#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 -0.53 -0.03 3.04 0.00 -1.26 -5.18 121.76 117.79 2ozw s ALA 2 Ca 0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 51.96 51.40 2ozw s ALA 2 Cb 0.00 0.74 0.02 0.00 0.00 0.00 0.00 23.12 23.88 2ozw s ALA 2 CO 0.00 -0.66 0.27 0.54 0.00 0.00 0.00 175.76 175.91 2ozw s VAL 3 N -3.88 0.05 1.08 0.00 0.11 -1.26 -5.08 120.40 111.42 2ozw s VAL 3 Ca 0.09 -0.43 -0.16 0.00 -2.93 0.00 0.00 61.98 58.55 2ozw s VAL 3 Cb 0.02 -0.54 0.23 0.00 -1.53 0.00 0.00 36.38 34.56 2ozw s VAL 3 CO -0.06 -0.23 1.14 0.00 -3.33 0.00 0.00 175.10 172.62 2ozw s ALA 4 N -1.05 1.10 0.01 1.54 0.00 -1.26 -5.11 121.76 116.98 2ozw s ALA 4 Ca -0.11 -0.79 -0.19 0.00 0.00 0.00 0.00 51.96 50.87 2ozw s ALA 4 Cb -0.05 -2.94 0.04 0.00 0.00 0.00 0.00 23.12 20.16 2ozw s ALA 4 CO 0.03 -3.05 0.42 0.34 0.00 0.00 0.00 175.76 173.50 2ozw s ASP 5 N -3.97 -0.31 0.36 0.00 2.15 -1.26 -4.80 116.67 108.85 2ozw s ASP 5 Ca 0.69 0.15 0.10 0.00 0.43 0.00 0.00 52.55 53.93 2ozw s ASP 5 Cb -0.12 0.40 0.87 0.00 -0.30 0.00 0.00 42.92 43.77 2ozw s ASP 5 CO 0.55 -0.57 1.86 -0.07 -0.17 0.00 0.00 175.17 176.77 2ozw h LEU 6 N 3.33 0.61 -2.04 -1.34 3.38 -1.97 -0.82 115.31 116.47 2ozw h LEU 6 Ca -0.30 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 2ozw h LEU 6 Cb 1.18 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 2ozw h LEU 6 CO 0.41 0.29 -0.09 0.00 0.09 0.00 0.00 178.44 179.15 2ozw h ALA 7 N 1.61 1.37 0.00 1.53 0.00 -2.01 -2.61 119.26 119.14 2ozw h ALA 7 Ca 0.46 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 2ozw h ALA 7 Cb 0.81 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2ozw h ALA 7 CO -0.21 0.12 -0.43 -0.07 0.00 0.00 0.00 179.25 178.66 2ozw h LEU 8 N 0.00 0.00 -9.53 0.00 3.38 -1.56 -3.46 115.31 104.14 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 0.25 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.02 2ozw h LEU 8 CO 0.01 0.08 0.79 -0.63 0.09 0.00 0.00 178.44 178.78 2ozw s ILE 9 N -3.22 3.21 -0.24 1.22 1.01 -0.99 -4.93 121.20 117.27 2ozw s ILE 9 Ca 0.04 0.83 -0.37 0.00 0.00 0.00 0.00 60.65 61.15 2ozw s ILE 9 Cb 0.07 -3.53 -0.14 0.00 0.01 0.00 0.00 42.46 38.87 2ozw s ILE 9 CO 0.72 0.05 1.88 -2.65 0.00 0.00 0.00 174.94 174.95 2ozw n PRO 10 N 4.28 1.46 0.06 2.79 -0.02 -1.26 -4.87 135.00 137.44 2ozw n PRO 10 Ca 0.12 0.51 -0.08 0.00 -2.02 0.00 0.00 63.50 62.03 2ozw n PRO 10 Cb 0.42 -2.35 0.05 0.00 -0.02 0.00 0.00 33.50 31.60 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 8.93 0.42 -3.29 2.55 3.58 -1.92 -3.43 116.42 123.27 2ozw h ASP 11 Ca -0.43 -0.27 -0.31 0.00 0.42 0.00 0.00 57.03 56.44 2ozw h ASP 11 Cb 1.30 -0.12 -0.36 0.00 1.72 0.00 0.00 39.33 41.87 2ozw h ASP 11 CO 0.97 0.98 -0.68 -0.69 -2.88 0.00 0.00 179.24 176.94 2ozw s VAL 12 N -3.66 -0.14 -0.22 2.25 1.01 -1.26 -1.33 120.40 117.04 2ozw s VAL 12 Ca -0.05 0.34 -0.04 0.00 0.00 0.00 0.00 61.98 62.23 2ozw s VAL 12 Cb 0.11 -0.20 0.09 0.00 0.00 0.00 0.00 36.38 36.38 2ozw s VAL 12 CO 0.83 0.14 0.19 -0.62 0.00 0.00 0.00 175.10 175.64 2ozw s ASP 13 N 1.89 1.89 0.07 3.32 2.15 -0.87 -5.01 116.67 120.11 2ozw s ASP 13 Ca 0.00 -0.50 0.01 0.00 0.43 0.00 0.00 52.55 52.49 2ozw s ASP 13 Cb -0.12 0.16 -0.04 0.00 -0.30 0.00 0.00 42.92 42.63 2ozw s ASP 13 CO -0.04 -0.35 -0.06 0.27 -0.17 0.00 0.00 175.17 174.81 2ozw s ILE 14 N 2.26 0.53 0.00 4.11 -4.36 -1.26 -3.68 121.20 118.81 2ozw s ILE 14 Ca 0.06 -1.66 0.00 0.00 -0.26 0.00 0.00 60.65 58.79 2ozw s ILE 14 Cb -0.16 -1.33 0.00 0.00 1.25 0.00 0.00 42.46 42.22 2ozw s ILE 14 CO -0.17 -0.77 0.00 -0.67 0.24 0.00 0.00 174.94 173.57 2ozw n ASP 15 N 0.41 0.93 -2.16 4.36 2.03 0.20 -4.86 116.55 117.47 2ozw n ASP 15 Ca -0.16 -0.20 -0.04 0.00 0.52 0.00 0.00 54.79 54.92 2ozw n ASP 15 Cb 0.59 0.58 -0.05 0.00 -0.72 0.00 0.00 41.12 41.52 2ozw n ASP 15 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2ozw n SER 16 N -0.67 2.24 -0.10 1.67 7.64 -1.14 -4.27 113.62 118.99 2ozw n SER 16 Ca 0.00 -1.83 -0.05 0.00 1.01 0.00 0.00 58.87 58.00 2ozw n SER 16 Cb 0.00 -0.57 0.16 0.00 -1.01 0.00 0.00 64.21 