#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ozw n ALA 2 N 0.00 0.22 -2.87 3.04 0.00 -0.26 -4.98 120.51 115.66 2ozw n ALA 2 Ca 0.00 -0.79 -0.10 0.00 0.00 0.00 0.00 53.44 52.55 2ozw n ALA 2 Cb 0.00 0.64 -0.09 0.00 0.00 0.00 0.00 19.45 20.00 2ozw n ALA 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ozw s VAL 3 N -2.57 0.11 0.00 0.00 0.11 -1.26 -3.17 120.40 113.62 2ozw s VAL 3 Ca 0.16 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 2ozw s VAL 3 Cb 0.01 -0.82 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 2ozw s VAL 3 CO 0.11 -0.50 0.00 0.00 -3.33 0.00 0.00 175.10 171.38 2ozw n ALA 4 N 0.85 0.00 -2.95 1.54 0.00 -1.26 -4.97 120.51 113.71 2ozw n ALA 4 Ca -0.20 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.14 2ozw n ALA 4 Cb 0.58 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.94 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 1.15 0.02 0.38 0.00 2.15 -1.26 -4.77 116.67 114.34 2ozw s ASP 5 Ca 0.00 -0.29 0.13 0.00 0.43 0.00 0.00 52.55 52.81 2ozw s ASP 5 Cb 0.00 0.26 0.94 0.00 -0.30 0.00 0.00 42.92 43.82 2ozw s ASP 5 CO 0.00 -0.49 1.86 -0.07 -0.17 0.00 0.00 175.17 176.30 2ozw h LEU 6 N 3.73 0.54 -1.91 -1.34 3.38 -1.96 -0.33 115.31 117.42 2ozw h LEU 6 Ca -0.32 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 2ozw h LEU 6 Cb 1.19 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 2ozw h LEU 6 CO 0.46 0.25 -0.12 0.00 0.09 0.00 0.00 178.44 179.11 2ozw h ALA 7 N 1.61 1.37 0.00 1.53 0.00 -2.01 -2.73 119.26 119.03 2ozw h ALA 7 Ca 0.46 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 2ozw h ALA 7 Cb 0.91 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2ozw h ALA 7 CO -0.20 0.15 -0.57 -0.07 0.00 0.00 0.00 179.25 178.56 2ozw h LEU 8 N 0.00 0.00 -9.63 0.00 3.38 -1.47 -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 0.31 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.10 2ozw h LEU 8 CO 0.02 0.22 0.78 -0.63 0.09 0.00 0.00 178.44 178.92 2ozw s ILE 9 N -3.13 2.89 0.07 1.22 1.01 -1.03 -4.94 121.20 117.28 2ozw s ILE 9 Ca 0.03 0.67 -0.36 0.00 0.00 0.00 0.00 60.65 60.99 2ozw s ILE 9 Cb 0.07 -3.43 -0.16 0.00 0.01 0.00 0.00 42.46 38.96 2ozw s ILE 9 CO 0.74 0.07 1.46 -2.65 0.00 0.00 0.00 174.94 174.55 2ozw n PRO 10 N 3.42 1.46 0.00 2.79 -0.02 -1.26 -4.90 135.00 136.49 2ozw n PRO 10 Ca 0.11 0.53 -0.18 0.00 -2.02 0.00 0.00 63.50 61.93 2ozw n PRO 10 Cb 0.40 -2.22 -0.09 0.00 -0.02 0.00 0.00 33.50 31.58 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 5.30 0.78 -3.47 2.55 3.58 -1.93 -3.44 116.42 119.79 2ozw h ASP 11 Ca -0.47 -0.69 -0.37 0.00 0.42 0.00 0.00 57.03 55.92 2ozw h ASP 11 Cb 1.31 -0.23 -0.34 0.00 1.72 0.00 0.00 39.33 41.78 2ozw h ASP 11 CO 0.83 1.36 -0.76 -0.69 -2.88 0.00 0.00 179.24 177.10 2ozw s VAL 12 N -3.50 0.33 -0.24 2.25 1.01 -1.26 -2.18 120.40 116.82 2ozw s VAL 12 Ca -0.11 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 