#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ozw s ALA 2 N 0.00 0.46 -0.07 -5.12 0.00 -1.26 -5.16 121.76 110.62 2ozw s ALA 2 Ca 0.00 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.69 2ozw s ALA 2 Cb 0.00 1.11 0.03 0.00 0.00 0.00 0.00 23.12 24.26 2ozw s ALA 2 CO 0.00 -0.66 0.01 0.08 0.00 0.00 0.00 175.76 175.19 2ozw s VAL 3 N -4.06 0.28 0.85 0.00 1.01 -1.26 -4.80 120.40 112.41 2ozw s VAL 3 Ca 0.27 0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.29 2ozw s VAL 3 Cb 0.04 -0.46 0.20 0.00 0.00 0.00 0.00 36.38 36.16 2ozw s VAL 3 CO 0.07 0.24 0.96 0.00 0.00 0.00 0.00 175.10 176.37 2ozw n ALA 4 N 5.18 -1.82 -3.34 5.51 0.00 -1.26 -5.04 120.51 119.73 2ozw n ALA 4 Ca -0.06 -1.32 -0.14 0.00 0.00 0.00 0.00 53.44 51.92 2ozw n ALA 4 Cb 0.50 -0.08 -0.08 0.00 0.00 0.00 0.00 19.45 19.79 2ozw n ALA 4 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ozw s ASP 5 N -4.37 -0.39 0.42 0.00 -1.08 -1.26 -4.77 116.67 105.22 2ozw s ASP 5 Ca 0.57 0.52 0.14 0.00 -0.52 0.00 0.00 52.55 53.26 2ozw s ASP 5 Cb -0.03 0.58 1.01 0.00 -1.46 0.00 0.00 42.92 43.03 2ozw s ASP 5 CO 0.42 -0.38 1.94 -0.07 0.52 0.00 0.00 175.17 177.59 2ozw h LEU 6 N 4.22 0.41 -1.40 -1.34 3.38 -1.96 -0.43 115.31 118.18 2ozw h LEU 6 Ca -0.28 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 2ozw h LEU 6 Cb 1.17 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 2ozw h LEU 6 CO 0.33 0.23 -0.26 0.00 0.09 0.00 0.00 178.44 178.83 2ozw h ALA 7 N 1.66 1.20 0.00 1.53 0.00 -2.00 -2.96 119.26 118.69 2ozw h ALA 7 Ca 0.34 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2ozw h ALA 7 Cb 0.71 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2ozw h ALA 7 CO -0.11 0.32 -0.48 -0.07 0.00 0.00 0.00 179.25 178.92 2ozw h LEU 8 N 0.00 0.00 -9.56 0.00 3.38 -1.49 -3.46 115.31 104.18 2ozw h LEU 8 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2ozw h LEU 8 Cb 0.61 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.39 2ozw h LEU 8 CO 0.03 0.35 0.84 -0.63 0.09 0.00 0.00 178.44 179.11 2ozw s ILE 9 N -3.05 2.95 -0.35 1.22 1.01 -1.12 -4.90 121.20 116.96 2ozw s ILE 9 Ca 0.04 0.65 -0.40 0.00 0.00 0.00 0.00 60.65 60.94 2ozw s ILE 9 Cb 0.07 -3.42 -0.16 0.00 0.01 0.00 0.00 42.46 38.97 2ozw s ILE 9 CO 0.73 0.04 1.89 -2.65 0.00 0.00 0.00 174.94 174.96 2ozw n PRO 10 N 4.19 0.84 0.10 2.79 -0.02 -1.26 -4.86 135.00 136.79 2ozw n PRO 10 Ca 0.13 0.29 -0.04 0.00 -2.02 0.00 0.00 63.50 61.86 2ozw n PRO 10 Cb 0.40 -2.03 0.12 0.00 -0.02 0.00 0.00 33.50 31.97 2ozw n PRO 10 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2ozw h ASP 11 N 8.45 0.17 -3.68 2.55 3.58 -1.90 -3.43 116.42 122.16 2ozw h ASP 11 Ca -0.36 -0.10 -0.23 0.00 0.42 0.00 0.00 57.03 56.75 2ozw h ASP 11 Cb 1.34 -0.05 -0.29 0.00 1.72 0.00 0.00 39.33 42.05 2ozw h ASP 11 CO 1.00 0.76 -0.65 -0.69 -2.88 0.00 0.00 179.24 176.78 2ozw s VAL 12 N -3.63 -0.02 -0.24 2.25 1.01 -1.26 -2.18 120.40 116.33 2ozw s VAL 12 Ca -0.03 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.98 2ozw s VAL 12 Cb 0.12 -0.11 0.13 0.00 0.00 0.00 0.00 36.38 36.52 2ozw s VAL 12 CO 0.79 0.02 0.38 -0.62 0.00 0.00 0.00 175.10 175.67 2ozw s ASP 13 N 0.34 0.22 0.05 3.32 2.15 -0.84 -4.99 116.67 116.93 2ozw s ASP 13 Ca -0.03 0.28 -0.02 0.00 0.43 0.00 0.00 52.55 53.21 2ozw s ASP 13 Cb -0.04 1.12 -0.03 0.00 -0.30 0.00 0.00 42.92 43.67 2ozw s ASP 13 CO -0.01 -0.29 0.01 0.27 -0.17 0.00 0.00 175.17 174.98 2ozw s ILE 14 N 2.55 0.18 0.96 4.11 -4.36 -1.26 -3.71 121.20 119.66 2ozw s ILE 14 Ca 0.11 -1.52 -0.16 0.00 -0.26 0.00 0.00 60.65 58.82 2ozw s ILE 14 Cb -0.15 -1.26 0.23 0.00 1.25 0.00 0.00 42.46 42.53 2ozw s ILE 14 CO -0.15 -0.84 1.06 -0.67 0.24 0.00 0.00 174.94 174.58 2ozw n ASP 15 N 0.36 -0.87 0.00 4.36 -0.08 -0.81 -5.01 116.55 114.51 2ozw n ASP 15 Ca -0.16 -1.26 0.00 0.00 -1.51 0.00 0.00 54.79 51.86 2ozw n ASP 15 Cb 0.60 -0.88 0.00 0.00 2.34 0.00 0.00 41.12 43.18 2ozw n ASP 15 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2ozw n SER 16 N -4.16 0.00 0.24 1.67 7.64 -1.26 -4.96 113.62 112.78 2ozw n SER 16 Ca 0.14 -1.00 0.10 0.00 1.01 0.00 0.00 58.87 59.12 2ozw n SER 16 Cb 0.51 0.00 0.59 0.00 -1.01 0.00 0.00 64.21 