62.78 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 4.21 0.74 -3.00 6.43 3.58 -1.90 -3.42 116.42 123.06 2ozw h ASP 17 Ca 0.06 -0.19 -0.45 0.00 0.42 0.00 0.00 57.03 56.87 2ozw h ASP 17 Cb 0.59 -0.20 0.07 0.00 1.72 0.00 0.00 39.33 41.51 2ozw h ASP 17 CO 0.29 0.84 0.11 -0.83 -2.88 0.00 0.00 179.24 176.77 2ozw s GLY 18 N -3.76 1.76 -0.81 -0.78 0.00 -1.26 -4.66 107.32 97.81 2ozw s GLY 18 Ca -0.09 -1.24 -0.25 0.00 0.00 0.00 0.00 44.72 43.14 2ozw s GLY 18 CO 0.81 -0.83 1.98 0.14 0.00 0.00 0.00 173.10 175.20 2ozw s VAL 19 N -3.07 3.38 0.18 1.40 1.01 -1.25 -4.72 120.40 117.32 2ozw s VAL 19 Ca 0.61 -0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.32 2ozw s VAL 19 Cb -0.09 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2ozw s VAL 19 CO 0.43 -0.83 0.26 -0.36 0.00 0.00 0.00 175.10 174.60 2ozw s PHE 20 N 10.31 0.59 0.78 5.22 0.08 -1.25 -4.99 117.98 128.72 2ozw s PHE 20 Ca 0.72 -0.92 -0.11 0.00 0.12 0.00 0.00 56.93 56.73 2ozw s PHE 20 Cb -0.09 -0.15 0.06 0.00 -0.57 0.00 0.00 43.02 42.27 2ozw s PHE 20 CO 0.06 -0.73 1.08 0.15 -0.10 0.00 0.00 175.22 175.68 2ozw s LYS 21 N -4.02 2.24 0.16 0.44 1.02 -1.26 -2.05 119.74 116.27 2ozw s LYS 21 Ca 0.23 0.81 -0.13 0.00 0.02 0.00 0.00 55.97 56.90 2ozw s LYS 21 Cb 0.04 -1.92 0.01 0.00 -0.52 0.00 0.00 37.83 35.44 2ozw s LYS 21 CO 0.04 -1.55 0.37 1.52 -0.92 0.00 0.00 175.35 174.81 2ozw s TYR 22 N -3.07 0.08 0.12 3.18 1.13 0.09 -2.82 117.35 116.06 2ozw s TYR 22 Ca 0.60 -0.44 0.05 0.00 -1.41 0.00 0.00 57.07 55.87 2ozw s TYR 22 Cb -0.15 0.15 -0.04 0.00 -1.10 0.00 0.00 41.96 40.82 2ozw s TYR 22 CO 0.55 -0.76 -0.12 0.14 -2.51 0.00 0.00 175.55 172.85 2ozw s VAL 23 N -3.89 1.16 -0.27 -3.49 -7.23 0.15 -1.74 120.40 105.10 2ozw s VAL 23 Ca 0.10 -1.75 -0.07 0.00 -1.81 0.00 0.00 61.98 58.45 2ozw s VAL 23 Cb 0.02 -1.53 -0.01 0.00 0.56 0.00 0.00 36.38 35.42 2ozw s VAL 23 CO -0.05 -0.53 0.06 -0.22 -0.31 0.00 0.00 175.10 174.05 2ozw s LEU 24 N -2.59 3.53 -0.22 1.32 1.98 -0.92 -2.62 118.68 119.16 2ozw s LEU 24 Ca 0.09 -0.46 0.02 0.00 -2.89 0.00 0.00 54.13 50.89 2ozw s LEU 24 Cb -0.03 -1.87 0.04 0.00 0.66 0.00 0.00 46.19 44.99 2ozw s LEU 24 CO 0.02 -0.10 -0.13 -0.63 -1.89 0.00 0.00 176.35 173.61 2ozw s ILE 25 N 1.54 1.96 0.37 6.68 1.01 -0.46 -0.62 121.20 131.68 2ozw s ILE 25 Ca 0.05 -1.26 -0.27 0.00 0.00 0.00 0.00 60.65 59.17 2ozw s ILE 25 Cb -0.16 -1.99 -0.09 0.00 0.01 0.00 0.00 42.46 40.23 2ozw s ILE 25 CO 0.02 0.17 1.20 -0.60 0.00 0.00 0.00 174.94 175.73 2ozw s ARG 26 N 1.25 4.20 0.01 2.79 3.52 0.44 -0.75 118.95 130.41 2ozw s ARG 26 Ca -0.03 1.94 -0.01 0.00 -0.13 0.00 0.00 55.73 57.50 2ozw s ARG 26 Cb -0.17 -2.85 -0.01 0.00 -1.56 0.00 0.00 34.95 30.36 2ozw s ARG 26 CO -0.08 -0.22 0.01 0.54 -0.81 0.00 0.00 175.30 174.74 2ozw s VAL 27 N -1.30 0.08 0.14 7.11 0.11 0.41 -1.52 120.40 125.43 2ozw s VAL 27 Ca 0.53 -0.68 0.10 0.00 -2.93 0.00 0.00 61.98 59.00 2ozw s VAL 27 Cb -0.33 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.24 2ozw s VAL 27 CO 0.43 -0.37 -0.23 -1.00 -3.33 0.00 0.00 175.10 170.59 2ozw s HIS 28 N -1.13 2.09 -0.72 1.54 3.76 -0.02 -0.74 115.29 120.08 2ozw s HIS 28 Ca -0.12 -0.40 -0.26 0.00 -0.15 0.00 0.00 55.06 54.13 2ozw s HIS 28 Cb -0.08 -1.10 -0.10 0.00 1.11 0.00 0.00 32.58 32.42 2ozw s HIS 28 CO -0.00 0.34 2.29 -1.12 -0.85 0.00 0.00 174.74 175.40 2ozw s SER 29 N -2.25 4.33 -0.01 1.40 0.01 -0.38 -3.49 113.70 113.30 2ozw s SER 29 Ca 0.14 0.21 0.11 0.00 1.31 0.00 0.00 55.95 57.72 2ozw s SER 29 Cb -0.09 -2.54 0.19 0.00 0.21 0.00 0.00 66.02 63.80 2ozw s SER 29 CO 0.07 -3.34 1.08 0.00 0.41 0.00 0.00 173.24 171.46 2ozw n ALA 30 N 16.79 2.19 -1.50 1.44 0.00 -1.26 -4.61 120.51 133.56 2ozw n ALA 30 Ca 0.41 -1.66 -0.48 0.00 0.00 0.00 0.00 53.44 51.71 2ozw n ALA 30 Cb 0.47 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.30 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 0.13 0.60 -1.52 0.00 -0.02 -1.26 -0.72 135.00 132.21 2ozw n PRO 31 Ca 0.03 0.21 -0.04 0.00 -2.02 0.00 0.00 63.50 61.69 2ozw n PRO 31 Cb 0.88 -1.47 -0.01 0.00 -0.02 0.00 0.00 33.50 32.88 