#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 -1.12 0.23 3.04 0.00 -0.11 -4.88 121.76 118.92 2ozw s ALA 2 Ca 0.00 0.67 -0.31 0.00 0.00 0.00 0.00 51.96 52.33 2ozw s ALA 2 Cb 0.00 -1.81 -0.11 0.00 0.00 0.00 0.00 23.12 21.21 2ozw s ALA 2 CO 0.00 -1.43 1.56 0.08 0.00 0.00 0.00 175.76 175.97 2ozw s VAL 3 N 2.54 2.40 0.00 0.00 1.01 -1.23 -4.63 120.40 120.49 2ozw s VAL 3 Ca 0.12 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.41 2ozw s VAL 3 Cb -0.14 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.04 2ozw s VAL 3 CO -0.21 0.04 0.00 0.00 0.00 0.00 0.00 175.10 174.93 2ozw n ALA 4 N 3.01 0.00 -3.15 5.51 0.00 -1.26 -5.10 120.51 119.51 2ozw n ALA 4 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.42 2ozw n ALA 4 Cb 0.38 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.73 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 -0.89 -0.13 0.53 0.00 -1.08 -1.26 -4.83 116.67 109.01 2ozw s ASP 5 Ca 0.00 0.11 0.20 0.00 -0.52 0.00 0.00 52.55 52.33 2ozw s ASP 5 Cb 0.00 0.33 1.37 0.00 -1.46 0.00 0.00 42.92 43.17 2ozw s ASP 5 CO 0.00 -0.30 2.14 -0.07 0.52 0.00 0.00 175.17 177.46 2ozw h LEU 6 N 4.66 0.00 -1.46 -1.34 3.38 -1.98 -0.32 115.31 118.25 2ozw h LEU 6 Ca -0.29 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 2ozw h LEU 6 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2ozw h LEU 6 CO 0.39 0.00 -0.24 0.00 0.09 0.00 0.00 178.44 178.67 2ozw h ALA 7 N 1.95 1.24 0.00 1.53 0.00 -1.99 -3.00 119.26 118.98 2ozw h ALA 7 Ca 0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 2ozw h ALA 7 Cb 0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2ozw h ALA 7 CO -0.00 0.30 -0.65 -0.07 0.00 0.00 0.00 179.25 178.83 2ozw h LEU 8 N 0.00 0.00 -9.56 0.00 3.38 -1.47 -3.46 115.31 104.20 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 0.57 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.35 2ozw h LEU 8 CO 0.03 0.42 0.87 -0.63 0.09 0.00 0.00 178.44 179.22 2ozw s ILE 9 N -3.01 2.85 -0.34 1.22 1.01 -1.14 -4.90 121.20 116.89 2ozw s ILE 9 Ca 0.03 0.56 -0.43 0.00 0.00 0.00 0.00 60.65 60.81 2ozw s ILE 9 Cb 0.08 -3.36 -0.17 0.00 0.01 0.00 0.00 42.46 39.01 2ozw s ILE 9 CO 0.75 0.03 1.66 -2.65 0.00 0.00 0.00 174.94 174.73 2ozw n PRO 10 N 4.29 0.70 0.09 2.79 -0.02 -1.26 -4.87 135.00 136.71 2ozw n PRO 10 Ca 0.14 0.25 -0.11 0.00 -2.02 0.00 0.00 63.50 61.76 2ozw n PRO 10 Cb 0.40 -1.86 -0.09 0.00 -0.02 0.00 0.00 33.50 31.92 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 6.18 0.26 -3.89 2.55 3.58 -1.90 -3.44 116.42 119.76 2ozw h ASP 11 Ca -0.46 -0.25 -0.30 0.00 0.42 0.00 0.00 57.03 56.44 2ozw h ASP 11 Cb 1.34 -0.08 -0.28 0.00 1.72 0.00 0.00 39.33 42.03 2ozw h ASP 11 CO 0.95 1.15 -0.75 -0.69 -2.88 0.00 0.00 179.24 177.03 2ozw s VAL 12 N -2.85 0.33 -0.17 2.25 1.01 -1.26 -1.97 120.40 117.73 2ozw s VAL 12 Ca -0.02 -0.20 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 2ozw s VAL 12 Cb 0.09 -0.28 0.06 0.00 0.00 0.00 0.00 36.38 36.24 2ozw s VAL 12 CO 0.85 0.08 0.42 -0.62 0.00 0.00 0.00 175.10 175.83 2ozw s ASP 13 N -0.13 -0.53 0.11 3.32 2.15 -0.78 -4.98 116.67 115.82 2ozw s ASP 13 Ca 0.01 0.91 -0.10 0.00 0.43 0.00 0.00 52.55 53.81 2ozw s ASP 13 Cb -0.02 0.79 0.00 0.00 -0.30 0.00 0.00 42.92 43.39 2ozw s ASP 13 CO -0.00 -0.19 0.23 0.27 -0.17 0.00 0.00 175.17 175.31 2ozw s ILE 14 N 1.39 0.12 -0.32 4.11 -4.36 -1.26 -3.29 121.20 117.59 2ozw s ILE 14 Ca -0.09 -1.14 0.16 0.00 -0.26 0.00 0.00 60.65 59.32 2ozw s ILE 14 Cb -0.08 -1.40 0.44 0.00 1.25 0.00 0.00 42.46 42.67 2ozw s ILE 14 CO -0.13 -0.55 1.33 -0.67 0.24 0.00 0.00 174.94 175.16 2ozw n ASP 15 N -0.11 -0.35 -3.94 4.36 2.03 -1.26 -5.06 116.55 112.24 2ozw n ASP 15 Ca -0.14 -2.25 -0.12 0.00 0.52 0.00 0.00 54.79 52.80 2ozw n ASP 15 Cb 0.63 0.27 -0.08 0.00 -0.72 0.00 0.00 41.12 41.22 2ozw n ASP 15 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2ozw s SER 16 N -2.13 0.34 0.18 1.67 0.01 -1.26 -4.78 113.70 107.72 2ozw s SER 16 Ca 0.18 -1.31 -0.10 0.00 1.31 0.00 0.00 55.95 56.03 2ozw s SER 16 Cb 0.41 0.49 -0.00 0.00 0.21 0.00 0.00 66.02 67.12 2ozw