#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 0.18 0.05 -5.12 0.00 -1.26 -5.08 121.76 110.53 2ozw s ALA 2 Ca 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 51.96 50.73 2ozw s ALA 2 Cb 0.00 1.01 -0.02 0.00 0.00 0.00 0.00 23.12 24.11 2ozw s ALA 2 CO 0.00 -0.86 0.05 0.54 0.00 0.00 0.00 175.76 175.49 2ozw s VAL 3 N -3.05 0.16 0.28 0.00 0.11 -1.15 -1.92 120.40 114.83 2ozw s VAL 3 Ca 0.25 -1.34 -0.08 0.00 -2.93 0.00 0.00 61.98 57.87 2ozw s VAL 3 Cb -0.02 -1.11 0.03 0.00 -1.53 0.00 0.00 36.38 33.76 2ozw s VAL 3 CO 0.16 -0.74 0.51 0.00 -3.33 0.00 0.00 175.10 171.70 2ozw n ALA 4 N 0.52 -1.01 -2.97 1.54 0.00 -1.25 -4.91 120.51 112.43 2ozw n ALA 4 Ca -0.17 -0.98 -0.12 0.00 0.00 0.00 0.00 53.44 52.18 2ozw n ALA 4 Cb 0.59 0.78 -0.13 0.00 0.00 0.00 0.00 19.45 20.70 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 -2.50 -0.02 0.46 0.00 -1.08 -1.26 -4.80 116.67 107.47 2ozw s ASP 5 Ca 0.14 0.02 0.15 0.00 -0.52 0.00 0.00 52.55 52.33 2ozw s ASP 5 Cb -0.03 0.14 1.11 0.00 -1.46 0.00 0.00 42.92 42.69 2ozw s ASP 5 CO 0.10 -0.10 2.03 -0.07 0.52 0.00 0.00 175.17 177.66 2ozw h LEU 6 N 5.66 0.25 -1.37 -1.34 3.38 -1.96 -0.79 115.31 119.14 2ozw h LEU 6 Ca -0.26 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2ozw h LEU 6 Cb 1.20 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2ozw h LEU 6 CO 0.45 0.16 -0.24 0.00 0.09 0.00 0.00 178.44 178.90 2ozw h ALA 7 N 1.77 1.15 0.00 1.53 0.00 -2.00 -3.03 119.26 118.68 2ozw h ALA 7 Ca 0.19 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2ozw h ALA 7 Cb 0.41 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2ozw h ALA 7 CO -0.04 0.30 -0.54 -0.07 0.00 0.00 0.00 179.25 178.91 2ozw h LEU 8 N 0.00 0.00 -9.52 0.00 3.38 -1.57 -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 0.63 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.40 2ozw h LEU 8 CO 0.03 0.49 0.83 -0.63 0.09 0.00 0.00 178.44 179.25 2ozw s ILE 9 N -2.97 3.12 -0.04 1.22 1.01 -1.15 -4.93 121.20 117.47 2ozw s ILE 9 Ca 0.04 0.74 -0.38 0.00 0.00 0.00 0.00 60.65 61.05 2ozw s ILE 9 Cb 0.08 -3.48 -0.17 0.00 0.01 0.00 0.00 42.46 38.90 2ozw s ILE 9 CO 0.75 0.04 1.43 -2.65 0.00 0.00 0.00 174.94 174.50 2ozw n PRO 10 N 4.43 0.98 0.08 2.79 -0.02 -1.26 -4.89 135.00 137.11 2ozw n PRO 10 Ca 0.13 0.35 -0.14 0.00 -2.02 0.00 0.00 63.50 61.82 2ozw n PRO 10 Cb 0.41 -1.99 -0.14 0.00 -0.02 0.00 0.00 33.50 31.77 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 5.09 0.33 -3.61 2.55 3.58 -1.91 -3.44 116.42 119.00 2ozw h ASP 11 Ca -0.48 -0.38 -0.30 0.00 0.42 0.00 0.00 57.03 56.30 2ozw h ASP 11 Cb 1.34 -0.11 -0.32 0.00 1.72 0.00 0.00 39.33 41.97 2ozw h ASP 11 CO 0.82 1.30 -0.74 -0.69 -2.88 0.00 0.00 179.24 177.06 2ozw s VAL 12 N -2.65 0.09 -0.12 2.25 1.01 -1.26 -1.81 120.40 117.90 2ozw s VAL 12 Ca -0.04 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 2ozw s VAL 12 Cb 0.08 -0.16 0.04 0.00 0.00 0.00 0.00 36.38 36.34 2ozw s VAL 12 CO 0.86 0.09 0.29 -0.62 0.00 0.00 0.00 175.10 175.72 2ozw s ASP 13 N 0.64 -0.32 0.06 3.32 2.15 -0.83 -4.99 116.67 116.69 2ozw s ASP 13 Ca -0.06 0.61 -0.10 0.00 0.43 0.00 0.00 52.55 53.43 2ozw s ASP 13 Cb -0.09 0.54 0.00 0.00 -0.30 0.00 0.00 42.92 43.07 2ozw s ASP 13 CO -0.01 -0.15 0.21 0.27 -0.17 0.00 0.00 175.17 175.32 2ozw s ILE 14 N 0.90 0.12 -0.34 4.11 -4.36 -1.26 -3.46 121.20 116.91 2ozw s ILE 14 Ca -0.06 -0.96 0.15 0.00 -0.26 0.00 0.00 60.65 59.52 2ozw s ILE 14 Cb -0.07 -1.08 0.44 0.00 1.25 0.00 0.00 42.46 43.00 2ozw s ILE 14 CO -0.06 -0.53 1.22 -0.67 0.24 0.00 0.00 174.94 175.14 2ozw n ASP 15 N 0.38 -0.12 -3.75 4.36 2.03 -1.25 -5.06 116.55 113.14 2ozw n ASP 15 Ca -0.17 -2.40 -0.13 0.00 0.52 0.00 0.00 54.79 52.61 2ozw n ASP 15 Cb 0.60 0.19 -0.07 0.00 -0.72 0.00 0.00 41.12 41.13 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 -2.28 0.50 0.23 1.67 0.01 -1.26 -4.81 113.70 107.76 2ozw s SER 16 Ca 0.22 -1.34 -0.12 0.00 1.31 0.00 0.00 55.95 56.03 2ozw s SER 16 Cb 0.41 0.55 -0.01 0.00 0.21 0.00 0.00 66.02 67.18 2ozw s SER 