2ozw n PRO 31 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2ozw n ARG 32 N 1.14 -1.58 -2.52 -0.52 1.74 -0.17 -1.15 116.66 113.61 2ozw n ARG 32 Ca 0.15 0.22 -0.11 0.00 -0.77 0.00 0.00 57.85 57.34 2ozw n ARG 32 Cb 0.25 -4.43 -0.00 0.00 -1.02 0.00 0.00 32.46 27.26 2ozw n ARG 32 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2ozw n SER 33 N -0.08 -3.52 0.00 0.55 7.64 0.11 -4.75 113.62 113.56 2ozw n SER 33 Ca -0.04 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.03 2ozw n SER 33 Cb 0.25 -3.00 0.00 0.00 -1.01 0.00 0.00 64.21 60.44 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 -0.79 0.74 3.72 0.23 0.00 -0.30 -5.09 105.19 103.69 2ozw n GLY 34 Ca -0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 1.54 0.19 4.61 0.00 -0.64 -4.93 120.51 121.28 2ozw n ALA 35 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 53.44 53.83 2ozw n ALA 35 Cb 0.31 -2.30 0.22 0.00 0.00 0.00 0.00 19.45 17.68 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 2.45 0.00 -7.25 0.00 0.13 -1.93 -3.46 132.00 121.93 2ozw h PRO 36 Ca -0.48 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.13 2ozw h PRO 36 Cb 1.28 0.00 0.14 0.00 0.13 0.00 0.00 31.00 32.55 2ozw h PRO 36 CO 0.62 0.29 0.32 0.00 -0.23 0.00 0.00 178.00 179.00 2ozw s ALA 37 N -3.27 2.10 0.00 -0.56 0.00 -1.26 -4.99 121.76 113.78 2ozw s ALA 37 Ca 0.03 0.51 0.18 0.00 0.00 0.00 0.00 51.96 52.69 2ozw s ALA 37 Cb 0.08 -3.36 0.30 0.00 0.00 0.00 0.00 23.12 20.14 2ozw s ALA 37 CO 0.69 -1.90 1.11 0.00 0.00 0.00 0.00 175.76 175.66 2ozw n ALA 38 N -3.29 2.36 -1.66 0.00 0.00 -1.26 -4.74 120.51 111.92 2ozw n ALA 38 Ca 0.11 -1.92 -0.30 0.00 0.00 0.00 0.00 53.44 51.33 2ozw n ALA 38 Cb 0.52 -0.65 0.20 0.00 0.00 0.00 0.00 19.45 19.52 2ozw n ALA 38 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2ozw s GLU 39 N 0.00 0.03 0.07 0.00 2.02 -1.26 -4.81 118.70 114.75 2ozw s GLU 39 Ca 0.24 -0.30 -0.03 0.00 0.02 0.00 0.00 54.97 54.89 2ozw s GLU 39 Cb 0.27 -1.76 -0.03 0.00 0.10 0.00 0.00 34.13 32.71 2ozw s GLU 39 CO -0.12 -2.84 0.04 -1.12 0.02 0.00 0.00 175.26 171.25 2ozw s SER 40 N -4.58 0.36 0.17 -0.19 0.01 -1.26 -1.25 113.70 106.97 2ozw s SER 40 Ca 0.73 -0.95 -0.10 0.00 1.31 0.00 0.00 55.95 56.95 2ozw s SER 40 Cb -0.06 0.25 -0.01 0.00 0.21 0.00 0.00 66.02 66.42 2ozw s SER 40 CO 0.54 -0.66 0.31 -0.75 0.41 0.00 0.00 173.24 173.09 2ozw s LYS 41 N -3.93 1.21 -0.07 12.44 2.20 0.08 -4.99 119.74 126.68 2ozw s LYS 41 Ca 0.09 -1.17 0.03 0.00 -0.36 0.00 0.00 55.97 54.56 2ozw s LYS 41 Cb 0.07 0.39 0.01 0.00 -1.51 0.00 0.00 37.83 36.79 2ozw s LYS 41 CO -0.08 -0.45 -0.17 -1.21 -0.36 0.00 0.00 175.35 173.08 2ozw s GLU 42 N -3.97 2.09 0.26 4.03 8.01 -1.26 -0.44 118.70 127.41 2ozw s GLU 42 Ca 0.18 -0.59 0.09 0.00 0.01 0.00 0.00 54.97 54.66 2ozw s GLU 42 Cb 0.03 -1.69 -0.04 0.00 -4.31 0.00 0.00 34.13 28.12 2ozw s GLU 42 CO 0.01 0.13 -0.00 0.96 0.01 0.00 0.00 175.26 176.36 2ozw s ILE 43 N 0.41 3.47 -0.13 -1.63 -4.36 0.07 -4.96 121.20 114.07 2ozw s ILE 43 Ca -0.13 -1.88 0.01 0.00 -0.26 0.00 0.00 60.65 58.39 2ozw s ILE 43 Cb -0.15 -2.85 0.02 0.00 1.25 0.00 0.00 42.46 40.73 2ozw s ILE 43 CO 0.05 -0.36 -0.13 -0.69 0.24 0.00 0.00 174.94 174.06 2ozw s VAL 44 N -2.28 1.39 0.02 8.37 1.01 -0.44 -1.35 120.40 127.11 2ozw s VAL 44 Ca 0.31 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.76 2ozw s VAL 44 Cb -0.07 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.99 2ozw s VAL 44 CO 0.20 0.43 -0.03 -0.13 0.00 0.00 0.00 175.10 175.56 2ozw s ARG 45 N 1.39 0.26 0.00 2.72 1.81 -1.08 -2.06 118.95 122.00 2ozw s ARG 45 Ca 0.01 -0.45 0.00 0.00 -1.72 0.00 0.00 55.73 53.57 2ozw s ARG 45 Cb -0.13 0.01 0.00 0.00 -0.45 0.00 0.00 34.95 34.38 2ozw s ARG 45 CO -0.07 -0.02 0.00 0.41 -0.68 0.00 0.00 175.30 174.94 2ozw n GLY 46 N 2.02 1.15 3.33 -3.53 0.00 -1.24 -0.67 105.19 106.25 2ozw n GLY 46 Ca -0.20 0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.57 -0.27 0.52 1.61 1.51 -1.13 -0.62 117.35 118.40 2ozw s TYR 47 Ca 0.00 0.19 0.17 0.00 -1.01 0.00 0.00 57.07 56.42 2ozw s TYR 47 Cb 0.00 0.24 