s SER 16 CO -0.08 -1.01 0.34 -0.62 0.41 0.00 0.00 173.24 172.28 2ozw s ASP 17 N -3.15 -0.02 0.38 2.44 2.15 -1.26 -5.07 116.67 112.14 2ozw s ASP 17 Ca 0.33 -0.84 0.00 0.00 0.43 0.00 0.00 52.55 52.48 2ozw s ASP 17 Cb 0.03 0.47 0.00 0.00 -0.30 0.00 0.00 42.92 43.13 2ozw s ASP 17 CO 0.14 -0.95 0.00 0.61 -0.17 0.00 0.00 175.17 174.80 2ozw n GLY 18 N -0.26 -0.66 3.72 2.66 0.00 -1.26 -4.73 105.19 104.65 2ozw n GLY 18 Ca -0.07 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 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 0.00 4.12 -0.02 1.61 1.01 -1.26 -4.16 120.40 121.70 2ozw s VAL 19 Ca 0.00 1.58 -0.22 0.00 0.00 0.00 0.00 61.98 63.34 2ozw s VAL 19 Cb 0.00 -4.01 0.05 0.00 0.00 0.00 0.00 36.38 32.42 2ozw s VAL 19 CO 0.00 0.16 0.49 0.72 0.00 0.00 0.00 175.10 176.46 2ozw s PHE 20 N 0.77 -0.40 0.56 5.22 -0.71 -0.92 -4.97 117.98 117.54 2ozw s PHE 20 Ca 0.56 0.62 -0.16 0.00 -1.04 0.00 0.00 56.93 56.91 2ozw s PHE 20 Cb -0.28 0.25 -0.05 0.00 -1.21 0.00 0.00 43.02 41.73 2ozw s PHE 20 CO 0.30 -0.52 1.02 0.15 -1.34 0.00 0.00 175.22 174.84 2ozw s LYS 21 N -1.48 3.60 0.12 1.99 1.02 -1.26 -0.92 119.74 122.82 2ozw s LYS 21 Ca -0.11 1.06 -0.08 0.00 0.02 0.00 0.00 55.97 56.87 2ozw s LYS 21 Cb -0.02 -2.08 -0.01 0.00 -0.52 0.00 0.00 37.83 35.20 2ozw s LYS 21 CO 0.05 -0.57 0.21 1.52 -0.92 0.00 0.00 175.35 175.64 2ozw s TYR 22 N -2.58 0.32 0.09 3.18 1.13 0.13 -2.53 117.35 117.09 2ozw s TYR 22 Ca 0.61 -0.73 0.04 0.00 -1.41 0.00 0.00 57.07 55.58 2ozw s TYR 22 Cb -0.13 -0.11 -0.03 0.00 -1.10 0.00 0.00 41.96 40.59 2ozw s TYR 22 CO 0.36 -0.60 -0.11 0.14 -2.51 0.00 0.00 175.55 172.83 2ozw s VAL 23 N -3.92 0.96 -0.25 -3.49 -7.23 0.21 -1.39 120.40 105.29 2ozw s VAL 23 Ca 0.11 -1.57 -0.06 0.00 -1.81 0.00 0.00 61.98 58.65 2ozw s VAL 23 Cb 0.05 -1.29 -0.02 0.00 0.56 0.00 0.00 36.38 35.68 2ozw s VAL 23 CO -0.06 -0.50 0.04 -0.22 -0.31 0.00 0.00 175.10 174.05 2ozw s LEU 24 N -2.31 3.32 -0.14 1.32 1.98 -0.96 -2.33 118.68 119.57 2ozw s LEU 24 Ca 0.04 -0.34 0.02 0.00 -2.89 0.00 0.00 54.13 50.95 2ozw s LEU 24 Cb -0.04 -1.86 0.01 0.00 0.66 0.00 0.00 46.19 44.96 2ozw s LEU 24 CO 0.01 -0.05 -0.19 -0.63 -1.89 0.00 0.00 176.35 173.60 2ozw s ILE 25 N 1.55 1.82 0.41 6.68 1.01 -0.56 -0.49 121.20 131.62 2ozw s ILE 25 Ca 0.06 -0.82 -0.23 0.00 0.00 0.00 0.00 60.65 59.66 2ozw s ILE 25 Cb -0.15 -1.64 -0.10 0.00 0.01 0.00 0.00 42.46 40.59 2ozw s ILE 25 CO 0.01 0.50 1.00 -0.60 0.00 0.00 0.00 174.94 175.85 2ozw s ARG 26 N 1.02 4.19 0.02 2.79 3.52 0.29 -0.62 118.95 130.16 2ozw s ARG 26 Ca -0.04 1.34 0.03 0.00 -0.13 0.00 0.00 55.73 56.93 2ozw s ARG 26 Cb -0.15 -2.40 -0.01 0.00 -1.56 0.00 0.00 34.95 30.83 2ozw s ARG 26 CO -0.04 -0.09 -0.10 0.08 -0.81 0.00 0.00 175.30 174.34 2ozw s VAL 27 N -1.86 0.74 0.05 7.11 1.01 0.54 -2.15 120.40 125.84 2ozw s VAL 27 Ca 0.59 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.97 2ozw s VAL 27 Cb -0.17 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2ozw s VAL 27 CO 0.21 0.01 -0.22 -1.00 0.00 0.00 0.00 175.10 174.10 2ozw s HIS 28 N -0.62 1.92 -0.30 5.22 3.76 0.10 -0.93 115.29 124.44 2ozw s HIS 28 Ca -0.00 -0.38 -0.28 0.00 -0.15 0.00 0.00 55.06 54.25 2ozw s HIS 28 Cb -0.06 -1.14 -0.05 0.00 1.11 0.00 0.00 32.58 32.45 2ozw s HIS 28 CO 0.00 0.11 2.16 -1.12 -0.85 0.00 0.00 174.74 175.04 2ozw s SER 29 N -1.23 5.35 0.00 1.40 0.01 -0.28 -3.01 113.70 115.94 2ozw s SER 29 Ca 0.08 1.57 0.13 0.00 1.31 0.00 0.00 55.95 59.05 2ozw s SER 29 Cb -0.09 -2.51 0.22 0.00 0.21 0.00 0.00 66.02 63.84 2ozw s SER 29 CO 0.02 -2.09 1.07 0.00 0.41 0.00 0.00 173.24 172.65 2ozw n ALA 30 N 12.19 2.90 0.54 1.44 0.00 -1.26 -4.61 120.51 131.71 2ozw n ALA 30 Ca 0.29 -1.52 0.00 0.00 0.00 0.00 0.00 53.44 52.22 2ozw n ALA 30 Cb 0.47 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2ozw n ALA 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2ozw n PRO 31 N 0.25 0.54 -0.13 0.00 -0.04 -1.26 -1.31 135.00 133.06 2ozw n PRO 31 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2ozw n PRO 31 Cb 0.92 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 