64.30 2ozw n SER 16 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2ozw h ASP 17 N 0.00 0.00 0.00 6.43 3.58 -1.97 -3.47 116.42 121.00 2ozw h ASP 17 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2ozw h ASP 17 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2ozw h ASP 17 CO 0.00 0.19 0.00 0.61 -2.88 0.00 0.00 179.24 177.16 2ozw n GLY 18 N -0.41 -0.61 3.77 -0.78 0.00 -1.26 -5.12 105.19 100.78 2ozw n GLY 18 Ca -0.01 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 44.92 2ozw n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ozw s VAL 19 N -3.00 2.45 0.10 1.61 1.01 -1.26 -4.81 120.40 116.50 2ozw s VAL 19 Ca 0.00 0.39 -0.21 0.00 0.00 0.00 0.00 61.98 62.17 2ozw s VAL 19 Cb 0.00 -3.23 0.05 0.00 0.00 0.00 0.00 36.38 33.20 2ozw s VAL 19 CO 0.00 0.05 0.51 0.72 0.00 0.00 0.00 175.10 176.37 2ozw s PHE 20 N -1.27 -0.39 0.57 5.22 -0.12 -0.84 -4.82 117.98 116.33 2ozw s PHE 20 Ca 0.60 0.25 -0.17 0.00 -0.05 0.00 0.00 56.93 57.56 2ozw s PHE 20 Cb -0.39 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.33 2ozw s PHE 20 CO 0.50 -0.72 1.08 0.15 -0.05 0.00 0.00 175.22 176.18 2ozw s LYS 21 N -3.23 3.33 0.06 1.99 -0.14 -1.26 -0.92 119.74 119.57 2ozw s LYS 21 Ca -0.01 1.37 -0.03 0.00 -1.36 0.00 0.00 55.97 55.94 2ozw s LYS 21 Cb 0.00 -2.02 -0.03 0.00 -1.68 0.00 0.00 37.83 34.10 2ozw s LYS 21 CO -0.08 -0.82 0.04 1.52 -0.76 0.00 0.00 175.35 175.24 2ozw s TYR 22 N -2.17 0.41 0.10 3.18 1.13 -0.17 -2.62 117.35 117.22 2ozw s TYR 22 Ca 0.67 -0.92 0.05 0.00 -1.41 0.00 0.00 57.07 55.46 2ozw s TYR 22 Cb -0.19 -0.29 -0.03 0.00 -1.10 0.00 0.00 41.96 40.35 2ozw s TYR 22 CO 0.32 -0.43 -0.14 0.14 -2.51 0.00 0.00 175.55 172.93 2ozw s VAL 23 N -3.90 1.22 -0.29 -3.49 -7.23 0.08 -1.21 120.40 105.57 2ozw s VAL 23 Ca 0.07 -1.56 -0.07 0.00 -1.81 0.00 0.00 61.98 58.61 2ozw s VAL 23 Cb 0.07 -1.35 0.01 0.00 0.56 0.00 0.00 36.38 35.67 2ozw s VAL 23 CO -0.10 -0.36 0.08 -0.22 -0.31 0.00 0.00 175.10 174.19 2ozw s LEU 24 N -2.19 3.85 -0.15 1.32 1.98 -0.37 -2.56 118.68 120.56 2ozw s LEU 24 Ca 0.05 -0.70 0.02 0.00 -2.89 0.00 0.00 54.13 50.61 2ozw s LEU 24 Cb -0.07 -1.88 0.01 0.00 0.66 0.00 0.00 46.19 44.91 2ozw s LEU 24 CO 0.02 -0.19 -0.20 -0.63 -1.89 0.00 0.00 176.35 173.47 2ozw s ILE 25 N 1.50 2.25 0.41 6.68 1.01 -0.63 -0.48 121.20 131.93 2ozw s ILE 25 Ca 0.03 -0.91 -0.22 0.00 0.00 0.00 0.00 60.65 59.54 2ozw s ILE 25 Cb -0.17 -1.92 -0.10 0.00 0.01 0.00 0.00 42.46 40.28 2ozw s ILE 25 CO 0.03 0.54 0.98 -0.60 0.00 0.00 0.00 174.94 175.89 2ozw s ARG 26 N 0.84 4.22 0.03 2.79 3.52 0.33 -0.66 118.95 130.02 2ozw s ARG 26 Ca -0.06 1.28 0.04 0.00 -0.13 0.00 0.00 55.73 56.86 2ozw s ARG 26 Cb -0.15 -2.36 -0.02 0.00 -1.56 0.00 0.00 34.95 30.86 2ozw s ARG 26 CO -0.02 -0.06 -0.11 0.08 -0.81 0.00 0.00 175.30 174.38 2ozw s VAL 27 N -1.93 0.89 0.07 7.11 1.01 0.38 -2.14 120.40 125.79 2ozw s VAL 27 Ca 0.60 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.76 2ozw s VAL 27 Cb -0.15 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 2ozw s VAL 27 CO 0.19 -0.05 -0.18 -1.00 0.00 0.00 0.00 175.10 174.07 2ozw s HIS 28 N -0.83 1.52 -0.55 5.22 0.09 0.06 -0.83 115.29 119.98 2ozw s HIS 28 Ca -0.01 -0.41 -0.26 0.00 -0.00 0.00 0.00 55.06 54.38 2ozw s HIS 28 Cb -0.07 -0.86 -0.06 0.00 -0.00 0.00 0.00 32.58 31.58 2ozw s HIS 28 CO 0.01 0.12 2.29 -1.12 -0.00 0.00 0.00 174.74 176.03 2ozw s SER 29 N -1.62 4.58 0.00 1.40 0.01 -0.15 -3.26 113.70 114.66 2ozw s SER 29 Ca 0.03 0.82 0.00 0.00 1.31 0.00 0.00 55.95 58.12 2ozw s SER 29 Cb -0.09 -2.51 0.01 0.00 0.21 0.00 0.00 66.02 63.63 2ozw s SER 29 CO 0.03 -2.85 0.94 0.00 0.41 0.00 0.00 173.24 171.77 2ozw n ALA 30 N 15.44 2.01 -1.49 1.44 0.00 -1.26 -4.58 120.51 132.07 2ozw n ALA 30 Ca 0.34 -0.90 -0.46 0.00 0.00 0.00 0.00 53.44 52.43 2ozw n ALA 30 Cb 0.53 -0.44 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 2ozw n ALA 30 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2ozw n PRO 31 N 0.01 0.69 -1.74 0.00 -0.02 -1.26 -1.03 135.00 131.64 2ozw n PRO 31 Ca 0.00 0.24 -0.03 0.00 -2.02 0.00 0.00 63.50 61.69 2ozw n PRO 31 Cb 0.68 -1.44 -0.01 0.00 -0.02 0.00 0.00 33.50 32.71 2ozw n PRO 31 