1.29 0.00 -0.11 0.00 0.00 41.96 43.38 2ozw s TYR 47 CO 0.00 -0.60 2.13 1.57 -1.11 0.00 0.00 175.55 177.54 2ozw h LYS 48 N 2.87 0.00 0.00 -0.62 2.10 -1.86 -1.96 116.57 117.09 2ozw h LYS 48 Ca -0.32 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.30 2ozw h LYS 48 Cb 1.22 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2ozw h LYS 48 CO 0.44 0.00 -0.16 0.11 -2.00 0.00 0.00 179.45 177.84 2ozw h TRP 49 N 0.00 0.00 -1.02 0.07 5.08 -1.97 -3.35 115.95 114.76 2ozw h TRP 49 Ca 0.03 0.00 -0.70 0.00 1.08 0.00 0.00 58.89 59.30 2ozw h TRP 49 Cb 0.12 0.00 -0.10 0.00 -3.00 0.00 0.00 29.16 26.19 2ozw h TRP 49 CO 0.00 0.16 2.15 0.00 -1.28 0.00 0.00 178.44 179.47 2ozw n ALA 50 N -2.23 3.88 0.29 0.11 0.00 -0.74 -4.75 120.51 117.08 2ozw n ALA 50 Ca -0.01 -3.94 0.18 0.00 0.00 0.00 0.00 53.44 49.68 2ozw n ALA 50 Cb 0.33 -3.48 0.94 0.00 0.00 0.00 0.00 19.45 17.24 2ozw n ALA 50 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2ozw h GLU 51 N 7.26 0.00 -5.53 0.00 4.57 -1.84 -3.41 114.58 115.63 2ozw h GLU 51 Ca 0.44 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 58.12 2ozw h GLU 51 Cb 0.84 0.00 -0.27 0.00 -0.16 0.00 0.00 28.75 29.16 2ozw h GLU 51 CO 1.47 0.00 -0.81 0.71 -1.18 0.00 0.00 179.01 179.20 2ozw s TYR 52 N -3.87 1.42 0.40 0.92 2.02 -1.26 -5.03 117.35 111.94 2ozw s TYR 52 Ca -0.03 -0.32 0.12 0.00 -0.37 0.00 0.00 57.07 56.47 2ozw s TYR 52 Cb 0.10 -0.87 0.82 0.00 -0.40 0.00 0.00 41.96 41.62 2ozw s TYR 52 CO 0.38 0.02 1.91 0.45 -1.57 0.00 0.00 175.55 176.74 2ozw h HIS 53 N 5.26 0.11 -0.42 2.71 3.86 -1.94 -1.30 115.15 123.43 2ozw h HIS 53 Ca -0.38 -0.02 0.12 0.00 -1.16 0.00 0.00 60.37 58.94 2ozw h HIS 53 Cb 1.17 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.59 2ozw h HIS 53 CO 0.47 0.32 0.31 0.00 0.86 0.00 0.00 177.93 179.90 2ozw h ALA 54 N 1.68 2.35 -0.02 2.45 0.00 -1.96 -1.71 119.26 122.04 2ozw h ALA 54 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2ozw h ALA 54 Cb 0.45 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2ozw h ALA 54 CO 0.03 -0.53 -0.01 0.22 0.00 0.00 0.00 179.25 178.96 2ozw h ASP 55 N 0.00 0.05 -0.39 0.00 3.58 -1.61 -0.52 116.42 117.53 2ozw h ASP 55 Ca 0.20 -0.43 -0.10 0.00 0.42 0.00 0.00 57.03 57.11 2ozw h ASP 55 Cb 0.83 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.84 2ozw h ASP 55 CO -0.00 0.47 -0.13 0.16 -2.88 0.00 0.00 179.24 176.86 2ozw h ILE 56 N -0.37 1.26 -0.21 2.25 3.07 -1.62 -1.35 117.51 120.54 2ozw h ILE 56 Ca 0.00 -1.23 -0.01 0.00 1.55 0.00 0.00 64.86 65.18 2ozw h ILE 56 Cb 0.46 1.05 -0.01 0.00 -0.27 0.00 0.00 36.82 38.04 2ozw h ILE 56 CO 0.00 0.42 0.11 0.22 -1.05 0.00 0.00 178.15 177.85 2ozw h TYR 57 N 0.77 0.29 -0.29 0.16 3.20 -1.20 0.83 116.97 120.73 2ozw h TYR 57 Ca 0.12 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2ozw h TYR 57 Cb 0.64 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2ozw h TYR 57 CO 0.04 0.28 0.15 0.22 -1.64 0.00 0.00 178.16 177.21 2ozw h ASP 58 N 0.22 0.37 0.42 -2.11 3.58 -0.99 -0.88 116.42 117.02 2ozw h ASP 58 Ca 0.07 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 2ozw h ASP 58 Cb 0.09 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2ozw h ASP 58 CO -0.01 0.37 -0.20 0.50 -2.88 0.00 0.00 179.24 177.02 2ozw h LYS 59 N 0.35 -0.54 -0.02 0.28 3.64 -1.11 -0.92 116.57 118.25 2ozw h LYS 59 Ca 0.10 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 2ozw h LYS 59 Cb 0.09 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2ozw h LYS 59 CO -0.01 -0.29 -0.05 0.28 -2.27 0.00 0.00 179.45 177.11 2ozw h VAL 60 N -0.71 1.48 0.00 2.00 2.07 -0.83 -0.70 116.25 119.57 2ozw h VAL 60 Ca -0.06 -1.47 -0.05 0.00 0.82 0.00 0.00 66.70 65.94 2ozw h VAL 60 Cb 0.51 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 2ozw h VAL 60 CO 0.09 0.39 -0.23 0.28 0.02 0.00 0.00 177.57 178.13 2ozw h SER 61 N -0.53 0.00 -0.06 0.57 0.02 -1.27 0.95 113.55 113.23 2ozw h SER 61 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ozw h SER 61 Cb 0.66 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.20 2ozw h SER 61 CO 0.01 0.23 