16 CO -0.05 -1.09 0.43 -0.62 0.41 0.00 0.00 173.24 172.32 2ozw s ASP 17 N -3.17 -0.07 0.00 2.44 2.15 -1.26 -5.05 116.67 111.71 2ozw s ASP 17 Ca 0.32 -0.92 0.00 0.00 0.43 0.00 0.00 52.55 52.38 2ozw s ASP 17 Cb 0.02 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 43.19 2ozw s ASP 17 CO 0.16 -1.08 0.00 0.61 -0.17 0.00 0.00 175.17 174.69 2ozw n GLY 18 N -0.35 1.25 3.09 2.66 0.00 -1.26 -4.69 105.19 105.89 2ozw n GLY 18 Ca -0.03 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 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 0.01 -0.01 1.61 1.01 -1.26 -0.94 120.40 120.82 2ozw s VAL 19 Ca 0.00 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 2ozw s VAL 19 Cb 0.00 -0.31 0.07 0.00 0.00 0.00 0.00 36.38 36.14 2ozw s VAL 19 CO 0.00 -0.04 0.68 0.72 0.00 0.00 0.00 175.10 176.46 2ozw s PHE 20 N -0.05 -0.62 0.54 5.22 -0.71 -0.36 -4.92 117.98 117.07 2ozw s PHE 20 Ca -0.02 0.94 -0.18 0.00 -1.04 0.00 0.00 56.93 56.63 2ozw s PHE 20 Cb -0.02 0.44 -0.06 0.00 -1.21 0.00 0.00 43.02 42.17 2ozw s PHE 20 CO 0.00 -0.65 1.05 0.15 -1.34 0.00 0.00 175.22 174.44 2ozw s LYS 21 N -1.73 3.56 0.11 1.99 3.01 -1.26 -0.79 119.74 124.64 2ozw s LYS 21 Ca -0.08 1.31 -0.10 0.00 -1.01 0.00 0.00 55.97 56.09 2ozw s LYS 21 Cb -0.00 -2.06 0.00 0.00 -1.01 0.00 0.00 37.83 34.76 2ozw s LYS 21 CO 0.05 -0.63 0.24 1.52 0.51 0.00 0.00 175.35 177.04 2ozw s TYR 22 N -2.17 0.16 0.10 3.18 1.13 -0.16 -2.07 117.35 117.52 2ozw s TYR 22 Ca 0.66 -0.56 0.05 0.00 -1.41 0.00 0.00 57.07 55.81 2ozw s TYR 22 Cb -0.17 -0.02 -0.03 0.00 -1.10 0.00 0.00 41.96 40.64 2ozw s TYR 22 CO 0.28 -0.60 -0.12 0.14 -2.51 0.00 0.00 175.55 172.73 2ozw s VAL 23 N -3.88 1.11 -0.29 -3.49 -7.23 0.02 -1.76 120.40 104.88 2ozw s VAL 23 Ca 0.07 -1.57 -0.07 0.00 -1.81 0.00 0.00 61.98 58.60 2ozw s VAL 23 Cb 0.04 -1.33 0.01 0.00 0.56 0.00 0.00 36.38 35.66 2ozw s VAL 23 CO -0.09 -0.42 0.08 -0.22 -0.31 0.00 0.00 175.10 174.14 2ozw s LEU 24 N -2.26 3.82 -0.15 1.32 1.98 -0.64 -2.57 118.68 120.18 2ozw s LEU 24 Ca 0.05 -0.69 0.02 0.00 -2.89 0.00 0.00 54.13 50.61 2ozw s LEU 24 Cb -0.05 -1.88 0.01 0.00 0.66 0.00 0.00 46.19 44.93 2ozw s LEU 24 CO 0.02 -0.18 -0.21 -0.63 -1.89 0.00 0.00 176.35 173.46 2ozw s ILE 25 N 1.50 2.16 0.43 6.68 1.01 -0.66 -0.58 121.20 131.74 2ozw s ILE 25 Ca 0.03 -0.94 -0.22 0.00 0.00 0.00 0.00 60.65 59.52 2ozw s ILE 25 Cb -0.17 -1.88 -0.10 0.00 0.01 0.00 0.00 42.46 40.32 2ozw s ILE 25 CO 0.02 0.54 0.98 -0.60 0.00 0.00 0.00 174.94 175.88 2ozw s ARG 26 N 0.87 4.18 0.04 2.79 3.52 0.42 -0.66 118.95 130.11 2ozw s ARG 26 Ca -0.05 1.23 0.03 0.00 -0.13 0.00 0.00 55.73 56.81 2ozw s ARG 26 Cb -0.15 -2.27 -0.02 0.00 -1.56 0.00 0.00 34.95 30.95 2ozw s ARG 26 CO -0.03 -0.08 -0.10 0.08 -0.81 0.00 0.00 175.30 174.35 2ozw s VAL 27 N -2.02 0.78 0.13 7.11 1.01 0.46 -2.07 120.40 125.79 2ozw s VAL 27 Ca 0.61 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.62 2ozw s VAL 27 Cb -0.13 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2ozw s VAL 27 CO 0.17 -0.22 -0.13 -1.00 0.00 0.00 0.00 175.10 173.92 2ozw s HIS 28 N -1.12 1.40 0.00 5.22 0.09 -0.12 -0.89 115.29 119.87 2ozw s HIS 28 Ca -0.05 -0.60 -0.01 0.00 -0.00 0.00 0.00 55.06 54.41 2ozw s HIS 28 Cb -0.09 -0.72 -0.05 0.00 -0.00 0.00 0.00 32.58 31.72 2ozw s HIS 28 CO 0.01 0.15 1.31 0.43 -0.00 0.00 0.00 174.74 176.65 2ozw n SER 29 N 0.30 2.32 0.00 1.40 7.64 -0.59 -3.62 113.62 121.07 2ozw n SER 29 Ca -0.14 -1.75 0.09 0.00 1.01 0.00 0.00 58.87 58.08 2ozw n SER 29 Cb 0.58 -0.55 0.41 0.00 -1.01 0.00 0.00 64.21 63.64 2ozw n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ozw n ALA 30 N 2.22 1.87 -0.94 -0.43 0.00 -1.26 -4.40 120.51 117.58 2ozw n ALA 30 Ca 0.08 -0.07 -0.35 0.00 0.00 0.00 0.00 53.44 53.11 2ozw n ALA 30 Cb 0.30 -1.30 0.08 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.47 -0.11 -1.47 0.00 -0.02 -1.00 -2.30 135.00 128.64 2ozw n PRO 31 Ca 0.05 -0.01 -0.07 0.00 -2.02 0.00 0.00 63.50 61.45 2ozw n PRO 31 Cb 0.21 -1.44 -0.02 0.00 -0.02 0.00 0.00 33.50 32.23 2ozw