2ozw s VAL 12 Cb 0.06 -0.40 0.13 0.00 0.00 0.00 0.00 36.38 36.17 2ozw s VAL 12 CO 0.88 0.18 0.40 -0.62 0.00 0.00 0.00 175.10 175.94 2ozw s ASP 13 N 1.03 0.02 0.07 3.32 2.15 -0.90 -5.01 116.67 117.35 2ozw s ASP 13 Ca -0.10 0.43 -0.10 0.00 0.43 0.00 0.00 52.55 53.21 2ozw s ASP 13 Cb -0.14 1.24 0.01 0.00 -0.30 0.00 0.00 42.92 43.73 2ozw s ASP 13 CO -0.01 -0.28 0.22 0.27 -0.17 0.00 0.00 175.17 175.20 2ozw s ILE 14 N 2.58 0.12 0.09 4.11 -4.36 -1.26 -3.58 121.20 118.90 2ozw s ILE 14 Ca 0.11 -0.99 -0.24 0.00 -0.26 0.00 0.00 60.65 59.27 2ozw s ILE 14 Cb -0.15 -1.16 -0.14 0.00 1.25 0.00 0.00 42.46 42.27 2ozw s ILE 14 CO -0.16 -0.55 1.71 -0.78 0.24 0.00 0.00 174.94 175.41 2ozw h ASP 15 N 2.96 -0.17 -7.03 4.36 3.58 -1.76 -3.47 116.42 114.89 2ozw h ASP 15 Ca -0.33 0.02 -0.60 0.00 0.42 0.00 0.00 57.03 56.53 2ozw h ASP 15 Cb 1.20 0.06 -0.28 0.00 1.72 0.00 0.00 39.33 42.03 2ozw h ASP 15 CO 0.52 -0.10 -0.91 -1.20 -2.88 0.00 0.00 179.24 174.67 2ozw n SER 16 N -5.17 -1.17 -0.04 2.28 7.64 -1.26 -4.82 113.62 111.07 2ozw n SER 16 Ca -0.07 -1.19 0.00 0.00 1.01 0.00 0.00 58.87 58.62 2ozw n SER 16 Cb 0.10 -1.94 0.01 0.00 -1.01 0.00 0.00 64.21 61.37 2ozw n SER 16 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2ozw n ASP 17 N -2.67 0.82 0.00 6.43 2.03 -1.26 -5.12 116.55 116.78 2ozw n ASP 17 Ca -0.05 -1.53 0.00 0.00 0.52 0.00 0.00 54.79 53.73 2ozw n ASP 17 Cb 0.55 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 2ozw n ASP 17 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ozw n GLY 18 N -0.25 -0.67 3.76 0.27 0.00 -1.26 -5.12 105.19 101.93 2ozw n GLY 18 Ca 0.01 -0.90 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 2ozw n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ozw s VAL 19 N -3.00 3.20 0.17 1.61 1.01 -1.26 -4.50 120.40 117.63 2ozw s VAL 19 Ca 0.00 1.18 -0.24 0.00 0.00 0.00 0.00 61.98 62.92 2ozw s VAL 19 Cb 0.00 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.70 2ozw s VAL 19 CO 0.00 0.25 0.83 0.72 0.00 0.00 0.00 175.10 176.91 2ozw s PHE 20 N -1.20 -0.23 0.10 5.22 -0.71 -0.92 -4.80 117.98 115.44 2ozw s PHE 20 Ca 0.48 -0.09 0.00 0.00 -1.04 0.00 0.00 56.93 56.28 2ozw s PHE 20 Cb -0.34 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.07 2ozw s PHE 20 CO 0.44 -0.92 0.25 0.15 -1.34 0.00 0.00 175.22 173.80 2ozw s LYS 21 N -3.51 3.45 0.11 1.99 1.02 -1.26 -1.25 119.74 120.28 2ozw s LYS 21 Ca 0.10 -0.47 -0.04 0.00 0.02 0.00 0.00 55.97 55.58 2ozw s LYS 21 Cb -0.03 -3.00 -0.03 0.00 -0.52 0.00 0.00 37.83 34.26 2ozw s LYS 21 CO 0.00 0.57 0.10 1.52 -0.92 0.00 0.00 175.35 176.62 2ozw s TYR 22 N -1.60 0.53 0.09 3.18 1.13 -0.09 -2.36 117.35 118.23 2ozw s TYR 22 Ca 0.35 -0.97 0.03 0.00 -1.41 0.00 0.00 57.07 55.08 2ozw s TYR 22 Cb -0.12 -0.29 -0.04 0.00 -1.10 0.00 0.00 41.96 40.42 2ozw s TYR 22 CO 0.28 -0.53 -0.10 0.14 -2.51 0.00 0.00 175.55 172.84 2ozw