 113.55 112.70 2ozx h SER 105 Ca -0.00 -0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 2ozx h SER 105 Cb 0.24 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 2ozx h SER 105 CO 0.00 0.54 -0.10 0.71 -1.14 0.00 0.00 176.83 176.84 2ozx h THR 106 N 0.87 1.26 -0.63 -2.27 1.35 -0.77 0.03 112.91 112.75 2ozx h THR 106 Ca 0.23 -1.19 -0.07 0.00 -0.55 0.00 0.00 66.41 64.83 2ozx h THR 106 Cb -0.09 1.01 -0.03 0.00 -1.73 0.00 0.00 68.15 67.31 2ozx h THR 106 CO -0.05 0.41 0.10 -0.33 -0.25 0.00 0.00 175.52 175.40 2ozx h GLU 107 N 0.76 1.02 -0.29 4.72 5.08 -1.06 0.61 114.58 125.42 2ozx h GLU 107 Ca 0.13 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 2ozx h GLU 107 Cb 0.60 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2ozx h GLU 107 CO 0.04 0.94 -0.02 0.87 -1.00 0.00 0.00 179.01 179.84 2ozx h LYS 108 N 0.96 0.53 -0.27 2.33 1.57 -0.85 0.82 116.57 121.66 2ozx h LYS 108 Ca 0.19 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2ozx h LYS 108 Cb 0.41 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 2ozx h LYS 108 CO 0.01 0.70 0.05 0.82 -0.57 0.00 0.00 179.45 180.46 2ozx h ILE 109 N 0.31 0.87 -1.01 1.86 2.04 -0.84 -2.33 117.51 118.41 2ozx h ILE 109 Ca 0.08 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.92 2ozx h ILE 109 Cb 0.47 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 2ozx h ILE 109 CO 0.02 0.03 0.66 0.50 0.00 0.00 0.00 178.15 179.36 2ozx h LYS 110 N 0.15 1.26 -0.21 2.37 3.64 -0.58 0.46 116.57 123.65 2ozx h LYS 110 Ca 0.12 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2ozx h LYS 110 Cb 0.13 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 2ozx h LYS 110 CO -0.17 0.84 0.07 0.00 -2.27 0.00 0.00 179.45 177.92 2ozx h ALA 111 N 1.40 1.72 0.00 5.00 0.00 -0.32 -1.65 119.26 125.40 2ozx h ALA 111 Ca 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2ozx h ALA 111 Cb -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2ozx h ALA 111 CO -0.11 0.22 -0.62 1.63 0.00 0.00 0.00 179.25 180.37 2ozx n LYS 112 N -4.43 0.16 -4.09 0.00 4.76 -0.64 -5.02 118.16 108.90 2ozx n LYS 112 Ca 0.00 0.03 -0.40 0.00 -2.87 0.00 0.00 58.31 55.07 2ozx n LYS 112 Cb 0.14 -1.59 -0.01 0.00 -1.84 0.00 0.00 35.03 31.73 2ozx n LYS 112 CO 0.00 0.00 0.00 2.48 -1.37 0.00 0.00 177.40 178.51 2ozx n TYR 113 N -1.81 -1.22 0.33 2.13 4.11 0.06 -4.86 117.16 115.90 2ozx n TYR 113 Ca 0.04 0.16 0.14 0.00 -0.00 0.00 0.00 57.90 58.24 2ozx n TYR 113 Cb 0.39 -2.52 0.61 0.00 -0.00 0.00 0.00 39.34 37.82 2ozx n TYR 113 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.86 175.86 2ozx h PRO 114 N -2.03 0.00 -4.12 -3.48 0.13 -1.88 -3.43 132.00 117.19 2ozx h PRO 114 Ca -0.64 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.38 2ozx h PRO 114 Cb 1.28 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.27 2ozx h