n PRO 31 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2ozw n ARG 32 N 0.38 -1.45 -2.12 -0.52 1.85 -0.81 -0.86 116.66 113.13 2ozw n ARG 32 Ca 0.03 0.40 -0.10 0.00 -1.00 0.00 0.00 57.85 57.17 2ozw n ARG 32 Cb 0.54 -4.61 -0.02 0.00 -1.05 0.00 0.00 32.46 27.32 2ozw n ARG 32 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2ozw n SER 33 N -0.19 -3.20 0.00 2.89 7.64 -0.97 -4.54 113.62 115.25 2ozw n SER 33 Ca -0.07 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.06 2ozw n SER 33 Cb 0.30 -2.83 0.00 0.00 -1.01 0.00 0.00 64.21 60.66 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 -0.59 0.00 3.62 0.23 0.00 -0.60 -5.12 105.19 102.74 2ozw n GLY 34 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 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 0.28 0.20 4.61 0.00 -0.04 -4.93 120.51 120.63 2ozw n ALA 35 Ca 0.00 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.54 2ozw n ALA 35 Cb 0.00 -2.13 0.36 0.00 0.00 0.00 0.00 19.45 17.69 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 0.66 0.00 -7.25 0.00 0.13 -1.91 -3.44 132.00 120.18 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 1.36 0.00 0.13 0.00 0.13 0.00 0.00 31.00 32.62 2ozw h PRO 36 CO 0.52 0.33 0.33 0.00 -0.23 0.00 0.00 178.00 178.95 2ozw s ALA 37 N -3.61 2.20 -0.17 -0.56 0.00 -1.26 -4.99 121.76 113.35 2ozw s ALA 37 Ca 0.00 0.49 0.22 0.00 0.00 0.00 0.00 51.96 52.67 2ozw s ALA 37 Cb 0.11 -3.34 0.45 0.00 0.00 0.00 0.00 23.12 20.34 2ozw s ALA 37 CO 0.67 -1.76 1.16 0.00 0.00 0.00 0.00 175.76 175.84 2ozw n ALA 38 N -3.14 2.60 -1.93 0.00 0.00 -1.26 -4.76 120.51 112.01 2ozw n ALA 38 Ca 0.10 -2.37 -0.29 0.00 0.00 0.00 0.00 53.44 50.89 2ozw n ALA 38 Cb 0.52 -0.80 0.15 0.00 0.00 0.00 0.00 19.45 19.32 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 -2.08 1.07 0.06 0.00 0.41 -1.26 -4.84 118.70 112.06 2ozw s GLU 39 Ca 0.26 -0.40 -0.02 0.00 -0.41 0.00 0.00 54.97 54.40 2ozw s GLU 39 Cb 0.34 -1.94 -0.03 0.00 -1.78 0.00 0.00 34.13 30.72 2ozw s GLU 39 CO -0.09 -2.10 0.01 -1.12 -0.49 0.00 0.00 175.26 171.47 2ozw s SER 40 N -4.80 0.42 0.24 -0.19 0.01 -1.26 -1.54 113.70 106.57 2ozw s SER 40 Ca 0.70 -0.96 -0.11 0.00 1.31 0.00 0.00 55.95 56.90 2ozw s SER 40 Cb -0.06 0.23 -0.01 0.00 0.21 0.00 0.00 66.02 66.39 2ozw s SER 40 CO 0.51 -0.63 0.41 -0.75 0.41 0.00 0.00 173.24 173.19 2ozw s LYS 41 N -3.92 1.47 0.08 12.44 2.36 -0.06 -4.99 119.74 127.12 2ozw s LYS 41 Ca 0.08 -1.31 0.04 0.00 -2.55 0.00 0.00 55.97 52.22 2ozw s LYS 41 Cb 0.07 0.43 -0.03 0.00 -1.05 0.00 0.00 37.83 37.26 2ozw s LYS 41 CO -0.09 -0.59 -0.10 -1.21 1.55 0.00 0.00 175.35 174.90 2ozw s GLU 42 N -4.04 0.76 0.09 4.03 8.01 -1.26 -0.41 118.70 125.88 2ozw s GLU 42 Ca 0.25 -1.01 0.03 0.00 0.01 0.00 0.00 54.97 54.25 2ozw s GLU 42 Cb 0.01 -0.54 -0.04 0.00 -4.31 0.00 0.00 34.13 29.26 2ozw s GLU 42 CO 0.09 0.10 -0.09 0.96 0.01 0.00 0.00 175.26 176.33 2ozw s ILE 43 N -1.92 0.84 -0.19 -1.63 -4.36 0.16 -4.91 121.20 109.20 2ozw s ILE 43 Ca -0.00 -1.64 -0.01 0.00 -0.26 0.00 0.00 60.65 58.74 2ozw s ILE 43 Cb -0.06 -1.34 0.01 0.00 1.25 0.00 0.00 42.46 42.32 2ozw s ILE 43 CO 0.01 -0.61 -0.14 -0.69 0.24 0.00 0.00 174.94 173.75 2ozw s VAL 44 N -2.57 2.53 0.01 8.37 1.01 -0.75 -1.65 120.40 127.35 2ozw s VAL 44 Ca 0.05 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.31 2ozw s VAL 44 Cb -0.02 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 2ozw s VAL 44 CO -0.01 0.50 -0.16 -0.13 0.00 0.00 0.00 175.10 175.29 2ozw s ARG 45 N 1.35 1.23 -0.29 2.72 1.81 -1.06 -1.97 118.95 122.74 2ozw s ARG 45 Ca 0.05 -0.68 -0.25 0.00 -1.72 0.00 0.00 55.73 53.13 2ozw s ARG 45 Cb -0.13 -1.23 0.15 0.00 -0.45 0.00 0.00 34.95 33.29 2ozw s ARG 45 CO -0.09 0.33 1.21 0.20 -0.68 0.00 0.00 175.30 176.26 2ozw s GLY 46 N -0.69 0.07 0.08 -3.53 0.00 -1.22 -0.80 107.32 101.22 2ozw s GLY 46 Ca 0.05 3.06 -0.19 0.00 0.00 0.00 0.00 44.72 47.64 2ozw s GLY 46 CO 0.00 1.90 0.46 -0.19 0.00 0.00 0.00 173.10 175.26 2ozw s TYR 47 N 0.16 -0.32 0.33 1.90 2.02 -0.88 -3.95 