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2ozw n ARG 32 N 0.84 -1.87 -2.50 -0.52 3.00 0.07 -1.33 116.66 114.35 2ozw n ARG 32 Ca 0.13 0.18 -0.12 0.00 -0.00 0.00 0.00 57.85 58.05 2ozw n ARG 32 Cb 0.30 -4.46 -0.01 0.00 0.00 0.00 0.00 32.46 28.29 2ozw n ARG 32 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2ozw n SER 33 N -0.41 -3.71 0.00 6.15 7.64 -0.20 -4.73 113.62 118.36 2ozw n SER 33 Ca -0.04 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.03 2ozw n SER 33 Cb 0.31 -3.16 0.00 0.00 -1.01 0.00 0.00 64.21 60.35 2ozw n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ozw n GLY 34 N -0.81 1.00 3.72 0.23 0.00 -0.44 -5.11 105.19 103.78 2ozw n GLY 34 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2ozw n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozw n ALA 35 N 0.00 1.72 0.22 4.61 0.00 -0.49 -4.92 120.51 121.65 2ozw n ALA 35 Ca 0.00 0.37 0.12 0.00 0.00 0.00 0.00 53.44 53.93 2ozw n ALA 35 Cb 0.20 -2.33 0.27 0.00 0.00 0.00 0.00 19.45 17.58 2ozw n ALA 35 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2ozw h PRO 36 N 3.44 0.00 -7.28 0.00 0.13 -1.94 -3.46 132.00 122.89 2ozw h PRO 36 Ca -0.47 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.14 2ozw h PRO 36 Cb 1.26 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.56 2ozw h PRO 36 CO 0.69 0.08 0.28 0.00 -0.23 0.00 0.00 178.00 178.81 2ozw s ALA 37 N -3.29 1.87 -0.15 -0.56 0.00 -1.26 -5.00 121.76 113.37 2ozw s ALA 37 Ca 0.05 0.46 0.21 0.00 0.00 0.00 0.00 51.96 52.68 2ozw s ALA 37 Cb 0.06 -3.37 0.43 0.00 0.00 0.00 0.00 23.12 20.24 2ozw s ALA 37 CO 0.65 -2.25 1.17 0.00 0.00 0.00 0.00 175.76 175.33 2ozw n ALA 38 N -3.81 2.63 -2.15 0.00 0.00 -1.26 -4.71 120.51 111.20 2ozw n ALA 38 Ca 0.11 -2.27 -0.22 0.00 0.00 0.00 0.00 53.44 51.06 2ozw n ALA 38 Cb 0.52 -0.78 0.17 0.00 0.00 0.00 0.00 19.45 19.37 2ozw n ALA 38 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ozw n GLU 39 N -0.24 -0.88 -4.04 0.00 1.02 -1.26 -4.81 120.64 110.43 2ozw n GLU 39 Ca 0.01 -2.26 -0.08 0.00 -0.02 0.00 0.00 57.16 54.81 2ozw n GLU 39 Cb 0.93 -1.12 -0.09 0.00 -0.02 0.00 0.00 31.44 31.14 2ozw n GLU 39 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2ozw s SER 40 N -5.55 0.38 0.27 1.62 0.01 -1.26 -0.98 113.70 108.19 2ozw s SER 40 Ca 0.72 -0.93 -0.12 0.00 1.31 0.00 0.00 55.95 56.93 2ozw s SER 40 Cb -0.03 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.45 2ozw s SER 40 CO 0.49 -0.65 0.50 -0.75 0.41 0.00 0.00 173.24 173.25 2ozw s LYS 41 N -3.92 1.64 0.11 12.44 2.36 -0.01 -4.98 119.74 127.38 2ozw s LYS 41 Ca 0.08 -1.32 0.03 0.00 -2.55 0.00 0.00 55.97 52.21 2ozw s LYS 41 Cb 0.07 0.48 -0.04 0.00 -1.05 0.00 0.00 37.83 37.29 2ozw s LYS 41 CO -0.09 -0.69 -0.09 -1.21 1.55 0.00 0.00 175.35 174.82 2ozw s GLU 42 N -3.80 0.90 0.06 4.03 8.01 -1.26 -0.47 118.70 126.18 2ozw s GLU 42 Ca 0.23 -1.28 0.01 0.00 0.01 0.00 0.00 54.97 53.94 2ozw s GLU 42 Cb -0.01 -0.49 -0.03 0.00 -4.31 0.00 0.00 34.13 29.29 2ozw s GLU 42 CO 0.11 0.06 -0.06 0.96 0.01 0.00 0.00 175.26 176.33 2ozw s ILE 43 N -2.95 0.49 -0.18 -1.63 -4.36 0.17 -4.89 121.20 107.86 2ozw s ILE 43 Ca 0.10 -1.55 0.00 0.00 -0.26 0.00 0.00 60.65 58.94 2ozw s ILE 43 Cb 0.00 -1.19 0.01 0.00 1.25 0.00 0.00 42.46 42.54 2ozw s ILE 43 CO -0.01 -0.72 -0.18 -0.69 0.24 0.00 0.00 174.94 173.59 2ozw s VAL 44 N -2.80 2.30 0.02 8.37 1.01 -0.93 -1.61 120.40 126.76 2ozw s VAL 44 Ca 0.02 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.15 2ozw s VAL 44 Cb -0.00 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 2ozw s VAL 44 CO -0.04 0.52 -0.07 -0.13 0.00 0.00 0.00 175.10 175.38 2ozw s ARG 45 N 1.24 0.50 0.00 2.72 1.81 -1.06 -1.98 118.95 122.19 2ozw s ARG 45 Ca 0.03 -0.48 0.00 0.00 -1.72 0.00 0.00 55.73 53.56 2ozw s ARG 45 Cb -0.14 -0.39 0.00 0.00 -0.45 0.00 0.00 34.95 33.97 2ozw s ARG 45 CO -0.10 0.09 0.00 0.41 -0.68 0.00 0.00 175.30 175.03 2ozw n GLY 46 N 2.21 1.25 3.35 -3.53 0.00 -1.24 -0.74 105.19 106.49 2ozw n GLY 46 Ca -0.18 0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 2ozw n GLY 46 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ozw s TYR 47 N -0.47 -0.33 0.42 1.61 1.51 -1.08 -1.92 117.35 117.09 2ozw s TYR 47 Ca 0.00 0.29 0.10 0.00 -1.01 0.00 0.00 57.07 56.45 2ozw s TYR 47 Cb 0.00 0.29 0.93 0.00 -0.11 0.00 0.00 41.96 43.06 2ozw s TYR 47 CO 0.00 -0.63 2.01 -0.22 -1.11 0.00 0.00 175.55 175.60 2ozw h LYS 48 N 2.80 0.50 0.00 -0.62 3.64 -1.88 -1.68 116.57 119.34 2ozw h LYS 48 Ca -0.31 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 58.98 2ozw h LYS 48 Cb 1.22 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2ozw h LYS 48 CO 0.43 0.33 -0.28 0.11 -2.27 0.00 0.00 179.45 177.77 2ozw h TRP 49 N 0.51 0.00 -1.46 1.91 5.08 -1.97 -3.34 115.95 116.68 2ozw h TRP 49 Ca 0.23 0.00 -0.70 0.00 1.08 0.00 0.00 58.89 59.49 2ozw h TRP 49 Cb 0.25 0.00 -0.12 0.00 -3.00 0.00 0.00 29.16 26.29 2ozw h TRP 49 CO -0.00 0.28 1.80 0.00 -1.28 0.00 0.00 178.44 179.23 2ozw s ALA 50 N -4.11 3.60 0.17 0.11 0.00 -0.63 -4.78 121.76 116.12 2ozw s ALA 50 Ca -0.02 -3.09 0.34 0.00 0.00 0.00 0.00 51.96 49.18 2ozw s ALA 50 Cb 0.13 -4.41 1.68 0.00 0.00 0.00 0.00 23.12 20.52 2ozw s ALA 50 CO 0.67 -3.07 2.03 0.93 0.00 0.00 0.00 175.76 176.31 2ozw h GLU 51 N 7.47 0.00 -4.85 0.00 4.39 -1.80 -3.37 114.58 116.42 2ozw h GLU 51 Ca 0.38 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.76 2ozw h GLU 51 Cb 0.88 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 29.32 2ozw h GLU 51 CO 1.36 0.00 -0.75 1.52 -1.16 0.00 0.00 179.01 179.98 2ozw s TYR 52 N -3.77 0.89 0.21 4.33 1.13 -1.26 -4.91 117.35 113.96 2ozw s TYR 52 Ca -0.01 -0.52 0.05 0.00 -1.41 0.00 0.00 57.07 55.17 2ozw s TYR 52 Cb 0.10 -0.51 0.15 0.00 -1.10 0.00 0.00 41.96 40.60 2ozw s TYR 52 CO 0.40 -0.03 1.49 0.45 -2.51 0.00 0.00 175.55 175.34 2ozw h HIS 53 N 4.26 0.21 -0.55 -3.49 3.86 -1.95 -2.34 115.15 115.15 2ozw h HIS 53 Ca -0.37 -0.10 0.16 0.00 -1.16 0.00 0.00 60.37 58.90 2ozw h HIS 53 Cb 1.20 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.61 2ozw h HIS 53 CO 0.64 0.83 0.41 0.00 0.86 0.00 0.00 177.93 180.66 2ozw h ALA 54 N 1.14 2.51 0.04 2.45 0.00 -1.97 -1.41 119.26 122.02 2ozw h ALA 54 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ozw h ALA 54 Cb 1.29 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2ozw h ALA 54 CO 0.11 -0.69 -0.02 0.22 0.00 0.00 0.00 179.25 178.87 2ozw h ASP 55 N 0.00 -0.05 -0.38 0.00 3.58 -1.80 -0.80 116.42 116.96 2ozw h ASP 55 Ca 0.26 -0.36 -0.11 0.00 0.42 0.00 0.00 57.03 57.24 2ozw h ASP 55 Cb 1.07 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 42.12 2ozw h ASP 55 CO -0.00 0.34 -0.17 0.16 -2.88 0.00 0.00 179.24 176.69 2ozw h ILE 56 N -0.44 1.27 -0.17 2.25 3.07 -1.64 -1.66 117.51 120.19 2ozw h ILE 56 Ca -0.01 -1.29 0.00 0.00 1.55 0.00 0.00 64.86 65.12 2ozw h ILE 56 Cb 0.40 1.10 -0.01 0.00 -0.27 0.00 0.00 36.82 38.05 2ozw h ILE 56 CO 0.01 0.44 0.11 0.22 -1.05 0.00 0.00 178.15 177.88 2ozw h TYR 57 N 0.76 0.21 -0.18 0.16 3.20 -1.15 0.78 116.97 120.75 2ozw h TYR 57 Ca 0.11 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 2ozw h TYR 57 Cb 0.69 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 2ozw h TYR 57 CO 0.04 0.13 0.07 0.22 -1.64 0.00 0.00 178.16 176.98 2ozw h ASP 58 N 0.23 0.26 0.27 -2.11 3.58 -1.07 -1.05 116.42 116.52 2ozw h ASP 58 Ca 0.06 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 2ozw h ASP 58 Cb -0.02 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 40.96 2ozw h ASP 58 CO -0.02 0.37 -0.13 0.50 -2.88 0.00 0.00 179.24 177.08 2ozw h LYS 59 N 0.13 -0.35 -0.12 0.28 3.64 -1.16 -0.50 116.57 118.50 2ozw h LYS 59 Ca 0.06 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2ozw h LYS 59 Cb 0.20 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2ozw h LYS 59 CO -0.00 -0.19 -0.20 0.28 -2.27 0.00 0.00 179.45 177.07 2ozw h VAL 60 N -0.42 1.37 -0.17 2.00 2.07 -0.85 -0.76 116.25 119.49 2ozw h VAL 60 Ca -0.04 -1.44 -0.03 0.00 0.82 0.00 0.00 66.70 66.01 2ozw h VAL 60 Cb 0.32 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 2ozw h VAL 60 CO 0.06 0.42 -0.01 0.28 0.02 0.00 0.00 177.57 178.34 2ozw h SER 61 N -0.06 0.22 -0.02 0.57 0.02 -1.23 0.67 113.55 113.72 2ozw h SER 61 Ca 0.01 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2ozw h SER 61 Cb 0.77 