0.03 1.23 -1.14 0.00 0.00 176.83 177.19 2ozw h GLY 62 N 0.86 0.10 0.97 -3.77 0.00 -0.99 0.18 103.07 100.42 2ozw h GLY 62 Ca -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 2ozw h GLY 62 CO 0.03 0.04 0.23 -1.80 0.00 0.00 0.00 176.54 175.04 2ozw h ASP 63 N -0.01 0.64 -0.25 0.19 3.58 -0.20 0.38 116.42 120.75 2ozw h ASP 63 Ca 0.02 -0.13 0.04 0.00 0.42 0.00 0.00 57.03 57.38 2ozw h ASP 63 Cb 0.11 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 40.95 2ozw h ASP 63 CO -0.00 0.59 -0.00 0.24 -2.88 0.00 0.00 179.24 177.19 2ozw h MET 64 N 0.64 0.07 0.00 0.28 2.86 -0.79 -0.55 114.93 117.44 2ozw h MET 64 Ca 0.17 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.74 2ozw h MET 64 Cb 0.13 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2ozw h MET 64 CO -0.02 0.05 -0.31 1.96 1.06 0.00 0.00 176.91 179.65 2ozw h GLN 65 N 0.07 0.00 -0.39 1.72 1.08 -0.60 0.24 115.11 117.23 2ozw h GLN 65 Ca 0.12 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.21 2ozw h GLN 65 Cb 0.16 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2ozw h GLN 65 CO -0.21 0.31 -0.21 0.87 -0.95 0.00 0.00 178.83 178.64 2ozw h LYS 66 N 0.00 0.76 0.00 1.46 1.57 -0.20 -1.97 116.57 118.19 2ozw h LYS 66 Ca -0.00 -0.30 -0.07 0.00 -1.87 0.00 0.00 60.65 58.41 2ozw h LYS 66 Cb 0.57 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 2ozw h LYS 66 CO 0.04 0.91 -0.34 1.96 -0.57 0.00 0.00 179.45 181.44 2ozw h GLN 67 N 0.67 0.00 0.00 3.15 4.20 -0.09 -3.47 115.11 119.56 2ozw h GLN 67 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2ozw h GLN 67 Cb 0.71 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.49 2ozw h GLN 67 CO 0.05 0.34 0.00 0.41 -0.67 0.00 0.00 178.83 178.97 2ozw n GLY 68 N -0.19 1.20 3.65 3.46 0.00 0.60 -1.00 105.19 112.91 2ozw n GLY 68 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.64 4.93 0.16 0.00 2.15 -1.23 -2.43 116.67 119.62 2ozw s ASP 70 Ca 0.62 0.01 0.00 0.00 0.43 0.00 0.00 52.55 53.61 2ozw s ASP 70 Cb -0.55 -1.28 -0.04 0.00 -0.30 0.00 0.00 42.92 40.75 2ozw s ASP 70 CO 0.58 0.33 0.04 0.00 -0.17 0.00 0.00 175.17 175.95 2ozw s GLU 72 N -4.00 0.41 -0.04 0.00 2.12 -0.58 -4.99 118.70 111.61 2ozw s GLU 72 Ca 0.26 0.96 -0.30 0.00 0.36 0.00 0.00 54.97 56.25 2ozw s GLU 72 Cb 0.07 0.17 -0.04 0.00 0.26 0.00 0.00 34.13 34.59 2ozw s GLU 72 CO 0.04 -0.19 1.29 0.00 -0.54 0.00 0.00 175.26 175.85 2ozw h LEU 74 N 8.40 0.00 0.00 0.00 3.38 -1.24 -3.48 115.31 122.38 2ozw h LEU 74 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2ozw h LEU 74 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2ozw h LEU 74 CO 0.90 0.33 0.00 0.61 0.09 0.00 0.00 178.44 180.36 2ozw n GLY 75 N 0.13 -0.96 3.48 0.83 0.00 -1.25 -4.46 105.19 102.95 2ozw n GLY 75 Ca -0.00 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 2ozw n GLY 75 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ozw s GLY 76 N 0.00 1.09 0.00 -0.02 0.00 -0.68 -2.17 107.32 105.54 2ozw s GLY 76 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.43 2ozw s GLY 76 CO 0.00 -0.92 0.00 0.61 0.00 0.00 0.00 173.10 172.79 2ozw n GLY 77 N -0.43 2.03 3.16 0.20 0.00 -0.71 -3.01 105.19 106.43 2ozw n GLY 77 Ca 0.00 -0.69 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 2ozw n GLY 77 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ozw s ARG 78 N 0.93 0.81 0.09 1.61 1.70 0.71 -0.73 118.95 124.08 2ozw s ARG 78 Ca 0.00 -1.33 0.08 0.00 -0.47 0.00 0.00 55.73 54.01 2ozw s ARG 78 Cb 0.00 -0.15 -0.04 0.00 -0.57 0.00 0.00 34.95 34.20 2ozw s ARG 78 CO 0.00 -0.04 -0.16 0.42 -1.08 0.00 0.00 175.30 174.44 2ozw s ILE 79 N -3.67 2.95 0.39 4.99 1.01 -0.87 -1.88 121.20 124.11 2ozw s ILE 79 Ca 0.12 -1.36 0.00 0.00 0.00 0.00 0.00 60.65 59.40 2ozw s ILE 79 Cb 0.06 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 40.20 2ozw s ILE 79 CO -0.05 0.17 0.00 -1.20 0.00 0.00 0.00 174.94 173.86 2ozw n SER 80 N 0.98 -7.91 -0.84 3.58 7.64 0.50 -3.80 113.62 113.77 2ozw n SER 80 Ca -0.15 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.49 2ozw n SER 80 Cb 0.52 -4.16 0.00 0.00 -1.01 0.00 