s VAL 23 N -3.96 0.87 -0.28 -3.49 -7.23 0.12 -1.19 120.40 105.24 2ozw s VAL 23 Ca 0.14 -1.61 -0.07 0.00 -1.81 0.00 0.00 61.98 58.63 2ozw s VAL 23 Cb 0.06 -1.32 -0.01 0.00 0.56 0.00 0.00 36.38 35.68 2ozw s VAL 23 CO -0.04 -0.57 0.09 -0.22 -0.31 0.00 0.00 175.10 174.04 2ozw s LEU 24 N -2.42 3.74 -0.22 1.32 1.98 -0.82 -2.59 118.68 119.69 2ozw s LEU 24 Ca 0.04 -0.51 0.02 0.00 -2.89 0.00 0.00 54.13 50.80 2ozw s LEU 24 Cb -0.03 -1.91 0.04 0.00 0.66 0.00 0.00 46.19 44.95 2ozw s LEU 24 CO -0.00 -0.14 -0.15 -0.63 -1.89 0.00 0.00 176.35 173.54 2ozw s ILE 25 N 1.56 2.03 0.35 6.68 1.01 -0.62 -0.47 121.20 131.75 2ozw s ILE 25 Ca 0.04 -1.23 -0.27 0.00 0.00 0.00 0.00 60.65 59.20 2ozw s ILE 25 Cb -0.16 -2.00 -0.09 0.00 0.01 0.00 0.00 42.46 40.21 2ozw s ILE 25 CO 0.03 0.25 1.12 -0.60 0.00 0.00 0.00 174.94 175.75 2ozw s ARG 26 N 1.23 4.31 0.02 2.79 3.52 0.30 -0.78 118.95 130.33 2ozw s ARG 26 Ca -0.02 1.77 0.01 0.00 -0.13 0.00 0.00 55.73 57.36 2ozw s ARG 26 Cb -0.16 -2.85 -0.02 0.00 -1.56 0.00 0.00 34.95 30.36 2ozw s ARG 26 CO -0.09 -0.08 -0.04 0.54 -0.81 0.00 0.00 175.30 174.83 2ozw s VAL 27 N -1.37 0.21 0.06 7.11 0.11 0.36 -1.42 120.40 125.46 2ozw s VAL 27 Ca 0.52 -0.69 0.06 0.00 -2.93 0.00 0.00 61.98 58.95 2ozw s VAL 27 Cb -0.30 -0.29 -0.03 0.00 -1.53 0.00 0.00 36.38 34.24 2ozw s VAL 27 CO 0.38 -0.31 -0.17 -1.00 -3.33 0.00 0.00 175.10 170.67 2ozw s HIS 28 N -1.00 1.48 -0.51 1.54 0.09 0.12 -0.70 115.29 116.31 2ozw s HIS 28 Ca -0.10 -0.38 -0.26 0.00 -0.00 0.00 0.00 55.06 54.32 2ozw s HIS 28 Cb -0.07 -0.86 -0.06 0.00 -0.00 0.00 0.00 32.58 31.59 2ozw s HIS 28 CO -0.00 0.08 2.30 -1.12 -0.00 0.00 0.00 174.74 176.00 2ozw s SER 29 N -1.36 4.60 0.00 1.40 0.01 -0.21 -3.32 113.70 114.82 2ozw s SER 29 Ca 0.03 0.96 0.05 0.00 1.31 0.00 0.00 55.95 58.30 2ozw s SER 29 Cb -0.09 -2.51 0.09 0.00 0.21 0.00 0.00 66.02 63.73 2ozw s SER 29 CO 0.02 -2.78 0.95 0.00 0.41 0.00 0.00 173.24 171.84 2ozw n ALA 30 N 15.28 2.20 -1.36 1.44 0.00 -1.26 -4.52 120.51 132.29 2ozw n ALA 30 Ca 0.34 -1.08 -0.38 0.00 0.00 0.00 0.00 53.44 52.32 2ozw n ALA 30 Cb 0.54 -0.45 0.03 0.00 0.00 0.00 0.00 19.45 19.58 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 0.10 0.32 -0.92 0.00 -0.02 -1.26 -1.11 135.00 132.11 2ozw n PRO 31 Ca -0.01 0.13 -0.05 0.00 -2.02 0.00 0.00 63.50 61.55 2ozw n PRO 31 Cb 0.76 -1.49 -0.02 0.00 -0.02 0.00 0.00 33.50 32.73 2ozw n PRO 31 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2ozw n ARG 32 N 0.41 -1.70 -2.63 -0.52 0.00 0.02 -0.91 116.66 111.34 2ozw n ARG 32 Ca 0.10 0.48 -0.16 0.00 -0.00 0.00 0.00 57.85 58.27 2ozw n ARG 32 Cb 0.48 -4.40 -0.00 0.00 0.00 0.00 0.00 32.46 28.54 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 0.18 -4.47 0.00 6.15 7.64 -0.27 -4.74 113.62 118.11 2ozw n SER 33 Ca -0.05 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.85 2ozw n SER 33 Cb 0.34 -3.74 0.00 0.00 -1.01 0.00 0.00 64.21 59.80 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 -0.97 0.80 3.72 0.23 0.00 -0.48 -5.11 105.19 103.37 2ozw n GLY 34 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2ozw n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ozw n ALA 35 N 0.00 1.49 0.22 4.61 0.00 -0.08 -4.93 120.51 121.81 2ozw n ALA 35 Ca 0.00 0.28 0.12 0.00 0.00 0.00 0.00 53.44 53.84 2ozw n ALA 35 Cb 0.22 -2.30 0.20 0.00 0.00 0.00 0.00 19.45 17.57 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 2.24 0.00 -7.28 0.00 0.13 -1.93 -3.45 132.00 121.71 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 1.29 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.58 2ozw h PRO 36 CO 0.61 0.03 0.28 0.00 -0.23 0.00 0.00 178.00 178.69 2ozw s ALA 37 N -3.23 1.88 -0.00 -0.56 0.00 -1.26 -5.00 121.76 113.59 2ozw s ALA 37 Ca 0.06 0.46 0.22 0.00 0.00 0.00 0.00 51.96 52.70 2ozw s ALA 37 Cb 0.05 -3.37 0.36 0.00 0.00 0.00 0.00 23.12 20.16 2ozw s ALA 37 CO 0.67 -2.23 1.14 0.00 0.00 0.00 0.00 175.76 175.33 2ozw n ALA 38 N -3.79 2.60 -1.63 0.00 0.00 -1.26 -4.65 120.51 111.79 2ozw n ALA 38 Ca 0.11 -2.07 -0.30 0.00 0.00 0.00 0.00 53.44 51.18 2ozw n ALA 38 Cb 0.52 -0.67 0.19 0.00 0.00 0.00 0.00 19.45 19.49 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 -0.01 0.27 0.07 0.00 0.41 -1.26 -4.82 118.70 113.35 2ozw s GLU 39 Ca 0.28 -0.18 -0.05 0.00 -0.41 0.00 0.00 54.97 54.62 2ozw s GLU 39 Cb 0.32 -1.78 -0.02 0.00 -1.78 0.00 0.00 34.13 30.87 2ozw s GLU 39 CO -0.14 -2.70 0.07 -1.12 -0.49 0.00 0.00 175.26 170.88 2ozw s SER 40 N -4.46 0.32 0.18 -0.19 0.01 -1.26 -1.04 113.70 107.25 2ozw s SER 40 Ca 0.71 -0.83 -0.11 0.00 1.31 0.00 0.00 55.95 57.02 2ozw s SER 40 Cb -0.08 0.26 -0.00 0.00 0.21 0.00 0.00 66.02 66.42 2ozw s SER 40 CO 0.54 -0.66 0.35 -0.75 0.41 0.00 0.00 173.24 173.13 2ozw s LYS 41 N -3.88 1.24 -0.09 12.44 2.20 0.12 -4.99 119.74 126.78 2ozw s LYS 41 Ca 0.06 -1.12 0.03 0.00 -0.36 0.00 0.00 55.97 54.58 2ozw s LYS 41 Cb 0.06 0.41 0.01 0.00 -1.51 0.00 0.00 37.83 36.81 2ozw s LYS 41 CO -0.10 -0.48 -0.17 -1.21 -0.36 0.00 0.00 175.35 173.03 2ozw s GLU 42 N -3.95 2.28 0.18 4.03 8.01 -1.26 -0.48 118.70 127.49 2ozw s GLU 42 Ca 0.16 -0.60 0.07 0.00 0.01 0.00 0.00 54.97 54.60 2ozw s GLU 42 Cb 0.02 -1.84 -0.04 0.00 -4.31 0.00 0.00 34.13 27.97 2ozw s GLU 42 CO 0.00 0.04 0.05 0.96 0.01 0.00 0.00 175.26 176.33 2ozw s ILE 43 N 0.68 4.01 -0.22 -1.63 -4.36 0.04 -4.97 121.20 114.75 2ozw s ILE 43 Ca -0.13 -1.31 0.02 0.00 -0.26 0.00 0.00 60.65 58.96 2ozw s ILE 43 Cb -0.16 -3.04 0.04 0.00 1.25 0.00 0.00 42.46 40.55 2ozw s ILE 43 CO 0.03 -0.13 -0.14 -0.69 0.24 0.00 0.00 174.94 174.26 2ozw s VAL 44 N -1.77 2.22 0.05 8.37 1.01 -0.93 -1.59 120.40 127.77 2ozw s VAL 44 Ca 0.29 -1.26 0.06 0.00 0.00 0.00 0.00 61.98 61.07 2ozw s VAL 44 Cb -0.09 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 2ozw s VAL 44 CO 