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 2ozw h SER 61 CO 0.05 0.28 0.01 1.23 -1.14 0.00 0.00 176.83 177.25 2ozw h GLY 62 N 0.52 0.03 0.98 -3.77 0.00 -0.75 0.33 103.07 100.42 2ozw h GLY 62 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 2ozw h GLY 62 CO 0.00 0.01 0.28 -1.80 0.00 0.00 0.00 176.54 175.04 2ozw h ASP 63 N -0.03 0.66 -0.24 0.19 3.58 -0.27 0.58 116.42 120.88 2ozw h ASP 63 Ca 0.01 -0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.37 2ozw h ASP 63 Cb 0.06 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.92 2ozw h ASP 63 CO -0.00 0.57 0.14 0.24 -2.88 0.00 0.00 179.24 177.30 2ozw h MET 64 N 0.70 0.28 0.00 0.28 2.86 -0.83 -0.91 114.93 117.32 2ozw h MET 64 Ca 0.18 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 2ozw h MET 64 Cb 0.06 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2ozw h MET 64 CO -0.03 0.19 -0.32 1.96 1.06 0.00 0.00 176.91 179.76 2ozw h GLN 65 N 0.29 0.00 -0.35 1.72 1.08 -0.62 0.23 115.11 117.45 2ozw h GLN 65 Ca 0.10 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.18 2ozw h GLN 65 Cb -0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 2ozw h GLN 65 CO -0.05 0.32 -0.26 0.87 -0.95 0.00 0.00 178.83 178.77 2ozw h LYS 66 N 0.00 0.71 0.00 1.46 1.57 -0.38 -2.00 116.57 117.93 2ozw h LYS 66 Ca -0.00 -0.30 -0.08 0.00 -1.87 0.00 0.00 60.65 58.40 2ozw h LYS 66 Cb 0.62 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2ozw h LYS 66 CO 0.04 0.90 -0.39 1.96 -0.57 0.00 0.00 179.45 181.39 2ozw h GLN 67 N 0.61 0.00 0.00 3.15 4.20 -0.20 -3.47 115.11 119.41 2ozw h GLN 67 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2ozw h GLN 67 Cb 0.76 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.54 2ozw h GLN 67 CO 0.06 0.39 0.00 0.41 -0.67 0.00 0.00 178.83 179.02 2ozw n GLY 68 N -0.37 1.59 3.61 3.46 0.00 0.57 -0.76 105.19 113.29 2ozw n GLY 68 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2ozw n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozw s ASP 70 N -0.96 5.09 0.12 0.00 2.15 -1.20 -2.85 116.67 119.02 2ozw s ASP 70 Ca 0.68 0.05 -0.04 0.00 0.43 0.00 0.00 52.55 53.68 2ozw s ASP 70 Cb -0.49 -1.37 -0.03 0.00 -0.30 0.00 0.00 42.92 40.74 2ozw s ASP 70 CO 0.53 0.33 0.11 0.00 -0.17 0.00 0.00 175.17 175.97 2ozw s GLU 72 N -3.99 0.44 -0.23 0.00 2.12 -0.91 -5.00 118.70 111.13 2ozw s GLU 72 Ca 0.18 0.72 -0.29 0.00 0.36 0.00 0.00 54.97 55.94 2ozw s GLU 72 Cb 0.06 0.08 -0.02 0.00 0.26 0.00 0.00 34.13 34.52 2ozw s GLU 72 CO -0.02 -0.12 1.47 0.00 -0.54 0.00 0.00 175.26 176.05 2ozw h LEU 74 N 11.12 0.00 0.00 0.00 3.38 -1.14 -3.48 115.31 125.19 2ozw h LEU 74 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2ozw h LEU 74 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2ozw h LEU 74 CO 1.01 0.18 0.00 0.61 0.09 0.00 0.00 178.44 180.32 2ozw n GLY 75 N -0.42 -0.87 2.36 0.83 0.00 -1.22 -4.55 105.19 101.33 2ozw n GLY 75 Ca -0.01 -1.00 -0.07 0.00 0.00 0.00 0.00 46.02 44.93 2ozw n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ozw n GLY 76 N 0.00 1.81 0.00 -0.02 0.00 -0.51 -1.24 105.19 105.24 2ozw n GLY 76 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 2ozw n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ozw n GLY 77 N -0.36 1.80 3.04 -0.02 0.00 -0.35 -2.78 105.19 106.52 2ozw n GLY 77 Ca -0.03 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 2ozw n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ozw s ARG 78 N 1.36 0.52 -0.00 1.61 3.52 0.63 -1.00 118.95 125.59 2ozw s ARG 78 Ca 0.00 -0.60 0.08 0.00 -0.13 0.00 0.00 55.73 55.08 2ozw s ARG 78 Cb 0.00 -0.36 -0.02 0.00 -1.56 0.00 0.00 34.95 33.01 2ozw s ARG 78 CO 0.00 0.08 -0.24 0.42 -0.81 0.00 0.00 175.30 174.75 2ozw s ILE 79 N -1.00 1.89 0.21 4.11 1.01 -0.10 -1.62 121.20 125.69 2ozw s ILE 79 Ca -0.06 -1.09 -0.02 0.00 0.00 0.00 0.00 60.65 59.48 2ozw s ILE 79 Cb -0.08 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 2ozw s ILE 79 CO 0.00 0.47 0.17 -0.44 0.00 0.00 0.00 174.94 175.15 2ozw s SER 80 N -0.73 0.13 0.25 3.58 0.01 -0.40 -1.98 113.70 114.56 2ozw s SER 80 Ca 0.09 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.02 2ozw s SER 80 Cb -0.09 