33.11 2ozw n PRO 31 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2ozw n ARG 32 N 0.29 0.00 -2.23 0.54 0.00 -1.26 -3.52 116.66 110.48 2ozw n ARG 32 Ca 0.00 -0.35 -0.11 0.00 -0.00 0.00 0.00 57.85 57.39 2ozw n ARG 32 Cb 0.15 -0.28 -0.01 0.00 0.00 0.00 0.00 32.46 32.32 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 0.00 -3.41 0.00 6.15 7.64 -0.42 -4.40 113.62 119.17 2ozw n SER 33 Ca 0.00 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2ozw n SER 33 Cb 0.53 -2.98 0.00 0.00 -1.01 0.00 0.00 64.21 60.75 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 -0.66 0.00 3.77 0.23 0.00 -1.26 -5.14 105.19 102.13 2ozw n GLY 34 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2ozw n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozw s ALA 35 N 0.00 2.49 0.21 4.61 0.00 -1.26 -4.97 121.76 122.84 2ozw s ALA 35 Ca 0.00 0.66 0.17 0.00 0.00 0.00 0.00 51.96 52.79 2ozw s ALA 35 Cb 0.00 -3.35 0.62 0.00 0.00 0.00 0.00 23.12 20.39 2ozw s ALA 35 CO 0.00 -1.21 1.71 -1.00 0.00 0.00 0.00 175.76 175.26 2ozw h PRO 36 N 0.30 0.00 -7.06 0.00 0.13 -2.00 -3.44 132.00 119.93 2ozw h PRO 36 Ca -0.48 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.14 2ozw h PRO 36 Cb 1.26 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.47 2ozw h PRO 36 CO 0.54 0.43 0.46 0.00 -0.23 0.00 0.00 178.00 179.20 2ozw s ALA 37 N -3.65 2.75 -0.03 -0.56 0.00 -1.26 -4.97 121.76 114.05 2ozw s ALA 37 Ca -0.00 0.91 0.22 0.00 0.00 0.00 0.00 51.96 53.09 2ozw s ALA 37 Cb 0.12 -3.39 0.38 0.00 0.00 0.00 0.00 23.12 20.23 2ozw s ALA 37 CO 0.70 -0.83 1.15 0.00 0.00 0.00 0.00 175.76 176.79 2ozw n ALA 38 N -1.11 2.56 -1.58 0.00 0.00 -1.26 -4.71 120.51 114.42 2ozw n ALA 38 Ca 0.11 -2.16 -0.30 0.00 0.00 0.00 0.00 53.44 51.09 2ozw n ALA 38 Cb 0.50 -0.70 0.20 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.32 0.01 0.05 0.00 0.41 -1.26 -4.80 118.70 112.79 2ozw s GLU 39 Ca 0.29 -0.21 -0.02 0.00 -0.41 0.00 0.00 54.97 54.62 2ozw s GLU 39 Cb 0.34 -1.75 -0.03 0.00 -1.78 0.00 0.00 34.13 30.90 2ozw s GLU 39 CO -0.14 -2.87 -0.00 -1.12 -0.49 0.00 0.00 175.26 170.65 2ozw s SER 40 N -4.43 0.41 0.26 -0.19 0.01 -1.26 -1.13 113.70 107.37 2ozw s SER 40 Ca 0.72 -0.88 -0.14 0.00 1.31 0.00 0.00 55.95 56.96 2ozw s SER 40 Cb -0.07 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.36 2ozw s SER 40 CO 0.54 -0.57 0.52 -0.75 0.41 0.00 0.00 173.24 173.39 2ozw s LYS 41 N -3.55 1.63 0.10 12.44 2.20 -0.11 -4.99 119.74 127.45 2ozw s LYS 41 Ca 0.03 -1.25 0.03 0.00 -0.36 0.00 0.00 55.97 54.43 2ozw s LYS 41 Cb 0.05 0.49 -0.04 0.00 -1.51 0.00 0.00 37.83 36.83 2ozw s LYS 41 CO -0.09 -0.69 -0.09 -1.21 -0.36 0.00 0.00 175.35 172.92 2ozw s GLU 42 N -3.89 0.84 0.10 4.03 8.01 -1.26 -0.34 118.70 126.19 2ozw s GLU 42 Ca 0.21 -1.23 0.04 0.00 0.01 0.00 0.00 54.97 54.00 2ozw s GLU 42 Cb -0.02 -0.41 -0.04 0.00 -4.31 0.00 0.00 34.13 29.36 2ozw s GLU 42 CO 0.09 0.04 -0.11 0.96 0.01 0.00 0.00 175.26 176.26 2ozw s ILE 43 N -2.89 1.00 -0.18 -1.63 -4.36 0.21 -4.90 121.20 108.45 2ozw s ILE 43 Ca 0.08 -1.66 -0.00 0.00 -0.26 0.00 0.00 60.65 58.80 2ozw s ILE 43 Cb 0.00 -1.40 0.01 0.00 1.25 0.00 0.00 42.46 42.32 2ozw s ILE 43 CO -0.02 -0.55 -0.15 -0.69 0.24 0.00 0.00 174.94 173.78 2ozw s VAL 44 N -2.43 2.57 -0.00 8.37 1.01 -0.83 -1.50 120.40 127.58 2ozw s VAL 44 Ca 0.06 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.32 2ozw s VAL 44 Cb -0.03 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 2ozw s VAL 44 CO 0.00 0.50 -0.16 -0.13 0.00 0.00 0.00 175.10 175.31 2ozw s ARG 45 N 1.22 1.28 -0.29 2.72 1.81 -0.98 -1.87 118.95 122.84 2ozw s ARG 45 Ca 0.03 -0.63 -0.22 0.00 -1.72 0.00 0.00 55.73 53.18 2ozw s ARG 45 Cb -0.14 -1.26 0.15 0.00 -0.45 0.00 0.00 34.95 33.25 2ozw s ARG 45 CO -0.07 0.34 1.13 0.20 -0.68 0.00 0.00 175.30 176.22 2ozw s GLY 46 N -0.54 0.07 -0.05 -3.53 0.00 -1.21 -0.62 107.32 101.44 2ozw s GLY 46 Ca 0.06 3.09 -0.21 0.00 0.00 0.00 0.00 44.72 47.66 2ozw s GLY 46 CO -0.00 2.13 0.47 -0.19 0.00 0.00 0.00 173.10 175.51 2ozw s TYR 47 N 0.54 -0.40 0.50 1.90 1.51 -1.05 -3.98 