117.35 116.60 2ozw s TYR 47 Ca 0.05 0.22 0.08 0.00 -0.37 0.00 0.00 57.07 57.04 2ozw s TYR 47 Cb -0.05 0.29 0.56 0.00 -0.40 0.00 0.00 41.96 42.37 2ozw s TYR 47 CO -0.10 -0.65 1.77 0.87 -1.57 0.00 0.00 175.55 175.86 2ozw h LYS 48 N 2.68 0.21 -0.07 -0.62 1.57 -1.87 -2.95 116.57 115.52 2ozw h LYS 48 Ca -0.32 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.35 2ozw h LYS 48 Cb 1.23 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 2ozw h LYS 48 CO 0.43 0.53 -0.08 0.11 -0.57 0.00 0.00 179.45 179.87 2ozw h TRP 49 N 0.18 0.11 -1.64 -1.35 5.08 -1.96 -3.02 115.95 113.34 2ozw h TRP 49 Ca 0.02 -0.01 -0.76 0.00 1.08 0.00 0.00 58.89 59.23 2ozw h TRP 49 Cb 0.69 -0.03 -0.17 0.00 -3.00 0.00 0.00 29.16 26.65 2ozw h TRP 49 CO 0.01 0.20 1.82 0.00 -1.28 0.00 0.00 178.44 179.18 2ozw n ALA 50 N -2.51 5.21 0.29 0.11 0.00 -1.11 -4.78 120.51 117.72 2ozw n ALA 50 Ca -0.02 -4.37 0.19 0.00 0.00 0.00 0.00 53.44 49.24 2ozw n ALA 50 Cb 0.20 -2.91 0.97 0.00 0.00 0.00 0.00 19.45 17.70 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 5.83 0.00 -6.09 0.00 4.57 -1.73 -3.41 114.58 113.75 2ozw h GLU 51 Ca 0.36 0.00 -0.57 0.00 -1.18 0.00 0.00 59.36 57.98 2ozw h GLU 51 Cb 0.65 0.00 -0.24 0.00 -0.16 0.00 0.00 28.75 29.00 2ozw h GLU 51 CO 1.56 0.00 -0.83 1.52 -1.18 0.00 0.00 179.01 180.07 2ozw s TYR 52 N -3.90 1.78 0.24 0.92 1.13 -1.26 -4.91 117.35 111.35 2ozw s TYR 52 Ca -0.03 -0.39 0.07 0.00 -1.41 0.00 0.00 57.07 55.31 2ozw s TYR 52 Cb 0.11 -1.03 0.24 0.00 -1.10 0.00 0.00 41.96 40.18 2ozw s TYR 52 CO 0.36 0.14 1.54 0.45 -2.51 0.00 0.00 175.55 175.53 2ozw h HIS 53 N 4.55 0.15 -0.63 -3.49 3.86 -1.94 -2.24 115.15 115.41 2ozw h HIS 53 Ca -0.44 -0.06 0.17 0.00 -1.16 0.00 0.00 60.37 58.88 2ozw h HIS 53 Cb 1.17 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 29.59 2ozw h HIS 53 CO 0.55 0.74 0.45 0.00 0.86 0.00 0.00 177.93 180.53 2ozw h ALA 54 N 1.24 2.48 -0.03 2.45 0.00 -1.97 -0.97 119.26 122.46 2ozw h ALA 54 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2ozw h ALA 54 Cb 1.19 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2ozw h ALA 54 CO 0.09 -0.66 -0.03 0.22 0.00 0.00 0.00 179.25 178.87 2ozw h ASP 55 N 0.08 0.09 -0.63 0.00 3.58 -1.76 -0.75 116.42 117.02 2ozw h ASP 55 Ca 0.30 -0.48 -0.09 0.00 0.42 0.00 0.00 57.03 57.18 2ozw h ASP 55 Cb 1.09 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 42.09 2ozw h ASP 55 CO -0.03 0.55 0.04 0.16 -2.88 0.00 0.00 179.24 177.09 2ozw h ILE 56 N -0.37 1.27 0.06 2.25 3.07 -1.61 -1.73 117.51 120.43 2ozw h ILE 56 Ca 0.01 -1.11 -0.00 0.00 1.55 0.00 0.00 64.86 65.31 2ozw h ILE 56 Cb 0.53 0.74 0.00 0.00 -0.27 0.00 0.00 36.82 37.81 2ozw h ILE 56 CO 0.01 0.41 -0.03 0.22 -1.05 0.00 0.00 178.15 177.71 2ozw h TYR 57 N 0.99 -0.07 -0.44 0.16 3.20 -1.10 0.36 116.97 120.08 2ozw h TYR 57 Ca 0.18 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 2ozw h TYR 57 Cb 0.51 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 2ozw h TYR 57 CO 0.04 -0.04 0.25 0.22 -1.64 0.00 0.00 178.16 176.99 2ozw h ASP 58 N -0.08 0.53 -0.08 -2.11 3.58 -1.06 0.97 116.42 118.18 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 0.06 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 40.97 2ozw h ASP 58 CO 0.01 0.44 0.05 0.50 -2.88 0.00 0.00 179.24 177.36 2ozw h LYS 59 N 0.57 0.12 0.18 0.28 3.64 -1.19 -2.03 116.57 118.14 2ozw h LYS 59 Ca 0.16 -0.01 -0.31 0.00 -1.27 0.00 0.00 60.65 59.21 2ozw h LYS 59 Cb 0.02 -0.02 0.03 0.00 -0.41 0.00 0.00 32.23 31.85 2ozw h LYS 59 CO -0.03 0.15 -1.35 0.28 -2.27 0.00 0.00 179.45 176.23 2ozw h VAL 60 N 0.05 1.30 -0.85 2.00 2.07 -0.70 -0.57 116.25 119.56 2ozw h VAL 60 Ca 0.03 -2.62 -0.01 0.00 0.82 0.00 0.00 66.70 64.92 2ozw h VAL 60 Cb 0.06 2.