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.54 2ozw s SER 80 CO -0.00 -0.88 0.00 1.41 0.41 0.00 0.00 173.24 174.18 2ozw n HIS 81 N -0.29 -2.73 -3.94 2.43 8.25 -1.26 -1.61 115.22 116.06 2ozw n HIS 81 Ca 0.02 1.36 -0.09 0.00 -0.26 0.00 0.00 57.72 58.74 2ozw n HIS 81 Cb 0.65 -2.48 -0.10 0.00 1.12 0.00 0.00 29.99 29.19 2ozw n HIS 81 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2ozw s GLN 82 N -1.93 0.49 0.00 -0.41 -0.21 -1.26 -4.82 119.66 111.53 2ozw s GLN 82 Ca 0.00 -0.68 0.02 0.00 0.02 0.00 0.00 55.36 54.72 2ozw s GLN 82 Cb 0.00 0.19 0.13 0.00 1.00 0.00 0.00 33.01 34.33 2ozw s GLN 82 CO 0.00 -0.11 0.48 0.43 -2.12 0.00 0.00 175.29 173.97 2ozw n SER 83 N 1.08 0.00 -0.39 5.90 7.64 -1.26 -1.60 113.62 124.99 2ozw n SER 83 Ca -0.21 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.08 2ozw n SER 83 Cb 0.57 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.78 2ozw n SER 83 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ozw n GLN 84 N -0.60 0.08 0.03 1.43 6.02 -1.26 -4.94 117.38 118.14 2ozw n GLN 84 Ca 0.02 -0.97 0.00 0.00 -0.01 0.00 0.00 57.00 56.03 2ozw n GLN 84 Cb 0.01 -0.54 0.00 0.00 1.02 0.00 0.00 30.24 30.72 2ozw n GLN 84 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2ozw n ASP 85 N -0.06 0.00 -3.44 1.08 2.03 -0.63 -5.15 116.55 110.38 2ozw n ASP 85 Ca 0.01 0.12 -0.12 0.00 0.52 0.00 0.00 54.79 55.31 2ozw n ASP 85 Cb 0.66 0.08 -0.02 0.00 -0.72 0.00 0.00 41.12 41.11 2ozw n ASP 85 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2ozw s LYS 86 N -2.00 1.25 0.22 -0.67 2.20 -1.11 -4.99 119.74 114.63 2ozw s LYS 86 Ca 0.00 -0.47 -0.31 0.00 -0.36 0.00 0.00 55.97 54.84 2ozw s LYS 86 Cb 0.00 0.58 -0.15 0.00 -1.51 0.00 0.00 37.83 36.74 2ozw s LYS 86 CO 0.00 -0.54 1.05 0.36 -0.36 0.00 0.00 175.35 175.87 2ozw n LYS 87 N -0.32 1.14 -1.72 4.03 2.85 -1.26 -4.09 118.16 118.80 2ozw n LYS 87 Ca -0.17 0.40 -0.37 0.00 -1.05 0.00 0.00 58.31 57.12 2ozw n LYS 87 Cb 0.65 -1.81 0.06 0.00 -0.65 0.00 0.00 35.03 33.27 2ozw n LYS 87 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 2ozw n ILE 88 N 0.89 4.53 -4.18 0.58 2.08 -0.80 -4.78 119.36 117.67 2ozw n ILE 88 Ca 0.13 -0.50 -0.17 0.00 0.56 0.00 0.00 62.75 62.77 2ozw n ILE 88 Cb 0.27 -1.49 -0.11 0.00 -0.75 0.00 0.00 39.64 37.56 2ozw n ILE 88 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 2ozw s HIS 89 N -1.38 1.20 -0.04 1.39 2.46 -0.64 -1.29 115.29 117.00 2ozw s HIS 89 Ca 0.79 -0.53 0.02 0.00 0.47 0.00 0.00 55.06 55.81 2ozw s HIS 89 Cb -0.39 -0.66 0.01 0.00 -0.13 0.00 0.00 32.58 31.41 2ozw s HIS 89 CO 0.43 0.06 -0.07 0.08 -2.47 0.00 0.00 174.74 172.77 2ozw s VAL 90 N -1.75 0.67 0.00 0.89 1.01 -0.75 -1.28 120.40 119.19 2ozw s VAL 90 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.75 2ozw s VAL 90 Cb -0.07 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.67 2ozw s VAL 90 CO 0.02 0.24 0.00 0.00 0.00 0.00 0.00 175.10 175.35 2ozw n TYR 91 N 3.68 -0.79 -3.99 5.22 4.11 -0.64 -2.78 117.16 121.97 2ozw n TYR 91 Ca -0.22 0.00 0.01 0.00 -0.00 0.00 0.00 57.90 57.69 2ozw n TYR 91 Cb 0.53 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.86 2ozw n TYR 91 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2ozw n GLY 92 N 0.00 -1.60 3.51 -7.48 0.00 -0.52 -0.27 105.19 98.83 2ozw n GLY 92 Ca 0.00 -1.23 -0.15 0.00 0.00 0.00 0.00 46.02 44.64 2ozw n GLY 92 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ozw s TYR 93 N -0.22 -0.57 0.75 1.61 -0.85 -1.26 -4.54 117.35 112.28 2ozw s TYR 93 Ca 0.00 0.81 -0.10 0.00 -0.52 0.00 0.00 57.07 57.26 2ozw s TYR 93 Cb 0.00 0.46 0.06 0.00 0.38 0.00 0.00 41.96 42.85 2ozw s TYR 93 CO 0.00 -0.62 1.11 0.45 -1.52 0.00 0.00 175.55 174.97 2ozw s SER 94 N -1.61 4.85 -0.08 -0.18 0.15 -1.02 -4.68 113.70 111.13 2ozw s SER 94 Ca -0.06 0.78 0.08 0.00 0.70 0.00 0.00 55.95 57.45 2ozw s SER 94 Cb -0.00 -1.41 -0.11 0.00 -1.71 0.00 0.00 66.02 62.79 2ozw s SER 94 CO 0.02 -1.66 0.04 1.15 1.20 0.00 0.00 173.24 173.99 2ozw n MET 95 N -3.12 2.51 0.18 5.44 0.00 -1.26 -2.76 117.12 118.10 2ozw n MET 95 Ca 0.08 -0.01 0.05 0.00 0.00 0.00 0.00 57.70 57.82 2ozw n MET 95 Cb 0.60 -1.22 0.26 0.00 0.00 0.00 0.00 33.22 32.86 2ozw n MET 