117.35 116.37 2ozw s TYR 47 Ca 0.00 0.72 0.22 0.00 -1.01 0.00 0.00 57.07 57.01 2ozw s TYR 47 Cb -0.04 0.22 1.30 0.00 -0.11 0.00 0.00 41.96 43.32 2ozw s TYR 47 CO -0.11 -0.45 1.99 1.57 -1.11 0.00 0.00 175.55 177.44 2ozw h LYS 48 N 3.78 0.11 0.00 -0.62 2.10 -1.86 -1.41 116.57 118.67 2ozw h LYS 48 Ca -0.28 -0.01 -0.08 0.00 -2.00 0.00 0.00 60.65 58.28 2ozw h LYS 48 Cb 1.16 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.46 2ozw h LYS 48 CO 0.37 0.07 -0.39 0.11 -2.00 0.00 0.00 179.45 177.61 2ozw h TRP 49 N 0.11 0.00 -0.85 0.07 5.08 -1.96 -3.31 115.95 115.10 2ozw h TRP 49 Ca 0.27 0.00 -0.72 0.00 1.08 0.00 0.00 58.89 59.52 2ozw h TRP 49 Cb 0.90 0.00 -0.10 0.00 -3.00 0.00 0.00 29.16 26.96 2ozw h TRP 49 CO -0.00 0.39 2.40 0.00 -1.28 0.00 0.00 178.44 179.95 2ozw n ALA 50 N -2.41 4.83 0.39 0.11 0.00 -0.53 -4.74 120.51 118.17 2ozw n ALA 50 Ca -0.01 -4.04 0.04 0.00 0.00 0.00 0.00 53.44 49.43 2ozw n ALA 50 Cb 0.44 -3.34 0.22 0.00 0.00 0.00 0.00 19.45 16.77 2ozw n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ozw n GLU 51 N 5.95 0.09 -4.06 0.00 4.07 -1.25 -4.44 120.64 121.01 2ozw n GLU 51 Ca 0.46 0.24 -0.14 0.00 -0.06 0.00 0.00 57.16 57.66 2ozw n GLU 51 Cb 0.40 -1.50 -0.13 0.00 -0.06 0.00 0.00 31.44 30.15 2ozw n GLU 51 CO 0.00 0.00 0.00 1.52 -0.06 0.00 0.00 177.13 178.59 2ozw s TYR 52 N -2.68 0.42 0.29 4.31 1.13 -1.26 -5.01 117.35 114.55 2ozw s TYR 52 Ca 0.07 -0.25 0.08 0.00 -1.41 0.00 0.00 57.07 55.57 2ozw s TYR 52 Cb 0.06 -0.27 0.43 0.00 -1.10 0.00 0.00 41.96 41.08 2ozw s TYR 52 CO 0.14 -0.05 1.67 0.45 -2.51 0.00 0.00 175.55 175.25 2ozw h HIS 53 N 5.44 0.15 -0.66 -3.49 3.86 -1.94 -1.94 115.15 116.57 2ozw h HIS 53 Ca -0.30 -0.05 0.19 0.00 -1.16 0.00 0.00 60.37 59.05 2ozw h HIS 53 Cb 1.20 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.61 2ozw h HIS 53 CO 0.51 0.61 0.48 0.00 0.86 0.00 0.00 177.93 180.39 2ozw h ALA 54 N 1.38 2.62 -0.06 2.45 0.00 -1.97 -2.26 119.26 121.41 2ozw h ALA 54 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2ozw h ALA 54 Cb 0.93 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2ozw h ALA 54 CO 0.07 -0.82 -0.04 0.22 0.00 0.00 0.00 179.25 178.68 2ozw h ASP 55 N 0.00 0.15 -0.56 0.00 3.58 -1.72 -0.57 116.42 117.31 2ozw h ASP 55 Ca 0.31 -0.44 -0.07 0.00 0.42 0.00 0.00 57.03 57.25 2ozw h ASP 55 Cb 1.27 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 42.26 2ozw h ASP 55 CO -0.00 0.56 0.08 0.16 -2.88 0.00 0.00 179.24 177.15 2ozw h ILE 56 N -0.26 1.26 0.07 2.25 3.07 -1.65 -1.65 117.51 120.59 2ozw h ILE 56 Ca 0.01 -0.99 -0.00 0.00 1.55 0.00 0.00 64.86 65.43 2ozw h ILE 56 Cb 0.50 0.82 0.00 0.00 -0.27 0.00 0.00 36.82 37.87 2ozw h ILE 56 CO 0.01 0.36 -0.03 0.22 -1.05 0.00 0.00 178.15 177.66 2ozw h TYR 57 N 0.82 -0.08 -0.52 0.16 3.20 -1.31 -0.39 116.97 118.84 2ozw h TYR 57 Ca 0.17 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2ozw h TYR 57 Cb 0.43 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 2ozw h TYR 57 CO 0.03 0.03 0.31 0.22 -1.64 0.00 0.00 178.16 177.11 2ozw h ASP 58 N -0.18 0.64 0.03 -2.11 3.58 -1.05 0.13 116.42 117.45 2ozw h ASP 58 Ca -0.01 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 2ozw h ASP 58 Cb 0.15 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.04 2ozw h ASP 58 CO 0.01 0.52 -0.02 0.50 -2.88 0.00 0.00 179.24 177.38 2ozw h LYS 59 N 0.70 -0.04 0.07 0.28 3.64 -1.20 -1.97 116.57 118.04 2ozw h LYS 59 Ca 0.19 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.28 2ozw h LYS 59 Cb 0.01 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2ozw h LYS 59 CO -0.03 -0.03 -1.53 0.28 -2.27 0.00 0.00 179.45 175.87 2ozw h VAL 60 N -0.04 1.12 -0.61 2.00 2.07 -0.84 -1.32 116.25 118.63 2ozw h VAL 60 Ca -0.00 -2.83 -0.02 0.00 0.82 0.00 0.00 66.70 64.67 2ozw h VAL 60 Cb 0.04 2.66 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 2ozw h VAL 60 CO 0.00 0.76 0.31 0.77 0.02 0.00 0.00 177.57 179.43 2ozw h SER 61 N 0.04 0.76 0.04 0.57 4.64 -0.83 0.58 113.55 119.35 2ozw h SER 61 Ca -0.23 -0.07 0.02 0.00 -0.47 0.00 0.00 61.79 61.04 2ozw h SER 61 Cb 1.98 