0.21 0.24 -0.16 -0.13 0.00 0.00 0.00 175.10 175.25 2ozw s ARG 45 N 1.21 1.03 0.00 2.72 1.81 -1.07 -2.11 118.95 122.54 2ozw s ARG 45 Ca -0.02 -0.88 0.00 0.00 -1.72 0.00 0.00 55.73 53.11 2ozw s ARG 45 Cb -0.17 -1.10 0.00 0.00 -0.45 0.00 0.00 34.95 33.24 2ozw s ARG 45 CO -0.08 0.27 0.00 0.41 -0.68 0.00 0.00 175.30 175.21 2ozw n GLY 46 N 1.68 1.83 3.33 -3.53 0.00 -1.23 -0.70 105.19 106.55 2ozw n GLY 46 Ca -0.19 0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.76 -0.28 0.41 1.61 2.02 -0.99 -1.86 117.35 117.50 2ozw s TYR 47 Ca 0.00 0.28 0.11 0.00 -0.37 0.00 0.00 57.07 57.09 2ozw s TYR 47 Cb 0.00 0.22 0.93 0.00 -0.40 0.00 0.00 41.96 42.72 2ozw s TYR 47 CO 0.00 -0.56 1.98 0.87 -1.57 0.00 0.00 175.55 176.27 2ozw h LYS 48 N 3.07 0.50 0.00 -0.62 1.57 -1.87 -1.80 116.57 117.42 2ozw h LYS 48 Ca -0.31 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.40 2ozw h LYS 48 Cb 1.20 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 2ozw h LYS 48 CO 0.43 0.33 -0.20 0.11 -0.57 0.00 0.00 179.45 179.55 2ozw h TRP 49 N 0.52 0.00 -1.31 -1.35 5.08 -1.96 -3.28 115.95 113.65 2ozw h TRP 49 Ca 0.28 0.00 -0.74 0.00 1.08 0.00 0.00 58.89 59.51 2ozw h TRP 49 Cb 0.42 0.00 -0.14 0.00 -3.00 0.00 0.00 29.16 26.44 2ozw h TRP 49 CO -0.00 0.20 2.05 0.00 -1.28 0.00 0.00 178.44 179.41 2ozw n ALA 50 N -2.38 4.90 0.59 0.11 0.00 -0.68 -4.76 120.51 118.30 2ozw n ALA 50 Ca -0.02 -4.20 0.06 0.00 0.00 0.00 0.00 53.44 49.28 2ozw n ALA 50 Cb 0.29 -3.13 0.31 0.00 0.00 0.00 0.00 19.45 16.92 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 4.98 0.20 -4.00 0.00 4.07 -1.24 -4.40 120.64 120.25 2ozw n GLU 51 Ca 0.42 0.15 -0.11 0.00 -0.06 0.00 0.00 57.16 57.56 2ozw n GLU 51 Cb 0.39 -1.50 -0.12 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 -2.50 0.35 0.22 4.31 1.13 -1.26 -5.01 117.35 114.58 2ozw s TYR 52 Ca 0.12 -0.42 0.06 0.00 -1.41 0.00 0.00 57.07 55.43 2ozw s TYR 52 Cb 0.08 -0.23 0.18 0.00 -1.10 0.00 0.00 41.96 40.89 2ozw s TYR 52 CO 0.18 -0.12 1.51 0.45 -2.51 0.00 0.00 175.55 175.05 2ozw h HIS 53 N 4.91 0.16 -0.46 -3.49 3.86 -1.94 -2.09 115.15 116.09 2ozw h HIS 53 Ca -0.32 -0.07 0.13 0.00 -1.16 0.00 0.00 60.37 58.95 2ozw h HIS 53 Cb 1.21 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.63 2ozw h HIS 53 CO 0.61 0.79 0.36 0.00 0.86 0.00 0.00 177.93 180.55 2ozw h ALA 54 N 1.19 2.34 -0.04 2.45 0.00 -1.97 -1.83 119.26 121.40 2ozw h ALA 54 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2ozw h ALA 54 Cb 1.26 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2ozw h ALA 54 CO 0.10 -0.60 -0.01 0.22 0.00 0.00 0.00 179.25 178.96 2ozw h ASP 55 N 0.00 0.07 -0.41 0.00 3.58 -1.75 -0.64 116.42 117.28 2ozw h ASP 55 Ca 0.22 -0.37 -0.11 0.00 0.42 0.00 0.00 57.03 57.18 2ozw h ASP 55 Cb 0.94 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.95 2ozw h ASP 55 CO -0.00 0.43 -0.16 0.16 -2.88 0.00 0.00 179.24 