PRO 114 CO 0.52 0.00 -0.59 0.34 -0.23 0.00 0.00 178.00 178.04 2ozx s ASP 115 N -4.61 0.38 0.27 1.44 -1.08 -1.26 -5.07 116.67 106.74 2ozx s ASP 115 Ca 0.02 -0.90 0.26 0.00 -0.52 0.00 0.00 52.55 51.40 2ozx s ASP 115 Cb 0.09 0.24 0.84 0.00 -1.46 0.00 0.00 42.92 42.64 2ozx s ASP 115 CO 0.40 -0.64 1.75 0.10 0.52 0.00 0.00 175.17 177.30 2ozx h TYR 116 N 3.02 0.00 -3.47 -5.34 -0.00 -1.98 -3.46 116.97 105.74 2ozx h TYR 116 Ca -0.34 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.27 2ozx h TYR 116 Cb 1.16 0.00 -0.18 0.00 0.00 0.00 0.00 36.73 37.71 2ozx h TYR 116 CO 0.50 0.00 -0.39 -2.00 -0.00 0.00 0.00 178.16 176.26 2ozx s GLU 117 N -3.21 0.65 0.04 0.10 2.56 -1.26 -5.10 118.70 112.47 2ozx s GLU 117 Ca 0.08 -0.52 -0.04 0.00 0.00 0.00 0.00 54.97 54.49 2ozx s GLU 117 Cb 0.10 0.27 -0.01 0.00 2.00 0.00 0.00 34.13 36.49 2ozx s GLU 117 CO 0.55 -0.18 0.07 0.08 -0.56 0.00 0.00 175.26 175.22 2ozx s VAL 118 N -2.13 0.14 0.07 3.70 1.01 -1.26 -3.94 120.40 117.98 2ozx s VAL 118 Ca -0.08 -1.12 -0.07 0.00 0.00 0.00 0.00 61.98 60.70 2ozx s VAL 118 Cb -0.03 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.48 2ozx s VAL 118 CO -0.01 -0.62 0.15 0.42 0.00 0.00 0.00 175.10 175.03 2ozx s THR 119 N -2.55 0.15 0.17 3.92 -4.23 0.90 -4.90 115.64 109.10 2ozx s THR 119 Ca -0.06 -1.21 -0.13 0.00 -1.18 0.00 0.00 61.69 59.12 2ozx s THR 119 Cb -0.02 -1.23 0.01 0.00 1.34 0.00 0.00 72.50 72.60 2ozx s THR 119 CO -0.04 -0.67 0.38 -1.66 -0.54 0.00 0.00 174.62 172.09 2ozx s TRP 120 N -3.48 0.13 0.15 3.99 1.48 -1.26 -1.53 118.94 118.42 2ozx s TRP 120 Ca 0.02 -0.48 -0.01 0.00 -1.06 0.00 0.00 56.10 54.57 2ozx s TRP 120 Cb 0.04 0.15 0.00 0.00 -1.16 0.00 0.00 33.47 32.50 2ozx s TRP 120 CO -0.09 -0.78 0.21 0.00 -4.06 0.00 0.00 176.95 172.23 2ozx n ALA 121 N -0.25 -0.18 -2.37 2.67 0.00 -0.58 -4.91 120.51 114.88 2ozx n ALA 121 Ca -0.10 -0.68 -0.02 0.00 0.00 0.00 0.00 53.44 52.64 2ozx n ALA 121 Cb 0.63 0.55 0.06 0.00 0.00 0.00 0.00 19.45 20.69 2ozx n ALA 121 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ozx n ASN 122 N -1.88 2.01 -3.69 0.00 5.15 -1.26 -4.27 115.26 111.31 2ozx n ASN 122 Ca 0.00 -2.65 -0.11 0.00 -0.60 0.00 0.00 54.58 51.22 2ozx n ASN 122 Cb 0.25 -0.41 -0.06 0.00 -0.53 0.00 0.00 39.78 39.03 2ozx n ASN 122 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2ozx s ASP 123 N -3.09 -0.19 0.00 1.20 2.15 -1.26 -4.84 116.67 110.64 2ozx s ASP 123 Ca 0.35 -0.23 0.00 0.00 0.43 0.00 0.00 52.55 53.10 2ozx s ASP 123 Cb 0.37 0.42 0.00 0.00 -0.30 0.00 0.00 42.92 43.41 2ozx s ASP 123 CO -0.07 -0.74 0.00 0.61 -0.17 0.00 0.00 175.17 174.80 2ozx n GLY 124 N 0.17 1.04 0.00 2.66 0.00 -1.26 -4.62 105.19 103.18 2ozx n GLY 124 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2ozx n GLY 124 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30