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 63.85 2ozw h SER 61 CO 0.13 0.64 -0.16 1.23 -0.87 0.00 0.00 176.83 177.80 2ozw h GLY 62 N 0.93 -0.24 0.99 -0.77 0.00 -1.24 0.01 103.07 102.76 2ozw h GLY 62 Ca 0.21 0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.73 2ozw h GLY 62 CO -0.03 -0.15 0.29 -1.80 0.00 0.00 0.00 176.54 174.84 2ozw h ASP 63 N -0.28 0.56 -0.32 0.19 3.58 -0.56 0.10 116.42 119.69 2ozw h ASP 63 Ca 0.04 -0.05 0.01 0.00 0.42 0.00 0.00 57.03 57.45 2ozw h ASP 63 Cb 0.32 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 2ozw h ASP 63 CO -0.12 0.44 0.19 0.24 -2.88 0.00 0.00 179.24 177.11 2ozw h MET 64 N 0.62 0.38 -0.00 0.28 2.86 -0.77 -0.42 114.93 117.88 2ozw h MET 64 Ca 0.17 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 2ozw h MET 64 Cb -0.02 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 2ozw h MET 64 CO -0.03 0.25 -0.41 1.96 1.06 0.00 0.00 176.91 179.74 2ozw h GLN 65 N 0.40 0.01 -0.47 1.72 1.08 -0.71 0.25 115.11 117.39 2ozw h GLN 65 Ca 0.12 -0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.22 2ozw h GLN 65 Cb -0.01 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.40 2ozw h GLN 65 CO -0.05 0.41 -0.10 0.87 -0.95 0.00 0.00 178.83 179.01 2ozw h LYS 66 N 0.01 0.85 -0.28 1.46 1.57 -0.12 -2.45 116.57 117.62 2ozw h LYS 66 Ca -0.00 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 2ozw h LYS 66 Cb 0.72 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 2ozw h LYS 66 CO 0.05 0.92 0.07 1.96 -0.57 0.00 0.00 179.45 181.87 2ozw h GLN 67 N 0.77 0.44 0.00 3.15 4.20 -0.46 -0.86 115.11 122.35 2ozw h GLN 67 Ca 0.13 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2ozw h GLN 67 Cb 0.61 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2ozw h GLN 67 CO 0.04 0.53 0.00 0.41 -0.67 0.00 0.00 178.83 179.14 2ozw n GLY 68 N -0.54 0.97 3.61 3.46 0.00 0.66 -0.93 105.19 112.41 2ozw n GLY 68 Ca -0.03 0.00 -0.38 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 -1.13 4.97 0.14 0.00 2.15 -1.17 -2.77 116.67 118.87 2ozw s ASP 70 Ca 0.73 0.03 -0.03 0.00 0.43 0.00 0.00 52.55 53.71 2ozw s ASP 70 Cb -0.44 -1.31 -0.03 0.00 -0.30 0.00 0.00 42.92 40.83 2ozw s ASP 70 CO 0.49 0.34 0.11 0.00 -0.17 0.00 0.00 175.17 175.94 2ozw s GLU 72 N -4.04 0.50 -0.02 0.00 2.12 -0.92 -5.00 118.70 111.35 2ozw s GLU 72 Ca 0.23 0.93 -0.30 0.00 0.36 0.00 0.00 54.97 56.20 2ozw s GLU 72 Cb 0.07 0.03 -0.05 0.00 0.26 0.00 0.00 34.13 34.43 2ozw s GLU 72 CO 0.02 -0.16 1.46 0.00 -0.54 0.00 0.00 175.26 176.04 2ozw h LEU 74 N 8.83 0.00 0.00 0.00 3.38 -1.15 -3.48 115.31 122.89 2ozw h LEU 74 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2ozw h LEU 74 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2ozw h LEU 74 CO 0.92 0.39 0.00 0.61 0.09 0.00 0.00 178.44 180.45 2ozw n GLY 75 N -0.17 -1.41 3.57 0.83 0.00 -1.24 -4.59 105.19 102.18 2ozw n GLY 75 Ca -0.01 -1.04 -0.27 0.00 0.00 0.00 0.00 46.02 44.71 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 2.51 0.00 -0.02 0.00 -0.30 -2.26 107.32 107.25 2ozw s GLY 76 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.15 2ozw s GLY 76 CO 0.00 -1.97 0.00 0.61 0.00 0.00 0.00 173.10 171.74 2ozw n GLY 77 N -0.93 0.72 3.27 0.20 0.00 -0.49 -1.49 105.19 106.47 2ozw n GLY 77 Ca -0.07 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.49 0.98 0.11 1.61 1.70 0.59 -0.69 118.95 122.76 2ozw s ARG 78 Ca 0.00 -1.00 0.09 0.00 -0.47 0.00 0.00 55.73 54.35 2ozw s ARG 78 Cb 0.00 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.72 2ozw s ARG 78 CO 0.00 -0.34 -0.23 0.42 -1.08 0.00 0.00 175.30 174.07 2ozw s ILE 79 N -3.89 1.88 0.07 4.99 1.01 -0.09 -0.96 121.20 124.20 2ozw s ILE 79 Ca 0.09 -1.59 -0.07 0.00 0.00 0.00 0.00 60.65 59.08 2ozw s ILE 79 Cb 0.04 -1.68 -0.01 0.00 0.01 0.00 0.00 42.46 40.82 2ozw s ILE 79 CO -0.07 0.00 0.15 -0.94 0.00 0.00 0.00 174.94 174.07 2ozw s SER 80 N -1.91 0.16 -0.24 3.58 1.04 -0.49 -2.16 113.70 113.70 2ozw s SER 80 Ca 0.09 -0.63 0.12 0.00 0.48 0.00 0.00 55.95 56.01 2ozw s SER 80 Cb -0.10 0.29 0.34 0.00 0.10 0.00 0.00 66.02 66.65 