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.66 2ozw h VAL 60 CO -0.00 0.79 0.47 0.77 0.02 0.00 0.00 177.57 179.61 2ozw h SER 61 N 0.20 1.05 0.01 0.57 4.64 -0.88 0.55 113.55 119.70 2ozw h SER 61 Ca -0.21 -0.09 0.02 0.00 -0.47 0.00 0.00 61.79 61.04 2ozw h SER 61 Cb 2.03 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 63.83 2ozw h SER 61 CO 0.25 0.84 -0.11 1.23 -0.87 0.00 0.00 176.83 178.17 2ozw h GLY 62 N 1.20 -0.14 0.96 -0.77 0.00 -1.24 0.26 103.07 103.34 2ozw h GLY 62 Ca 0.30 0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.75 2ozw h GLY 62 CO -0.05 -0.12 0.18 -1.80 0.00 0.00 0.00 176.54 174.75 2ozw h ASP 63 N -0.20 0.42 -0.27 0.19 3.58 -0.51 0.64 116.42 120.28 2ozw h ASP 63 Ca 0.04 -0.09 0.01 0.00 0.42 0.00 0.00 57.03 57.40 2ozw h ASP 63 Cb 0.24 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 2ozw h ASP 63 CO -0.11 0.39 0.16 0.24 -2.88 0.00 0.00 179.24 177.05 2ozw h MET 64 N 0.41 0.32 -0.48 0.28 2.86 -0.81 -0.09 114.93 117.42 2ozw h MET 64 Ca 0.12 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 2ozw h MET 64 Cb 0.07 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2ozw h MET 64 CO -0.02 0.21 0.15 1.96 1.06 0.00 0.00 176.91 180.28 2ozw h GLN 65 N 0.33 0.71 -0.33 1.72 1.08 -0.71 0.57 115.11 118.47 2ozw h GLN 65 Ca 0.11 -0.12 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 2ozw h GLN 65 Cb -0.01 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.29 2ozw h GLN 65 CO -0.05 0.62 -0.15 0.87 -0.95 0.00 0.00 178.83 179.17 2ozw h LYS 66 N 0.70 0.60 0.00 1.46 1.57 -0.25 -1.57 116.57 119.07 2ozw h LYS 66 Ca 0.16 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2ozw h LYS 66 Cb 0.20 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2ozw h LYS 66 CO -0.01 0.73 0.00 1.96 -0.57 0.00 0.00 179.45 181.56 2ozw h GLN 67 N 0.54 0.00 0.00 3.15 4.20 -0.08 -3.40 115.11 119.52 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 0.58 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.36 2ozw h GLN 67 CO 0.04 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.61 2ozw n GLY 68 N 0.21 0.50 3.65 3.46 0.00 -0.21 -2.92 105.19 109.88 2ozw n GLY 68 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.06 2.45 0.15 0.00 2.15 -1.24 -3.34 116.67 113.78 2ozw s ASP 70 Ca 0.65 -0.63 -0.07 0.00 0.43 0.00 0.00 52.55 52.94 2ozw s ASP 70 Cb -0.21 -0.15 -0.02 0.00 -0.30 0.00 0.00 42.92 42.24 2ozw s ASP 70 CO 0.59 0.08 0.22 0.00 -0.17 0.00 0.00 175.17 175.89 2ozw s GLU 72 N -3.99 0.37 -0.31 0.00 2.56 -0.88 -5.00 118.70 111.44 2ozw s GLU 72 Ca 0.19 0.51 -0.29 0.00 0.00 0.00 0.00 54.97 55.38 2ozw s GLU 72 Cb 0.05 0.13 0.01 0.00 2.00 0.00 0.00 34.13 36.31 2ozw s GLU 72 CO 0.01 -0.07 1.20 0.00 -0.56 0.00 0.00 175.26 175.84 2ozw h LEU 74 N 10.54 0.00 0.00 0.00 3.38 -1.20 -3.48 115.31 124.55 2ozw h LEU 74 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2ozw h LEU 74 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2ozw h LEU 74 CO 1.04 0.18 0.00 0.61 0.09 0.00 0.00 178.44 180.35 2ozw n GLY 75 N -0.29 -0.99 3.48 0.83 0.00 -1.22 -4.49 105.19 102.53 2ozw n GLY 75 Ca -0.01 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.84 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 1.55 0.00 -0.02 0.00 -0.54 -1.62 107.32 106.69 2ozw s GLY 76 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.16 2ozw s GLY 76 CO 0.00 -1.02 0.00 0.61 0.00 0.00 0.00 173.10 172.69 2ozw n GLY 77 N -0.58 1.19 3.12 0.20 0.00 -0.72 -2.87 105.19 105.54 2ozw n GLY 77 Ca 0.01 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 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 1.22 0.70 -0.01 1.61 1.70 0.46 -0.99 118.95 123.64 2ozw s ARG 78 Ca 0.00 -1.17 0.05 0.00 -0.47 0.00 0.00 55.73 54.14 2ozw s ARG 78 Cb 0.00 -0.11 -0.03 0.00 -0.57 0.00 0.00 34.95 34.24 2ozw s ARG 78 CO 0.00 -0.03 -0.15 0.42 -1.08 0.00 0.00 175.30 174.46 2ozw s ILE 79 N -3.20 3.00 0.04 4.99 1.01 0.03 -1.52 121.20 125.55 2ozw s ILE 79 Ca 0.06 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 59.80 2ozw s ILE 79 Cb 0.02 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.25 2ozw s ILE 79 CO -0.05 0.47 -0.08 -0.44 0.00 0.00 0.00 174.94 174.84 2ozw s SER 80 N -1.09 0.84 0.00 3.58 0.01 -0.26 -1.23 113.70 115.55 2ozw s SER 80 Ca 0.13 -0.48 0.00 0.00 1.31 0.00 0.00 