176.79 2ozw h ILE 56 N -0.29 1.27 -0.59 2.25 3.07 -1.62 -1.05 117.51 120.55 2ozw h ILE 56 Ca 0.01 -1.29 -0.05 0.00 1.55 0.00 0.00 64.86 65.08 2ozw h ILE 56 Cb 0.40 1.08 -0.02 0.00 -0.27 0.00 0.00 36.82 38.01 2ozw h ILE 56 CO 0.00 0.44 0.16 0.22 -1.05 0.00 0.00 178.15 177.92 2ozw h TYR 57 N 0.78 0.98 -0.09 0.16 3.20 -1.24 0.11 116.97 120.88 2ozw h TYR 57 Ca 0.12 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 2ozw h TYR 57 Cb 0.69 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 2ozw h TYR 57 CO 0.04 0.83 0.04 0.22 -1.64 0.00 0.00 178.16 177.65 2ozw h ASP 58 N 0.85 0.13 0.33 -2.11 3.58 -0.97 0.50 116.42 118.73 2ozw h ASP 58 Ca 0.19 -0.17 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2ozw h ASP 58 Cb 0.33 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 2ozw h ASP 58 CO -0.00 0.27 -0.31 0.50 -2.88 0.00 0.00 179.24 176.82 2ozw h LYS 59 N -0.02 -0.63 0.04 0.28 1.63 -1.05 -1.04 116.57 115.79 2ozw h LYS 59 Ca 0.03 0.04 -0.16 0.00 -0.85 0.00 0.00 60.65 59.71 2ozw h LYS 59 Cb 0.18 0.14 0.01 0.00 -0.60 0.00 0.00 32.23 31.97 2ozw h LYS 59 CO -0.00 -0.42 -0.65 0.28 -3.45 0.00 0.00 179.45 175.20 2ozw h VAL 60 N -0.66 1.46 -0.57 2.00 2.07 -0.77 -0.55 116.25 119.22 2ozw h VAL 60 Ca -0.02 -2.21 -0.03 0.00 0.82 0.00 0.00 66.70 65.25 2ozw h VAL 60 Cb 0.59 2.78 -0.03 0.00 -1.52 0.00 0.00 31.29 33.12 2ozw h VAL 60 CO -0.05 0.64 0.21 -1.28 0.02 0.00 0.00 177.57 177.11 2ozw h SER 61 N -0.20 0.77 0.05 0.57 0.87 -0.97 0.13 113.55 114.78 2ozw h SER 61 Ca -0.09 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2ozw h SER 61 Cb 1.40 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2ozw h SER 61 CO 0.13 0.70 -0.04 1.23 -0.53 0.00 0.00 176.83 178.32 2ozw h GLY 62 N 0.95 -0.09 0.94 5.77 0.00 -1.10 -0.22 103.07 109.32 2ozw h GLY 62 Ca 0.19 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 2ozw h GLY 62 CO -0.02 -0.05 0.15 -1.80 0.00 0.00 0.00 176.54 174.83 2ozw h ASP 63 N -0.10 0.45 -0.32 0.19 3.58 -0.44 0.40 116.42 120.18 2ozw h ASP 63 Ca 0.00 -0.14 0.04 0.00 0.42 0.00 0.00 57.03 57.34 2ozw h ASP 63 Cb 0.09 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 40.99 2ozw h ASP 63 CO -0.01 0.47 0.11 0.24 -2.88 0.00 0.00 179.24 177.17 2ozw h MET 64 N 0.41 0.25 -0.05 0.28 2.86 -0.72 -0.26 114.93 117.69 2ozw h MET 64 Ca 0.12 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.67 2ozw h MET 64 Cb 0.14 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 2ozw h MET 64 CO -0.01 0.16 -0.30 1.96 1.06 0.00 0.00 176.91 179.78 2ozw h GLN 65 N 0.25 0.10 -0.27 1.72 4.20 -0.74 0.11 115.11 120.48 2ozw h GLN 65 Ca 0.14 -0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 2ozw h GLN 65 Cb 0.11 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 2ozw h GLN 65 CO -0.15 0.39 -0.25 0.87 -0.67 0.00 0.00 178.83 179.03 2ozw h LYS 66 N 0.09 0.53 0.00 1.46 1.57 -0.25 -1.26 116.57 118.71 