2ozw s SER 80 CO 0.05 -0.64 1.34 1.57 0.98 0.00 0.00 173.24 176.53 2ozw n HIS 81 N 0.24 -1.00 1.35 5.02 -0.00 -1.26 -1.05 115.22 118.51 2ozw n HIS 81 Ca -0.16 -1.45 0.09 0.00 -0.00 0.00 0.00 57.72 56.20 2ozw n HIS 81 Cb 0.61 0.96 0.54 0.00 -0.00 0.00 0.00 29.99 32.10 2ozw n HIS 81 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2ozw n GLN 82 N -0.96 0.67 -1.32 1.57 3.00 -1.26 -4.86 117.38 114.23 2ozw n GLN 82 Ca -0.15 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.47 2ozw n GLN 82 Cb 0.84 -1.42 0.06 0.00 0.00 0.00 0.00 30.24 29.72 2ozw n GLN 82 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2ozw n SER 83 N -0.92 -1.26 -0.88 1.08 7.64 -1.26 -4.93 113.62 113.08 2ozw n SER 83 Ca 0.14 0.63 0.06 0.00 1.01 0.00 0.00 58.87 60.70 2ozw n SER 83 Cb 0.06 -1.19 0.19 0.00 -1.01 0.00 0.00 64.21 62.26 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 -0.44 2.25 -3.93 1.43 6.02 -1.26 -4.88 117.38 116.56 2ozw n GLN 84 Ca 0.10 -1.53 -0.09 0.00 -0.01 0.00 0.00 57.00 55.47 2ozw n GLN 84 Cb 0.49 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 30.22 2ozw n GLN 84 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2ozw s ASP 85 N -0.85 -0.05 0.00 1.08 2.15 -1.26 -5.05 116.67 112.69 2ozw s ASP 85 Ca 0.28 -0.83 0.00 0.00 0.43 0.00 0.00 52.55 52.43 2ozw s ASP 85 Cb 0.16 0.50 0.00 0.00 -0.30 0.00 0.00 42.92 43.29 2ozw s ASP 85 CO 0.16 -0.99 0.99 0.29 -0.17 0.00 0.00 175.17 175.45 2ozw n LYS 86 N -0.29 0.65 -3.59 4.34 5.02 -1.26 -4.73 118.16 118.30 2ozw n LYS 86 Ca -0.06 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.83 2ozw n LYS 86 Cb 0.63 -1.17 -0.11 0.00 -0.02 0.00 0.00 35.03 34.36 2ozw n LYS 86 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2ozw s LYS 87 N 0.53 2.74 0.74 1.97 2.20 -1.26 -1.25 119.74 125.42 2ozw s LYS 87 Ca 0.00 -1.24 -0.11 0.00 -0.36 0.00 0.00 55.97 54.27 2ozw s LYS 87 Cb 0.00 -3.76 0.04 0.00 -1.51 0.00 0.00 37.83 32.60 2ozw s LYS 87 CO 0.00 -0.81 1.08 0.42 -0.36 0.00 0.00 175.35 175.68 2ozw s ILE 88 N 1.51 3.62 0.04 5.43 1.01 0.29 -4.67 121.20 128.43 2ozw s ILE 88 Ca 0.02 0.53 -0.00 0.00 0.00 0.00 0.00 60.65 61.19 2ozw s ILE 88 Cb -0.21 -3.13 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 2ozw s ILE 88 CO 0.05 -0.69 -0.03 -2.28 0.00 0.00 0.00 174.94 171.99 2ozw s HIS 89 N -2.98 0.44 -0.01 3.97 2.46 -0.22 -2.21 115.29 116.74 2ozw s HIS 89 Ca 0.60 -0.82 0.01 0.00 0.47 0.00 0.00 55.06 55.32 2ozw s HIS 89 Cb -0.16 -0.31 0.00 0.00 -0.13 0.00 0.00 32.58 31.98 2ozw s HIS 89 CO 0.56 -0.28 -0.04 0.08 -2.47 0.00 0.00 174.74 172.59 2ozw s VAL 90 N -2.79 0.34 0.03 0.89 1.01 -0.68 -1.39 120.40 117.80 2ozw s VAL 90 Ca -0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 2ozw s VAL 90 Cb -0.00 -0.32 0.01 0.00 0.00 0.00 0.00 36.38 36.07 2ozw s VAL 90 CO -0.06 0.12 0.10 0.00 0.00 0.00 0.00 175.10 175.26 2ozw n TYR 91 N 3.25 -0.86 -4.27 5.22 4.11 -0.14 -2.61 117.16 121.87 2ozw n TYR 91 Ca -0.16 -0.15 0.00 0.00 -0.00 0.00 0.00 57.90 57.58 2ozw n TYR 91 Cb 0.56 0.08 0.00 0.00 -0.00 0.00 0.00 39.34 39.98 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 -0.07 -1.58 3.79 -7.48 0.00 -1.16 -0.30 105.19 98.40 2ozw n GLY 92 Ca -0.01 -1.28 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 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 0.00 0.04 0.32 1.61 -0.85 -1.26 -4.59 117.35 112.62 2ozw s TYR 93 Ca 0.00 -0.55 0.08 0.00 -0.52 0.00 0.00 57.07 56.08 2ozw s TYR 93 Cb 0.00 0.65 -0.03 0.00 0.38 0.00 0.00 41.96 42.95 2ozw s TYR 93 CO 0.00 -1.31 0.24 0.45 -1.52 0.00 0.00 175.55 173.41 2ozw s SER 94 N -3.00 5.21 -0.14 -0.18 0.15 -1.03 -4.35 113.70 110.36 2ozw s SER 94 Ca 0.15 -0.50 0.13 0.00 0.70 0.00 0.00 55.95 56.43 2ozw s SER 94 Cb -0.05 -1.01 -0.18 0.00 -1.71 0.00 0.00 66.02 63.08 2ozw s SER 94 CO 0.09 -0.28 0.05 1.15 1.20 0.00 0.00 173.24 175.46 2ozw n MET 95 N -1.29 1.66 0.18 5.44 0.00 -1.26 -2.36 117.12 119.49 2ozw n MET 95 Ca -0.03 -0.01 0.05 0.00 0.00 0.00 0.00 57.70 57.71 2ozw n MET 95 Cb 0.60 -1.37 0.29 0.00 0.00 0.00 0.00 33.22 32.74 