0.00 64.21 59.56 2ozw n SER 80 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ozw n HIS 81 N -4.08 -0.58 -1.08 1.43 1.44 -1.26 -4.77 115.22 106.33 2ozw n HIS 81 Ca -0.02 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.35 2ozw n HIS 81 Cb 0.61 0.00 0.10 0.00 0.12 0.00 0.00 29.99 30.83 2ozw n HIS 81 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2ozw n GLN 82 N 0.00 0.09 0.00 -1.40 6.02 -1.26 -4.85 117.38 115.99 2ozw n GLN 82 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 2ozw n GLN 82 Cb 0.00 -2.06 0.00 0.00 1.02 0.00 0.00 30.24 29.20 2ozw n GLN 82 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2ozw n SER 83 N -1.65 0.37 0.30 1.08 7.64 -1.26 -3.81 113.62 116.31 2ozw n SER 83 Ca 0.10 -0.76 0.18 0.00 1.01 0.00 0.00 58.87 59.40 2ozw n SER 83 Cb 0.51 -0.19 0.95 0.00 -1.01 0.00 0.00 64.21 64.48 2ozw n SER 83 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2ozw h GLN 84 N 0.61 0.00 -4.12 1.43 4.20 -2.01 -3.44 115.11 111.78 2ozw h GLN 84 Ca 0.00 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.50 2ozw h GLN 84 Cb 0.19 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 27.87 2ozw h GLN 84 CO 0.00 0.03 -0.28 0.34 -0.67 0.00 0.00 178.83 178.25 2ozw s ASP 85 N -5.65 0.45 -0.01 1.46 -1.08 -1.25 -5.08 116.67 105.51 2ozw s ASP 85 Ca -0.03 -1.30 0.06 0.00 -0.52 0.00 0.00 52.55 50.76 2ozw s ASP 85 Cb 0.13 0.57 -0.10 0.00 -1.46 0.00 0.00 42.92 42.06 2ozw s ASP 85 CO 0.50 -1.13 0.16 1.17 0.52 0.00 0.00 175.17 176.39 2ozw n LYS 86 N -0.44 0.77 -1.69 4.34 4.81 -1.26 -4.98 118.16 119.71 2ozw n LYS 86 Ca 0.01 -0.05 -0.44 0.00 -0.87 0.00 0.00 58.31 56.96 2ozw n LYS 86 Cb 0.63 -1.11 -0.02 0.00 0.02 0.00 0.00 35.03 34.54 2ozw n LYS 86 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2ozw n LYS 87 N -1.66 2.18 -1.59 1.64 4.81 -1.26 -4.96 118.16 117.32 2ozw n LYS 87 Ca -0.01 0.77 -0.33 0.00 -0.87 0.00 0.00 58.31 57.88 2ozw n LYS 87 Cb 0.16 -2.45 0.06 0.00 0.02 0.00 0.00 35.03 32.83 2ozw n LYS 87 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2ozw s ILE 88 N -0.15 3.13 0.15 3.15 1.09 -0.72 -4.90 121.20 122.94 2ozw s ILE 88 Ca 0.66 0.49 0.01 0.00 -1.10 0.00 0.00 60.65 60.71 2ozw s ILE 88 Cb -0.61 -2.99 -0.04 0.00 -1.06 0.00 0.00 42.46 37.76 2ozw s ILE 88 CO 0.51 -0.36 0.01 -2.28 -0.10 0.00 0.00 174.94 172.72 2ozw s HIS 89 N -2.43 1.08 -0.08 3.97 2.46 -1.26 -1.36 115.29 117.67 2ozw s HIS 89 Ca 0.67 -1.07 -0.05 0.00 0.47 0.00 0.00 55.06 55.07 2ozw s HIS 89 Cb -0.21 -0.62 0.03 0.00 -0.13 0.00 0.00 32.58 31.66 2ozw s HIS 89 CO 0.45 -0.29 0.20 0.08 -2.47 0.00 0.00 174.74 172.71 2ozw s VAL 90 N -3.76 -0.03 0.11 0.89 1.01 -0.19 -0.37 120.40 118.05 2ozw s VAL 90 Ca 0.23 0.10 -0.16 0.00 0.00 0.00 0.00 61.98 62.15 2ozw s VAL 90 Cb 0.06 -0.31 0.06 0.00 0.00 0.00 0.00 36.38 36.19 2ozw s VAL 90 CO 0.02 0.04 0.75 0.00 0.00 0.00 0.00 175.10 175.92 2ozw n TYR 91 N 3.73 -1.01 0.00 5.22 4.11 -0.79 -3.25 117.16 125.18 2ozw n TYR 91 Ca -0.21 -0.84 0.00 0.00 -0.00 0.00 0.00 57.90 56.85 2ozw n TYR 91 Cb 0.55 0.41 0.00 0.00 -0.00 0.00 0.00 39.34 40.30 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 -0.53 -1.43 3.45 -7.48 0.00 -1.26 -0.20 105.19 97.74 2ozw n GLY 92 Ca -0.01 -2.09 -0.16 0.00 0.00 0.00 0.00 46.02 43.76 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 -0.01 -0.54 0.32 1.61 1.13 -1.24 -4.56 117.35 114.05 2ozw s TYR 93 Ca 0.00 0.84 -0.18 0.00 -1.41 0.00 0.00 57.07 56.32 2ozw s TYR 93 Cb 0.00 0.36 -0.09 0.00 -1.10 0.00 0.00 41.96 41.13 2ozw s TYR 93 CO 0.00 -0.60 0.78 0.45 -2.51 0.00 0.00 175.55 173.67 2ozw s SER 94 N -1.45 6.91 0.05 -0.18 0.15 -0.78 -4.71 113.70 113.69 2ozw s SER 94 Ca -0.10 1.42 -0.16 0.00 0.70 0.00 0.00 55.95 57.82 2ozw s SER 94 Cb -0.01 -2.43 -0.24 0.00 -1.71 0.00 0.00 66.02 61.63 2ozw s SER 94 CO 0.06 -0.16 1.15 0.00 1.20 0.00 0.00 173.24 175.48 2ozw h MET 95 N 2.55 0.62 0.00 5.44 -0.00 -1.96 -1.21 114.93 120.37 2ozw h MET 95 Ca -0.48 -0.70 -0.09 0.00 -0.00 0.00 0.00 59.70 58.44 2ozw h MET 95 Cb 1.18 0.20 -0.01 0.00 -0.00 0.00 0.00 31.60 32.97 2ozw h