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2ozw h ALA 96 N 0.44 0.90 0.00 3.17 0.00 -2.02 -3.38 119.26 118.37 2ozw h ALA 96 Ca -0.23 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2ozw h ALA 96 Cb 1.50 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.22 2ozw h ALA 96 CO 0.01 0.51 0.00 0.66 0.00 0.00 0.00 179.25 180.43 2ozw n TYR 97 N -3.44 0.00 -0.61 0.00 4.01 -1.26 -5.15 117.16 110.70 2ozw n TYR 97 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.78 2ozw n TYR 97 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.59 2ozw n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ozw n GLY 98 N 0.29 -2.18 3.77 2.72 0.00 -1.11 -4.34 105.19 104.34 2ozw n GLY 98 Ca 0.00 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.17 2ozw n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ozw s PRO 99 N -1.12 4.17 1.07 1.61 0.04 -1.26 -1.42 135.00 138.09 2ozw s PRO 99 Ca 0.00 2.04 -0.18 0.00 0.04 0.00 0.00 61.00 62.90 2ozw s PRO 99 Cb 0.00 -2.86 0.24 0.00 0.04 0.00 0.00 34.50 31.92 2ozw s PRO 99 CO 0.00 -0.28 1.24 0.00 0.04 0.00 0.00 177.00 177.99 2ozw s ALA 100 N -1.26 1.54 0.45 8.56 0.00 -1.12 -4.52 121.76 125.40 2ozw s ALA 100 Ca 0.53 -1.11 0.19 0.00 0.00 0.00 0.00 51.96 51.57 2ozw s ALA 100 Cb -0.36 -2.81 1.17 0.00 0.00 0.00 0.00 23.12 21.12 2ozw s ALA 100 CO 0.46 -2.95 2.03 1.96 0.00 0.00 0.00 175.76 177.26 2ozw h GLN 101 N -2.06 0.00 0.00 0.00 4.20 -1.95 -3.47 115.11 111.83 2ozw h GLN 101 Ca -0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.27 2ozw h GLN 101 Cb 1.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.04 2ozw h GLN 101 CO 0.35 0.15 0.00 0.72 -0.67 0.00 0.00 178.83 179.39 2ozw n HIS 102 N -4.13 0.00 -0.23 2.96 8.25 -1.26 -4.63 115.22 116.17 2ozw n HIS 102 Ca -0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.38 2ozw n HIS 102 Cb 0.23 -0.33 0.10 0.00 1.12 0.00 0.00 29.99 31.11 2ozw n HIS 102 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ozw h ALA 103 N 0.00 1.08 -0.44 -1.41 0.00 -2.00 -1.77 119.26 114.72 2ozw h ALA 103 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2ozw h ALA 103 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2ozw h ALA 103 CO 0.00 0.63 0.17 0.82 0.00 0.00 0.00 179.25 180.87 2ozw h ILE 104 N 1.03 1.21 -0.54 0.00 2.04 -1.99 -2.38 117.51 116.87 2ozw h ILE 104 Ca 0.23 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2ozw h ILE 104 Cb 0.28 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 2ozw h ILE 104 CO -0.01 0.24 0.35 0.28 0.00 0.00 0.00 178.15 179.01 2ozw h SER 105 N 0.58 0.62 0.08 1.72 0.02 -1.81 -0.24 113.55 114.53 2ozw h SER 105 Ca 0.15 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2ozw h SER 105 Cb 0.20 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2ozw h SER 105 CO -0.01 0.46 -0.04 0.71 -1.14 0.00 0.00 176.83 176.81 2ozw h THR 106 N 0.73 1.03 -0.66 -2.27 1.35 -1.29 -0.73 112.91 111.07 2ozw h THR 106 Ca 0.20 -0.39 0.05 0.00 -0.55 0.00 0.00 66.41 65.71 2ozw h THR 106 Cb -0.08 1.28 -0.05 0.00 -1.73 0.00 0.00 68.15 67.58 2ozw h THR 106 CO -0.04 0.10 0.38 -0.33 -0.25 0.00 0.00 175.52 175.38 2ozw h GLU 107 N -0.29 0.70 -0.28 4.72 5.08 -1.11 0.07 114.58 123.48 2ozw h GLU 107 Ca -0.01 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 2ozw h GLU 107 Cb 0.25 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2ozw h GLU 107 CO 0.02 0.47 -0.55 0.87 -1.00 0.00 0.00 179.01 178.82 2ozw h LYS 108 N 0.73 0.86 -0.21 2.33 1.57 -1.00 -0.91 116.57 119.94 2ozw h LYS 108 Ca 0.28 -0.56 -0.12 0.00 -1.87 0.00 0.00 60.65 58.38 2ozw h LYS 108 Cb 0.11 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2ozw h LYS 108 CO -0.15 1.19 -0.40 0.82 -0.57 0.00 0.00 179.45 180.34 2ozw h ILE 109 N 0.64 1.30 -0.56 1.86 2.04 -0.76 0.34 117.51 122.36 2ozw h ILE 109 Ca 0.01 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.30 2ozw h ILE 109 Cb 1.16 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 38.80 2ozw h ILE 109 CO 0.12 0.48 0.30 0.11 0.00 0.00 0.00 178.15 179.16 2ozw h LYS 110 N 0.39 0.79 -0.64 2.37 1.57 -0.90 -0.92 116.57 119.24 2ozw h LYS 110 Ca 0.04 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 