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 0.71 0.95 0.00 3.17 0.00 -2.03 -3.38 119.26 118.69 2ozw h ALA 96 Ca -0.38 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.15 2ozw h ALA 96 Cb 1.86 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2ozw h ALA 96 CO 0.02 0.52 0.00 0.66 0.00 0.00 0.00 179.25 180.45 2ozw n TYR 97 N -3.51 0.00 -1.64 0.00 4.01 -1.26 -5.13 117.16 109.62 2ozw n TYR 97 Ca -0.00 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.79 2ozw n TYR 97 Cb 0.55 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.56 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 0.15 -2.00 3.76 2.72 0.00 -1.00 -4.36 105.19 104.46 2ozw n GLY 98 Ca 0.00 -1.36 -0.41 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.04 4.43 1.10 1.61 0.04 -1.26 -1.15 135.00 138.73 2ozw s PRO 99 Ca 0.00 2.07 -0.17 0.00 0.04 0.00 0.00 61.00 62.94 2ozw s PRO 99 Cb 0.00 -3.14 0.24 0.00 0.04 0.00 0.00 34.50 31.64 2ozw s PRO 99 CO 0.00 -0.12 1.17 0.00 0.04 0.00 0.00 177.00 178.09 2ozw s ALA 100 N -0.73 1.17 0.37 8.56 0.00 -0.56 -4.54 121.76 126.03 2ozw s ALA 100 Ca 0.50 -0.93 0.09 0.00 0.00 0.00 0.00 51.96 51.63 2ozw s ALA 100 Cb -0.37 -2.89 0.71 0.00 0.00 0.00 0.00 23.12 20.57 2ozw s ALA 100 CO 0.45 -3.11 1.86 1.96 0.00 0.00 0.00 175.76 176.92 2ozw h GLN 101 N -2.18 0.20 0.00 0.00 1.08 -1.92 -3.47 115.11 108.82 2ozw h GLN 101 Ca -0.46 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 2ozw h GLN 101 Cb 1.29 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 2ozw h GLN 101 CO 0.40 0.42 0.00 0.72 -0.95 0.00 0.00 178.83 179.42 2ozw n HIS 102 N -4.20 0.00 -0.16 2.96 8.25 -1.26 -4.60 115.22 116.21 2ozw n HIS 102 Ca -0.01 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.37 2ozw n HIS 102 Cb 0.33 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.45 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 0.60 -0.46 -1.41 0.00 -2.00 -1.03 119.26 114.96 2ozw h ALA 103 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2ozw h ALA 103 Cb 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2ozw h ALA 103 CO 0.00 0.18 0.29 0.82 0.00 0.00 0.00 179.25 180.54 2ozw h ILE 104 N 0.61 1.13 0.22 0.00 2.04 -2.00 -2.53 117.51 116.99 2ozw h ILE 104 Ca 0.16 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2ozw h ILE 104 Cb 0.15 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2ozw h ILE 104 CO -0.02 0.13 -0.11 0.28 0.00 0.00 0.00 178.15 178.44 2ozw h SER 105 N 0.61 -0.25 -0.39 1.72 0.02 -1.83 -2.09 113.55 111.34 2ozw h SER 105 Ca 0.17 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 2ozw h SER 105 Cb -0.04 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2ozw h SER 105 CO -0.03 -0.16 -0.07 0.71 -1.14 0.00 0.00 176.83 176.14 2ozw h THR 106 N -0.32 1.27 -0.82 -2.27 1.35 -1.16 -0.11 112.91 110.85 2ozw h THR 106 Ca -0.03 -1.13 0.02 0.00 -0.55 0.00 0.00 66.41 64.72 2ozw h THR 106 Cb 0.25 1.21 -0.04 0.00 -1.73 0.00 0.00 68.15 67.84 2ozw h THR 106 CO 0.05 0.38 0.54 -0.33 -0.25 0.00 0.00 175.52 175.91 2ozw h GLU 107 N 0.54 1.04 -0.27 4.72 4.39 -1.38 0.13 114.58 123.75 2ozw h GLU 107 Ca 0.10 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 2ozw h GLU 107 Cb 0.57 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 2ozw h GLU 107 CO 0.03 0.69 -0.03 0.87 -1.16 0.00 0.00 179.01 179.42 2ozw h LYS 108 N 1.08 0.49 -0.57 2.33 1.57 -1.12 -1.63 116.57 118.72 2ozw h LYS 108 Ca 0.31 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.89 2ozw h LYS 108 Cb -0.06 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2ozw h LYS 108 CO -0.09 0.68 0.22 0.82 -0.57 0.00 0.00 179.45 180.50 2ozw h ILE 109 N 0.26 1.23 -0.33 1.86 2.04 -0.50 -0.57 117.51 121.50 2ozw h ILE 109 Ca 0.07 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.23 2ozw h ILE 109 Cb 0.47 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 2ozw h ILE 109 CO 0.02 0.28 0.15 0.11 0.00 0.00 0.00 178.15 178.71 2ozw h LYS 110 N 0.79 0.31 -0.83 2.37 1.57 -0.71 -0.24 116.57 119.84 2ozw h LYS 110 Ca 0.19 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 2ozw h LYS 110 Cb 0.22 