55.95 56.91 2ozw s SER 80 Cb -0.11 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.14 2ozw s SER 80 CO 0.03 -0.16 0.00 1.57 0.41 0.00 0.00 173.24 175.09 2ozw n HIS 81 N 1.68 0.00 0.13 2.43 -0.00 -0.12 -0.90 115.22 118.44 2ozw n HIS 81 Ca -0.21 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.46 2ozw n HIS 81 Cb 0.55 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.56 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 -1.02 1.23 -0.54 1.57 6.02 -1.07 -4.51 117.38 119.06 2ozw n GLN 82 Ca 0.00 -0.49 -0.20 0.00 -0.01 0.00 0.00 57.00 56.30 2ozw n GLN 82 Cb 0.03 -1.19 0.17 0.00 1.02 0.00 0.00 30.24 30.27 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 0.60 -2.23 0.31 1.08 7.64 -1.26 -4.90 113.62 114.85 2ozw n SER 83 Ca 0.10 -0.84 0.19 0.00 1.01 0.00 0.00 58.87 59.33 2ozw n SER 83 Cb 0.62 -0.66 1.04 0.00 -1.01 0.00 0.00 64.21 64.19 2ozw n SER 83 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2ozw h GLN 84 N 0.00 0.00 -4.20 1.43 5.75 -1.93 -3.41 115.11 112.75 2ozw h GLN 84 Ca -0.27 0.00 -0.16 0.00 -0.15 0.00 0.00 58.65 58.07 2ozw h GLN 84 Cb 0.85 0.00 -0.18 0.00 1.07 0.00 0.00 27.48 29.22 2ozw h GLN 84 CO 0.17 0.00 -0.69 0.34 -2.65 0.00 0.00 178.83 176.00 2ozw s ASP 85 N -5.21 0.48 0.49 -0.69 2.15 -1.26 -5.06 116.67 107.57 2ozw s ASP 85 Ca -0.05 -0.76 0.33 0.00 0.43 0.00 0.00 52.55 52.51 2ozw s ASP 85 Cb 0.13 0.14 1.61 0.00 -0.30 0.00 0.00 42.92 44.50 2ozw s ASP 85 CO 0.42 -0.43 2.00 0.11 -0.17 0.00 0.00 175.17 177.10 2ozw h LYS 86 N 3.85 0.00 -6.45 4.34 1.57 -1.79 -3.44 116.57 114.66 2ozw h LYS 86 Ca -0.33 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 57.85 2ozw h LYS 86 Cb 1.18 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.53 2ozw h LYS 86 CO 0.54 0.00 0.84 1.17 -0.57 0.00 0.00 179.45 181.43 2ozw n LYS 87 N -2.78 2.10 -1.97 3.15 4.81 -1.26 -4.89 118.16 117.32 2ozw n LYS 87 Ca -0.01 0.76 -0.36 0.00 -0.87 0.00 0.00 58.31 57.84 2ozw n LYS 87 Cb 0.16 -2.54 0.04 0.00 0.02 0.00 0.00 35.03 32.71 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 1.54 2.68 0.06 3.15 1.01 -0.37 -4.80 121.20 124.48 2ozw s ILE 88 Ca 0.82 0.41 0.01 0.00 0.00 0.00 0.00 60.65 61.89 2ozw s ILE 88 Cb -0.70 -3.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 2ozw s ILE 88 CO 0.41 -0.11 -0.06 -2.28 0.00 0.00 0.00 174.94 172.90 2ozw s HIS 89 N -1.69 0.70 -0.04 3.97 2.46 -0.08 -1.38 115.29 119.24 2ozw s HIS 89 Ca 0.76 -0.76 -0.01 0.00 0.47 0.00 0.00 55.06 55.53 2ozw s HIS 89 Cb -0.29 -0.43 0.03 0.00 -0.13 0.00 0.00 32.58 31.76 2ozw s HIS 89 CO 0.34 -0.16 0.01 0.08 -2.47 0.00 0.00 174.74 172.54 2ozw s VAL 90 N -2.69 0.20 0.24 0.89 1.01 -0.36 -1.10 120.40 118.59 2ozw s VAL 90 Ca 0.01 0.16 -0.15 0.00 0.00 0.00 0.00 61.98 61.99 2ozw s VAL 90 Cb -0.01 -0.34 0.06 0.00 0.00 0.00 0.00 36.38 36.09 2ozw s VAL 90 CO -0.03 0.19 0.77 0.00 0.00 0.00 0.00 175.10 176.03 2ozw n TYR 91 N 4.67 -1.67 -2.42 5.22 4.11 -0.58 -2.90 117.16 123.59 2ozw n TYR 91 Ca -0.16 -1.30 0.00 0.00 -0.00 0.00 0.00 57.90 56.44 2ozw n TYR 91 Cb 0.50 0.64 -0.00 0.00 -0.00 0.00 0.00 39.34 40.49 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 -2.15 3.41 -7.48 0.00 -1.26 -0.40 105.19 96.77 2ozw n GLY 92 Ca -0.04 -1.46 -0.14 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.42 -0.46 0.78 1.61 -0.85 -1.26 -4.56 117.35 112.20 2ozw s TYR 93 Ca 0.00 0.46 -0.11 0.00 -0.52 0.00 0.00 57.07 56.90 2ozw s TYR 93 Cb 0.00 0.39 0.06 0.00 0.38 0.00 0.00 41.96 42.79 2ozw s TYR 93 CO 0.00 -0.69 1.10 0.45 -1.52 0.00 0.00 175.55 174.89 2ozw s SER 94 N -2.12 4.66 -0.12 -0.18 0.15 -1.12 -4.73 113.70 110.23 2ozw s SER 94 Ca -0.04 1.28 0.10 0.00 0.70 0.00 0.00 55.95 57.99 2ozw s SER 94 Cb -0.00 -2.03 -0.14 0.00 -1.71 0.00 0.00 66.02 62.14 2ozw s SER 94 CO -0.04 -1.86 0.03 1.15 1.20 0.00 0.00 173.24 173.72 2ozw n MET 95 N -3.36 2.02 0.17 5.44 0.00 -1.26 -2.68 117.12 117.45 2ozw n MET 95 Ca 0.07 -0.00 0.04 0.00 0.00 0.00 0.00 57.70 57.81 2ozw n MET 95 Cb 0.56 -1.30 0.26 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 0.54 0.90 0.00 3.17 0.00 -2.03 -3.38 119.26 118.48 2ozw h ALA 96 Ca -0.32 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.21 2ozw h ALA 96 Cb 1.