2ozw h LYS 66 Ca 0.01 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2ozw h LYS 66 Cb 0.58 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2ozw h LYS 66 CO 0.04 0.74 0.00 1.96 -0.57 0.00 0.00 179.45 181.63 2ozw h GLN 67 N 0.47 0.00 0.00 3.15 4.20 0.10 -0.68 115.11 122.35 2ozw h GLN 67 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2ozw h GLN 67 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 2ozw h GLN 67 CO 0.05 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.62 2ozw n GLY 68 N 0.37 2.22 3.63 3.46 0.00 0.16 -0.80 105.19 114.24 2ozw n GLY 68 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.23 4.94 0.13 0.00 2.15 -1.21 -2.90 116.67 118.55 2ozw s ASP 70 Ca 0.76 -0.03 -0.02 0.00 0.43 0.00 0.00 52.55 53.69 2ozw s ASP 70 Cb -0.42 -1.26 -0.03 0.00 -0.30 0.00 0.00 42.92 40.90 2ozw s ASP 70 CO 0.47 0.30 0.09 0.00 -0.17 0.00 0.00 175.17 175.86 2ozw s GLU 72 N -4.02 0.37 -0.21 0.00 2.56 -0.51 -4.99 118.70 111.90 2ozw s GLU 72 Ca 0.22 0.82 -0.29 0.00 0.00 0.00 0.00 54.97 55.71 2ozw s GLU 72 Cb 0.07 0.02 -0.02 0.00 2.00 0.00 0.00 34.13 36.21 2ozw s GLU 72 CO 0.01 -0.17 1.39 0.00 -0.56 0.00 0.00 175.26 175.92 2ozw h LEU 74 N 10.56 0.00 0.00 0.00 3.38 -1.13 -3.48 115.31 124.64 2ozw h LEU 74 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2ozw h LEU 74 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2ozw h LEU 74 CO 1.00 0.18 0.00 0.61 0.09 0.00 0.00 178.44 180.32 2ozw n GLY 75 N 0.07 -1.41 3.36 0.83 0.00 -1.23 -4.55 105.19 102.25 2ozw n GLY 75 Ca 0.00 -1.06 -0.18 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 1.85 0.00 -0.02 0.00 -0.40 -1.94 107.32 106.81 2ozw s GLY 76 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 44.72 42.79 2ozw s GLY 76 CO 0.00 -1.67 0.00 0.61 0.00 0.00 0.00 173.10 172.04 2ozw n GLY 77 N -0.54 1.28 3.05 0.20 0.00 -0.33 -2.30 105.19 106.54 2ozw n GLY 77 Ca -0.01 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 2ozw n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ozw s ARG 78 N 0.53 0.44 -0.02 1.61 3.52 0.92 -0.91 118.95 125.03 2ozw s ARG 78 Ca 0.00 -0.68 0.06 0.00 -0.13 0.00 0.00 55.73 54.99 2ozw s ARG 78 Cb 0.00 0.16 -0.02 0.00 -1.56 0.00 0.00 34.95 33.54 2ozw s ARG 78 CO 0.00 -0.09 -0.21 0.42 -0.81 0.00 0.00 175.30 174.61 2ozw s ILE 79 N -1.99 1.66 0.02 4.11 1.01 -0.38 -1.63 121.20 124.00 2ozw s ILE 79 Ca -0.11 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.64 2ozw s ILE 79 Cb -0.06 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 41.01 2ozw s ILE 79 CO -0.02 0.47 -0.01 -0.44 0.00 0.00 0.00 174.94 174.93 2ozw s SER 80 N -0.48 0.26 0.34 3.58 0.01 -0.80 -2.16 113.70 114.44 2ozw s SER 80 Ca 0.08 -0.55 0.26 0.00 1.31 0.00 0.00 55.95 57.05 2ozw s SER 80 Cb -0.08 0.13 0.81 0.00 0.21 0.00 0.00 66.02 67.09 2ozw s SER 80 CO -0.01 -0.35 1.75 0.45 0.41 0.00 0.00 173.24 175.49 2ozw h HIS 81 N 4.39 