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 2ozw h LYS 110 CO -0.01 0.21 0.39 0.00 -0.57 0.00 0.00 179.45 179.47 2ozw h ALA 111 N 1.18 1.07 0.00 3.86 0.00 -0.85 -2.55 119.26 121.97 2ozw h ALA 111 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ozw h ALA 111 Cb 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2ozw h ALA 111 CO -0.10 0.64 -0.09 0.87 0.00 0.00 0.00 179.25 180.57 2ozw h LYS 112 N 1.18 0.00 -2.10 0.00 1.79 -0.82 -3.37 116.57 113.25 2ozw h LYS 112 Ca 0.28 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 58.21 2ozw h LYS 112 Cb 0.13 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.37 2ozw h LYS 112 CO -0.03 0.00 -0.94 0.66 -1.08 0.00 0.00 179.45 178.05 2ozw n TYR 113 N -3.04 1.54 0.38 -1.35 4.01 -0.12 -4.95 117.16 113.61 2ozw n TYR 113 Ca 0.04 -3.85 0.11 0.00 -0.16 0.00 0.00 57.90 54.04 2ozw n TYR 113 Cb 0.53 -0.44 0.48 0.00 -0.31 0.00 0.00 39.34 39.60 2ozw n TYR 113 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2ozw n PRO 114 N 0.55 0.17 0.06 -0.72 -0.04 -0.98 -1.24 135.00 132.80 2ozw n PRO 114 Ca 0.26 0.43 0.08 0.00 -0.04 0.00 0.00 63.50 64.23 2ozw n PRO 114 Cb 0.52 -1.85 0.34 0.00 -0.04 0.00 0.00 33.50 32.47 2ozw n PRO 114 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2ozw n ASP 115 N -2.17 0.25 -4.40 3.54 2.03 -1.26 -4.79 116.55 109.75 2ozw n ASP 115 Ca 0.02 0.58 -0.28 0.00 0.52 0.00 0.00 54.79 55.62 2ozw n ASP 115 Cb 0.20 -0.62 -0.08 0.00 -0.72 0.00 0.00 41.12 39.90 2ozw n ASP 115 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2ozw s TYR 116 N -3.15 1.85 0.29 -0.67 1.51 -0.37 -5.02 117.35 111.78 2ozw s TYR 116 Ca 0.04 -1.12 0.06 0.00 -1.01 0.00 0.00 57.07 55.04 2ozw s TYR 116 Cb 0.07 -1.36 -0.06 0.00 -0.11 0.00 0.00 41.96 40.50 2ozw s TYR 116 CO 0.25 -0.05 -0.05 -2.00 -1.11 0.00 0.00 175.55 172.59 2ozw s GLU 117 N -3.78 1.57 -0.04 -0.62 2.12 -0.38 -4.94 118.70 112.64 2ozw s GLU 117 Ca 0.18 -1.81 -0.06 0.00 0.36 0.00 0.00 54.97 53.64 2ozw s GLU 117 Cb 0.03 -1.15 0.01 0.00 0.26 0.00 0.00 34.13 33.28 2ozw s GLU 117 CO 0.10 0.02 0.15 0.08 -0.54 0.00 0.00 175.26 175.07 2ozw s VAL 118 N -3.02 0.03 0.28 3.70 1.01 -1.26 -0.54 120.40 120.60 2ozw s VAL 118 Ca 0.30 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2ozw s VAL 118 Cb 0.04 -0.30 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 2ozw s VAL 118 CO 0.12 -0.14 0.17 0.42 0.00 0.00 0.00 175.10 175.68 2ozw s THR 119 N -0.44 0.22 0.05 3.92 -4.23 -0.94 -4.95 115.64 109.27 2ozw s THR 119 Ca -0.05 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.40 2ozw s THR 119 Cb -0.03 -2.51 -0.01 0.00 1.34 0.00 0.00 72.50 71.28 2ozw s THR 119 CO 0.01 0.00 0.09 -1.66 -0.54 0.00 0.00 174.62 172.52 2ozw s TRP 120 N -3.71 0.26 -0.31 3.99 1.48 -1.26 -1.69 118.94 117.70 2ozw s TRP 120 Ca 0.37 -0.65 0.04 0.00 -1.06 0.00 0.00 56.10 54.80 2ozw s TRP 120 Cb 0.05 -0.18 0.17 0.00 -1.16 0.00 0.00 33.47 32.36 2ozw s TRP 120 CO 0.18 -0.42 0.47 0.00 -4.06 0.00 0.00 176.95 173.12 2ozw s ALA 121 N -3.24 -1.49 -1.13 2.67 0.00 -1.07 -4.97 121.76 112.51 2ozw s ALA 121 Ca 0.00 0.26 0.13 0.00 0.00 0.00 0.00 51.96 52.36 2ozw s ALA 121 Cb 0.03 -2.24 0.61 0.00 0.00 0.00 0.00 23.12 21.51 2ozw s ALA 121 CO -0.08 -1.86 1.41 -1.71 0.00 0.00 0.00 175.76 173.52 2ozw n ASN 122 N 5.15 0.00 0.16 0.00 4.05 -1.26 -2.10 115.26 121.27 2ozw n ASN 122 Ca 0.04 0.37 0.13 0.00 0.45 0.00 0.00 54.58 55.57 2ozw n ASN 122 Cb 0.51 -0.43 0.66 0.00 1.23 0.00 0.00 39.78 41.74 2ozw n ASN 122 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 177.26 173.43 2ozw h ASP 123 N 0.00 0.00 -4.15 1.20 3.58 -1.96 -3.40 116.42 111.69 2ozw h ASP 123 Ca 0.00 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.91 2ozw h ASP 123 Cb 0.20 0.00 0.16 0.00 1.72 0.00 0.00 39.33 41.40 2ozw h ASP 123 CO 0.00 0.00 0.43 -0.83 -2.88 0.00 0.00 179.24 175.96 2ozw s GLY 124 N -4.05 2.51 0.00 -0.78 0.00 -0.89 -4.97 107.32 99.14 2ozw s GLY 124 Ca -0.05 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.65 2ozw s GLY 124 CO 0.69 1.40 0.00 1.58 0.00 0.00 0.00 173.10 176.77