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.43 2ozw h ALA 96 CO 0.01 0.53 0.00 0.66 0.00 0.00 0.00 179.25 180.46 2ozw n TYR 97 N -3.46 0.00 -1.35 0.00 4.01 -1.26 -5.15 117.16 109.94 2ozw n TYR 97 Ca 0.00 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.76 2ozw n TYR 97 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.60 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 0.30 -2.13 3.75 2.72 0.00 -1.09 -4.32 105.19 104.41 2ozw n GLY 98 Ca 0.00 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.85 4.32 0.85 1.61 0.04 -1.26 -1.47 135.00 138.24 2ozw s PRO 99 Ca 0.00 2.20 -0.12 0.00 0.04 0.00 0.00 61.00 63.12 2ozw s PRO 99 Cb 0.00 -3.13 0.10 0.00 0.04 0.00 0.00 34.50 31.51 2ozw s PRO 99 CO 0.00 -0.32 1.13 0.00 0.04 0.00 0.00 177.00 177.85 2ozw s ALA 100 N -0.16 2.13 -1.21 8.56 0.00 -1.14 -4.52 121.76 125.41 2ozw s ALA 100 Ca 0.57 -0.43 -0.20 0.00 0.00 0.00 0.00 51.96 51.90 2ozw s ALA 100 Cb -0.40 -3.05 0.05 0.00 0.00 0.00 0.00 23.12 19.73 2ozw s ALA 100 CO 0.43 -1.94 1.69 -0.65 0.00 0.00 0.00 175.76 175.29 2ozw s GLN 101 N -5.29 3.74 0.34 0.00 -1.52 -1.26 -4.82 119.66 110.86 2ozw s GLN 101 Ca 0.62 -1.68 0.20 0.00 -1.95 0.00 0.00 55.36 52.55 2ozw s GLN 101 Cb -0.14 -5.46 1.10 0.00 -0.22 0.00 0.00 33.01 28.29 2ozw s GLN 101 CO 0.53 -2.41 1.59 0.45 -0.25 0.00 0.00 175.29 175.19 2ozw h HIS 102 N 8.36 0.00 -0.68 0.91 3.86 -1.97 -0.03 115.15 125.60 2ozw h HIS 102 Ca 0.36 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.64 2ozw h HIS 102 Cb 0.91 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.33 2ozw h HIS 102 CO 1.37 0.00 0.37 0.00 0.86 0.00 0.00 177.93 180.54 2ozw h ALA 103 N 1.76 0.91 -0.21 2.45 0.00 -1.99 -0.72 119.26 121.46 2ozw h ALA 103 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2ozw h ALA 103 Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2ozw h ALA 103 CO 0.00 0.04 0.05 0.82 0.00 0.00 0.00 179.25 180.16 2ozw h ILE 104 N 0.68 1.21 -0.02 0.00 2.04 -1.41 -2.85 117.51 117.16 2ozw h ILE 104 Ca 0.31 -0.67 0.02 0.00 1.00 0.00 0.00 64.86 65.52 2ozw h ILE 104 Cb 0.20 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 2ozw h ILE 104 CO -0.19 0.21 -0.07 0.28 0.00 0.00 0.00 178.15 178.38 2ozw h SER 105 N 0.15 -0.21 -0.21 1.72 0.02 -1.50 -1.75 113.55 111.77 2ozw h SER 105 Ca 0.06 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2ozw h SER 105 Cb 0.27 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2ozw h SER 105 CO 0.00 -0.10 0.04 0.71 -1.14 0.00 0.00 176.83 176.34 2ozw h THR 106 N -0.12 1.22 -0.99 -2.27 1.35 -1.17 0.45 112.91 111.39 2ozw h THR 106 Ca 0.04 -0.73 0.01 0.00 -0.55 0.00 0.00 66.41 65.18 2ozw h THR 106 Cb 0.16 1.30 -0.05 0.00 -1.73 0.00 0.00 68.15 67.83 2ozw h THR 106 CO -0.09 0.23 0.65 -0.33 -0.25 0.00 0.00 175.52 175.73 2ozw h GLU 107 N 0.15 1.30 -0.15 4.72 4.39 -1.39 0.11 114.58 123.70 2ozw h GLU 107 Ca 0.06 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 2ozw h GLU 107 Cb 0.31 -0.29 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2ozw h GLU 107 CO 0.00 0.86 -0.00 0.87 -1.16 0.00 0.00 179.01 179.58 2ozw h LYS 108 N 1.34 0.27 -0.69 2.33 1.57 -1.05 -1.72 116.57 118.63 2ozw h LYS 108 Ca 0.36 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.98 2ozw h LYS 108 Cb -0.15 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 2ozw h LYS 108 CO -0.08 0.50 0.15 0.82 -0.57 0.00 0.00 179.45 180.27 2ozw h ILE 109 N 0.00 1.26 -0.31 1.86 2.04 -0.41 0.19 117.51 122.15 2ozw h ILE 109 Ca 0.04 -1.00 0.02 0.00 1.00 0.00 0.00 64.86 64.93 2ozw h ILE 109 Cb 0.39 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2ozw h ILE 109 CO 0.01 0.38 0.15 0.11 0.00 0.00 0.00 178.15 178.80 2ozw h LYS 110 N 1.04 0.31 -0.76 2.37 1.57 -0.79 -0.89 116.57 119.43 2ozw h LYS 110 Ca 0.21 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 