MET 95 CO 0.65 1.29 -0.42 0.00 -0.00 0.00 0.00 176.91 178.42 2ozw h ALA 96 N 0.36 0.82 0.00 -3.00 0.00 -2.02 -3.37 119.26 112.05 2ozw h ALA 96 Ca -0.13 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2ozw h ALA 96 Cb 1.64 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2ozw h ALA 96 CO 0.19 0.52 0.00 0.66 0.00 0.00 0.00 179.25 180.62 2ozw n TYR 97 N -3.34 0.00 -1.04 0.00 4.01 -1.26 -5.15 117.16 110.38 2ozw n TYR 97 Ca 0.01 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.78 2ozw n TYR 97 Cb 0.62 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.64 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 0.05 -2.13 3.76 2.72 0.00 -0.46 -4.30 105.19 104.82 2ozw n GLY 98 Ca 0.00 -1.44 -0.40 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.01 4.54 0.87 1.61 0.04 -1.26 -1.69 135.00 138.10 2ozw s PRO 99 Ca 0.00 1.94 -0.12 0.00 0.04 0.00 0.00 61.00 62.86 2ozw s PRO 99 Cb 0.00 -3.16 0.12 0.00 0.04 0.00 0.00 34.50 31.50 2ozw s PRO 99 CO 0.00 0.06 1.17 0.00 0.04 0.00 0.00 177.00 178.27 2ozw s ALA 100 N -1.06 2.19 -1.17 8.56 0.00 -1.21 -4.54 121.76 124.53 2ozw s ALA 100 Ca 0.47 -0.62 -0.21 0.00 0.00 0.00 0.00 51.96 51.60 2ozw s ALA 100 Cb -0.34 -2.98 0.04 0.00 0.00 0.00 0.00 23.12 19.83 2ozw s ALA 100 CO 0.44 -2.03 1.67 -0.65 0.00 0.00 0.00 175.76 175.20 2ozw s GLN 101 N -5.45 3.62 0.28 0.00 -1.52 -1.26 -4.82 119.66 110.51 2ozw s GLN 101 Ca 0.64 -1.52 0.17 0.00 -1.95 0.00 0.00 55.36 52.69 2ozw s GLN 101 Cb -0.12 -5.42 0.91 0.00 -0.22 0.00 0.00 33.01 28.16 2ozw s GLN 101 CO 0.51 -2.48 1.48 0.72 -0.25 0.00 0.00 175.29 175.28 2ozw n HIS 102 N 9.48 0.57 -0.33 0.91 8.25 -1.26 -0.93 115.22 131.90 2ozw n HIS 102 Ca 0.43 0.30 -0.01 0.00 -0.26 0.00 0.00 57.72 58.17 2ozw n HIS 102 Cb 0.48 -0.92 0.12 0.00 1.12 0.00 0.00 29.99 30.78 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 1.80 1.19 -0.32 -1.41 0.00 -1.97 -1.39 119.26 117.16 2ozw h ALA 103 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2ozw h ALA 103 Cb 0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2ozw h ALA 103 CO 0.00 0.45 0.02 0.82 0.00 0.00 0.00 179.25 180.55 2ozw h ILE 104 N 1.15 1.25 -0.17 0.00 2.04 -1.45 -2.86 117.51 117.45 2ozw h ILE 104 Ca 0.36 -0.90 0.03 0.00 1.00 0.00 0.00 64.86 65.35 2ozw h ILE 104 Cb -0.01 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2ozw h ILE 104 CO -0.12 0.29 0.01 0.28 0.00 0.00 0.00 178.15 178.62 2ozw h SER 105 N 0.35 -0.04 -0.11 1.72 0.02 -1.56 -2.21 113.55 111.71 2ozw h SER 105 Ca 0.09 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2ozw h SER 105 Cb 0.40 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2ozw h SER 105 CO 0.01 0.01 0.05 0.71 -1.14 0.00 0.00 176.83 176.46 2ozw h THR 106 N 0.07 1.15 -0.93 -2.27 1.35 -1.24 0.33 112.91 111.37 2ozw h THR 106 Ca 0.08 -0.44 0.01 0.00 -0.55 0.00 0.00 66.41 65.51 2ozw h THR 106 Cb 0.09 1.23 -0.05 0.00 -1.73 0.00 0.00 68.15 67.69 2ozw h THR 106 CO -0.13 0.13 0.62 -0.33 -0.25 0.00 0.00 175.52 175.56 2ozw h GLU 107 N 0.03 1.23 -0.15 4.72 4.39 -1.38 0.90 114.58 124.33 2ozw h GLU 107 Ca 0.04 -0.08 -0.09 0.00 0.34 0.00 0.00 59.36 59.57 2ozw h GLU 107 Cb 0.17 -0.28 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 2ozw h GLU 107 CO -0.00 0.82 -0.27 0.87 -1.16 0.00 0.00 179.01 179.27 2ozw h LYS 108 N 1.27 0.44 -0.54 2.33 1.57 -1.17 -1.39 116.57 119.09 2ozw h LYS 108 Ca 0.34 -0.28 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 2ozw h LYS 108 Cb -0.14 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2ozw h LYS 108 CO -0.07 0.88 -0.01 0.82 -0.57 0.00 0.00 179.45 180.50 2ozw h ILE 109 N 0.06 1.26 -0.03 1.86 2.04 -0.55 -0.96 117.51 121.18 2ozw h ILE 109 Ca 0.01 -1.09 0.02 0.00 1.00 0.00 0.00 64.86 64.80 2ozw h ILE 109 Cb 0.86 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2ozw h ILE 109 CO 0.06 0.39 -0.07 0.11 0.00 0.00 0.00 178.15 178.64 2ozw h LYS 110 N 0.85 -0.10 -0.01 2.37 1.57 -0.83 -2.78 116.57 117.64 2ozw h LYS 110 Ca 0.16 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2ozw h LYS 110 Cb 0.51 