2ozw h LYS 110 Cb 0.87 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 2ozw h LYS 110 CO 0.07 0.62 0.24 0.00 -0.57 0.00 0.00 179.45 179.82 2ozw h ALA 111 N 1.13 1.23 -0.48 3.86 0.00 -0.64 -2.07 119.26 122.29 2ozw h ALA 111 Ca 0.20 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2ozw h ALA 111 Cb 0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2ozw h ALA 111 CO -0.03 0.56 -0.09 -0.22 0.00 0.00 0.00 179.25 179.46 2ozw h LYS 112 N 0.92 0.88 -2.09 0.00 1.63 -0.66 -3.38 116.57 113.87 2ozw h LYS 112 Ca 0.21 -0.30 -0.57 0.00 -0.85 0.00 0.00 60.65 59.14 2ozw h LYS 112 Cb 0.19 -0.07 -0.40 0.00 -0.60 0.00 0.00 32.23 31.35 2ozw h LYS 112 CO -0.02 0.94 -0.88 0.66 -3.45 0.00 0.00 179.45 176.70 2ozw n TYR 113 N -4.16 1.56 0.30 1.91 4.01 -0.37 -4.95 117.16 115.45 2ozw n TYR 113 Ca 0.02 -3.85 0.18 0.00 -0.16 0.00 0.00 57.90 54.09 2ozw n TYR 113 Cb 0.37 -0.45 0.75 0.00 -0.31 0.00 0.00 39.34 39.70 2ozw n TYR 113 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2ozw h PRO 114 N 3.97 0.00 0.00 -0.72 0.13 -1.57 -1.06 132.00 132.74 2ozw h PRO 114 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2ozw h PRO 114 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2ozw h PRO 114 CO 0.64 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 174.94 2ozw n ASP 115 N -2.99 0.00 -0.98 1.44 2.03 -1.26 -4.87 116.55 109.91 2ozw n ASP 115 Ca 0.00 -0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.27 2ozw n ASP 115 Cb 0.26 -0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 2ozw n ASP 115 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ozw n TYR 116 N -1.27 0.00 -3.93 -0.67 9.36 -0.40 -5.19 117.16 115.06 2ozw n TYR 116 Ca 0.10 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.23 2ozw n TYR 116 Cb 0.16 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.80 2ozw n TYR 116 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2ozw s GLU 117 N -1.53 1.09 0.03 2.98 2.12 -1.26 -4.96 118.70 117.18 2ozw s GLU 117 Ca 0.00 -1.12 -0.09 0.00 0.36 0.00 0.00 54.97 54.13 2ozw s GLU 117 Cb 0.00 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.76 2ozw s GLU 117 CO 0.00 -0.39 0.17 0.54 -0.54 0.00 0.00 175.26 175.04 2ozw s VAL 118 N -3.94 0.11 0.23 3.70 0.11 -1.26 -1.91 120.40 117.44 2ozw s VAL 118 Ca 0.14 -0.91 0.01 0.00 -2.93 0.00 0.00 61.98 58.29 2ozw s VAL 118 Cb 0.04 -0.86 -0.04 0.00 -1.53 0.00 0.00 36.38 33.99 2ozw s VAL 118 CO -0.03 -0.50 0.15 0.42 -3.33 0.00 0.00 175.10 171.81 2ozw s THR 119 N -2.44 0.09 0.02 5.04 -4.23 -0.41 -4.92 115.64 108.79 2ozw s THR 119 Ca -0.06 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.42 2ozw s THR 119 Cb -0.02 -2.52 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 2ozw s THR 119 CO -0.03 0.00 0.02 -1.66 -0.54 0.00 0.00 174.62 172.41 2ozw s TRP 120 N -3.98 0.24 -0.24 3.99 1.48 -1.26 -1.82 118.94 117.34 2ozw s TRP 120 Ca 0.39 -0.51 -0.20 0.00 -1.06 0.00 0.00 56.10 54.72 2ozw s TRP 120 Cb 0.06 -0.18 0.06 0.00 -1.16 0.00 0.00 33.47 32.26 2ozw s TRP 120 CO 0.15 -0.26 0.62 0.00 -4.06 0.00 0.00 176.95 173.40 2ozw s ALA 121 N -1.92 -1.58 -0.03 2.67 0.00 -1.12 -4.98 121.76 114.81 2ozw s ALA 121 Ca -0.11 1.89 -0.04 0.00 0.00 0.00 0.00 51.96 53.70 2ozw s ALA 121 Cb -0.06 -1.10 -0.16 0.00 0.00 0.00 0.00 23.12 21.80 2ozw s ALA 121 CO -0.02 -0.31 3.02 -1.71 0.00 0.00 0.00 175.76 176.74 2ozw n ASN 122 N 3.20 5.36 0.20 0.00 5.15 -1.26 -4.39 115.26 123.53 2ozw n ASN 122 Ca -0.16 -2.50 0.05 0.00 -0.60 0.00 0.00 54.58 51.37 2ozw n ASN 122 Cb 0.56 -1.31 0.44 0.00 -0.53 0.00 0.00 39.78 38.94 2ozw n ASN 122 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 2ozw h ASP 123 N 2.31 0.00 -1.55 1.20 3.58 -1.96 -3.47 116.42 116.53 2ozw h ASP 123 Ca 0.14 0.00 0.11 0.00 0.42 0.00 0.00 57.03 57.70 2ozw h ASP 123 Cb 1.30 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.33 2ozw h ASP 123 CO 0.20 0.31 0.36 0.61 -2.88 0.00 0.00 179.24 177.84 2ozw n GLY 124 N -0.46 0.80 0.00 -0.78 0.00 -1.26 -5.09 105.19 98.40 2ozw n GLY 124 Ca -0.02 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2ozw n GLY 124 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30