2ozw h LYS 110 Cb 0.40 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 2ozw h LYS 110 CO 0.01 0.20 0.29 0.00 -0.57 0.00 0.00 179.45 179.38 2ozw h ALA 111 N 1.16 1.08 -0.38 3.86 0.00 -0.79 -2.56 119.26 121.63 2ozw h ALA 111 Ca 0.13 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2ozw h ALA 111 Cb 0.04 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2ozw h ALA 111 CO -0.09 0.65 -0.13 -0.22 0.00 0.00 0.00 179.25 179.46 2ozw h LYS 112 N 1.10 0.68 -2.10 0.00 1.63 -0.63 -3.38 116.57 113.88 2ozw h LYS 112 Ca 0.25 -0.22 -0.58 0.00 -0.85 0.00 0.00 60.65 59.25 2ozw h LYS 112 Cb 0.23 -0.06 -0.40 0.00 -0.60 0.00 0.00 32.23 31.39 2ozw h LYS 112 CO -0.02 0.78 -0.86 0.66 -3.45 0.00 0.00 179.45 176.57 2ozw n TYR 113 N -4.17 1.62 0.29 1.91 4.01 -0.37 -4.95 117.16 115.51 2ozw n TYR 113 Ca 0.01 -3.86 0.19 0.00 -0.16 0.00 0.00 57.90 54.08 2ozw n TYR 113 Cb 0.36 -0.45 0.97 0.00 -0.31 0.00 0.00 39.34 39.91 2ozw n TYR 113 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2ozw h PRO 114 N 4.03 0.00 0.00 -0.72 0.11 -1.66 -1.27 132.00 132.49 2ozw h PRO 114 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2ozw h PRO 114 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2ozw h PRO 114 CO 0.65 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.97 2ozw n ASP 115 N -3.28 0.00 -4.21 -2.05 2.03 -1.26 -4.78 116.55 103.00 2ozw n ASP 115 Ca -0.01 0.32 -0.27 0.00 0.52 0.00 0.00 54.79 55.35 2ozw n ASP 115 Cb 0.25 -0.41 -0.08 0.00 -0.72 0.00 0.00 41.12 40.16 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 -2.82 1.80 0.10 -0.67 1.51 -0.48 -5.18 117.35 111.61 2ozw s TYR 116 Ca 0.09 -1.24 0.02 0.00 -1.01 0.00 0.00 57.07 54.94 2ozw s TYR 116 Cb 0.09 -1.23 -0.04 0.00 -0.11 0.00 0.00 41.96 40.67 2ozw s TYR 116 CO 0.23 -0.22 -0.07 -2.00 -1.11 0.00 0.00 175.55 172.38 2ozw s GLU 117 N -3.73 0.82 0.00 -0.62 2.12 -1.26 -4.95 118.70 111.09 2ozw s GLU 117 Ca 0.20 -1.27 0.00 0.00 0.36 0.00 0.00 54.97 54.27 2ozw s GLU 117 Cb 0.02 -0.27 -0.00 0.00 0.26 0.00 0.00 34.13 34.13 2ozw s GLU 117 CO 0.13 0.00 -0.01 0.08 -0.54 0.00 0.00 175.26 174.92 2ozw s VAL 118 N -3.26 0.09 0.28 3.70 1.01 -1.26 -1.24 120.40 119.72 2ozw s VAL 118 Ca 0.09 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.86 2ozw s VAL 118 Cb 0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 36.38 36.24 2ozw s VAL 118 CO -0.03 -0.09 0.12 0.42 0.00 0.00 0.00 175.10 175.51 2ozw s THR 119 N -0.33 0.50 0.12 3.92 -4.23 -0.48 -4.96 115.64 110.19 2ozw s THR 119 Ca -0.03 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.43 2ozw s THR 119 Cb -0.02 -2.59 -0.02 0.00 1.34 0.00 0.00 72.50 71.20 2ozw s THR 119 CO -0.00 0.00 0.14 -1.66 -0.54 0.00 0.00 174.62 172.56 2ozw s TRP 120 N -3.68 0.51 -0.15 3.99 1.48 -1.26 -1.22 118.94 118.61 2ozw s TRP 120 Ca 0.37 -0.92 -0.09 0.00 -1.06 0.00 0.00 56.10 54.39 2ozw s TRP 120 Cb 0.07 -0.24 0.05 0.00 -1.16 0.00 0.00 33.47 32.19 2ozw s TRP 120 CO 0.15 -0.56 0.37 0.00 -4.06 0.00 0.00 176.95 172.84 2ozw s ALA 121 N -3.96 -0.92 -1.19 2.67 0.00 -1.14 -4.96 121.76 112.26 2ozw s ALA 121 Ca 0.15 1.33 0.26 0.00 0.00 0.00 0.00 51.96 53.70 2ozw s ALA 121 Cb 0.06 -0.81 1.21 0.00 0.00 0.00 0.00 23.12 23.58 2ozw s ALA 121 CO -0.03 -0.23 1.87 -1.71 0.00 0.00 0.00 175.76 175.65 2ozw n ASN 122 N 4.01 0.00 0.25 0.00 4.05 -1.26 -3.77 115.26 118.54 2ozw n ASN 122 Ca -0.22 0.24 0.09 0.00 0.45 0.00 0.00 54.58 55.14 2ozw n ASN 122 Cb 0.55 -0.41 0.63 0.00 1.23 0.00 0.00 39.78 41.78 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 -4.26 1.20 3.58 -1.96 -3.45 116.42 111.52 2ozw h ASP 123 Ca 0.00 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.93 2ozw h ASP 123 Cb 0.36 0.00 0.20 0.00 1.72 0.00 0.00 39.33 41.61 2ozw h ASP 123 CO 0.00 0.13 0.23 -0.83 -2.88 0.00 0.00 179.24 175.89 2ozw s GLY 124 N -4.17 1.74 0.00 -0.78 0.00 -1.25 -4.96 107.32 97.90 2ozw s GLY 124 Ca -0.04 0.63 0.00 0.00 0.00 0.00 0.00 44.72 45.31 2ozw s GLY 124 CO 0.64 1.05 0.00 1.58 0.00 0.00 0.00 173.10 176.38