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 2ozw h LYS 110 CO 0.03 -0.07 -0.02 0.00 -0.57 0.00 0.00 179.45 178.82 2ozw h ALA 111 N 0.91 1.95 -0.89 3.86 0.00 -0.61 -1.77 119.26 122.71 2ozw h ALA 111 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2ozw h ALA 111 Cb 0.15 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2ozw h ALA 111 CO -0.09 0.04 0.53 -0.22 0.00 0.00 0.00 179.25 179.50 2ozw h LYS 112 N 0.01 1.21 -1.51 0.00 3.64 -0.91 -3.39 116.57 115.63 2ozw h LYS 112 Ca 0.00 -0.12 -0.36 0.00 -1.27 0.00 0.00 60.65 58.90 2ozw h LYS 112 Cb 0.04 -0.25 -0.26 0.00 -0.41 0.00 0.00 32.23 31.35 2ozw h LYS 112 CO 0.00 0.86 -0.73 0.98 -2.27 0.00 0.00 179.45 178.29 2ozw n TYR 113 N -4.39 -2.40 0.83 1.91 9.36 -0.74 -5.03 117.16 116.71 2ozw n TYR 113 Ca 0.09 -2.33 0.08 0.00 3.32 0.00 0.00 57.90 59.07 2ozw n TYR 113 Cb 0.07 0.87 0.43 0.00 -0.63 0.00 0.00 39.34 40.08 2ozw n TYR 113 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2ozw n PRO 114 N 2.65 0.29 0.27 2.98 -0.04 -0.79 -1.67 135.00 138.68 2ozw n PRO 114 Ca 0.22 0.11 0.15 0.00 -0.04 0.00 0.00 63.50 63.94 2ozw n PRO 114 Cb 0.53 -1.50 0.68 0.00 -0.04 0.00 0.00 33.50 33.18 2ozw n PRO 114 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2ozw h ASP 115 N 0.00 0.00 -0.94 3.54 3.58 -1.96 -3.44 116.42 117.20 2ozw h ASP 115 Ca 0.00 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 56.94 2ozw h ASP 115 Cb 0.13 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 2ozw h ASP 115 CO 0.00 0.07 -0.23 -0.31 -2.88 0.00 0.00 179.24 175.89 2ozw s TYR 116 N -3.78 1.90 0.06 0.28 2.02 -0.67 -5.16 117.35 112.00 2ozw s TYR 116 Ca -0.00 -0.67 0.00 0.00 -0.37 0.00 0.00 57.07 56.03 2ozw s TYR 116 Cb 0.10 -2.14 -0.04 0.00 -0.40 0.00 0.00 41.96 39.49 2ozw s TYR 116 CO 0.56 -0.66 -0.04 -2.00 -1.57 0.00 0.00 175.55 171.83 2ozw s GLU 117 N -4.41 0.65 0.00 -0.62 2.12 -1.26 -4.92 118.70 110.26 2ozw s GLU 117 Ca 0.50 -1.16 -0.01 0.00 0.36 0.00 0.00 54.97 54.66 2ozw s GLU 117 Cb -0.05 0.03 -0.01 0.00 0.26 0.00 0.00 34.13 34.37 2ozw s GLU 117 CO 0.31 -0.06 0.01 0.08 -0.54 0.00 0.00 175.26 175.05 2ozw s VAL 118 N -3.40 0.04 0.27 3.70 1.01 -1.26 -1.76 120.40 119.01 2ozw s VAL 118 Ca 0.05 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.70 2ozw s VAL 118 Cb 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 36.38 36.23 2ozw s VAL 118 CO -0.07 -0.19 0.09 0.42 0.00 0.00 0.00 175.10 175.35 2ozw s THR 119 N -0.57 0.70 0.01 3.92 -4.23 -0.46 -4.96 115.64 110.05 2ozw s THR 119 Ca -0.06 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.39 2ozw s THR 119 Cb -0.04 -2.67 -0.01 0.00 1.34 0.00 0.00 72.50 71.13 2ozw s THR 119 CO -0.00 -0.01 0.10 -1.66 -0.54 0.00 0.00 174.62 172.50 2ozw s TRP 120 N -3.65 0.12 -0.29 3.99 1.48 -1.26 -1.02 118.94 118.30 2ozw s TRP 120 Ca 0.37 -0.29 0.03 0.00 -1.06 0.00 0.00 56.10 55.16 2ozw s TRP 120 Cb 0.08 -0.10 0.18 0.00 -1.16 0.00 0.00 33.47 32.48 2ozw s TRP 120 CO 0.14 -0.28 0.52 0.00 -4.06 0.00 0.00 176.95 173.27 2ozw s ALA 121 N -1.65 -1.94 0.35 2.67 0.00 -1.20 -4.98 121.76 115.01 2ozw s ALA 121 Ca -0.13 0.89 0.31 0.00 0.00 0.00 0.00 51.96 53.03 2ozw s ALA 121 Cb -0.07 -2.31 1.52 0.00 0.00 0.00 0.00 23.12 22.26 2ozw s ALA 121 CO -0.00 -1.72 2.07 -0.97 0.00 0.00 0.00 175.76 175.14 2ozw h ASN 122 N 8.06 0.00 -0.48 0.00 -0.00 -1.95 -3.30 115.58 117.91 2ozw h ASN 122 Ca -0.07 0.00 0.14 0.00 -0.00 0.00 0.00 56.30 56.37 2ozw h ASN 122 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.46 2ozw h ASN 122 CO 0.21 0.09 0.44 -0.78 -0.00 0.00 0.00 177.43 177.38 2ozw h ASP 123 N 0.00 0.00 0.34 1.15 3.58 -1.97 -0.88 116.42 118.64 2ozw h ASP 123 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 2ozw h ASP 123 Cb 0.37 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.42 2ozw h ASP 123 CO 0.01 0.00 -0.04 1.23 -2.88 0.00 0.00 179.24 177.56 2ozw h GLY 124 N 0.00 0.00 0.00 -0.78 0.00 -1.99 -3.51 103.07 96.79 2ozw h GLY 124 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2ozw h GLY 124 CO -0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82