0.00 -3.31 2.43 3.86 -1.86 -0.14 115.15 120.52 2ozw h HIS 81 Ca -0.32 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 58.72 2ozw h HIS 81 Cb 1.20 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 29.43 2ozw h HIS 81 CO 0.63 0.00 -0.47 -0.65 0.86 0.00 0.00 177.93 178.30 2ozw s GLN 82 N -3.27 0.34 0.00 2.45 -1.52 -1.26 -3.73 119.66 112.66 2ozw s GLN 82 Ca 0.07 0.05 0.00 0.00 -1.95 0.00 0.00 55.36 53.53 2ozw s GLN 82 Cb 0.09 0.15 0.00 0.00 -0.22 0.00 0.00 33.01 33.03 2ozw s GLN 82 CO 0.57 -0.06 0.00 0.43 -0.25 0.00 0.00 175.29 175.97 2ozw n SER 83 N 2.42 0.06 0.00 5.90 7.64 -1.26 -4.90 113.62 123.48 2ozw n SER 83 Ca -0.16 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.72 2ozw n SER 83 Cb 0.58 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.78 2ozw n SER 83 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ozw n GLN 84 N 0.00 0.00 -4.25 1.43 -0.00 -1.26 -4.51 117.38 108.80 2ozw n GLN 84 Ca 0.00 0.41 -0.21 0.00 -0.00 0.00 0.00 57.00 57.20 2ozw n GLN 84 Cb 0.00 -1.50 -0.12 0.00 -0.00 0.00 0.00 30.24 28.62 2ozw n GLN 84 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2ozw s ASP 85 N -2.84 2.20 0.00 2.61 2.15 -1.26 -5.07 116.67 114.46 2ozw s ASP 85 Ca 0.00 -0.68 0.30 0.00 0.43 0.00 0.00 52.55 52.59 2ozw s ASP 85 Cb 0.00 -0.10 1.42 0.00 -0.30 0.00 0.00 42.92 43.93 2ozw s ASP 85 CO 0.01 -0.01 1.96 0.29 -0.17 0.00 0.00 175.17 177.24 2ozw n LYS 86 N 1.05 0.97 -2.22 4.34 5.02 -1.26 -4.76 118.16 121.30 2ozw n LYS 86 Ca -0.19 -0.30 -0.26 0.00 -2.02 0.00 0.00 58.31 55.53 2ozw n LYS 86 Cb 0.54 -1.49 0.12 0.00 -0.02 0.00 0.00 35.03 34.18 2ozw n LYS 86 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ozw s LYS 87 N -2.24 1.55 0.21 1.97 3.01 -1.26 -4.90 119.74 118.08 2ozw s LYS 87 Ca 0.37 -0.54 -0.32 0.00 -1.01 0.00 0.00 55.97 54.47 2ozw s LYS 87 Cb 0.21 -2.11 -0.12 0.00 -1.01 0.00 0.00 37.83 34.80 2ozw s LYS 87 CO 0.41 -1.68 1.70 0.42 0.51 0.00 0.00 175.35 176.71 2ozw s ILE 88 N -3.43 2.07 0.13 2.17 1.01 -1.16 -4.27 121.20 117.71 2ozw s ILE 88 Ca 0.66 0.05 0.10 0.00 0.00 0.00 0.00 60.65 61.47 2ozw s ILE 88 Cb -0.07 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 2ozw s ILE 88 CO 0.47 0.00 -0.24 -2.28 0.00 0.00 0.00 174.94 172.89 2ozw s HIS 89 N 1.07 2.12 -0.09 3.97 2.46 -0.06 -0.97 115.29 123.79 2ozw s HIS 89 Ca 0.73 -0.39 0.01 0.00 0.47 0.00 0.00 55.06 55.88 2ozw s HIS 89 Cb -0.49 -1.14 0.02 0.00 -0.13 0.00 0.00 32.58 30.84 2ozw s HIS 89 CO 0.33 0.31 -0.10 0.08 -2.47 0.00 0.00 174.74 172.89 2ozw s VAL 90 N -1.17 1.08 0.00 0.89 1.01 -0.42 -1.91 120.40 119.88 2ozw s VAL 90 Ca 0.12 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2ozw s VAL 90 Cb -0.10 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.24 2ozw s VAL 90 CO 0.06 0.36 0.00 0.00 0.00 0.00 0.00 175.10 175.52 2ozw n TYR 91 N 4.38 -0.61 -1.71 5.22 4.11 -0.65 -3.01 117.16 124.89 2ozw n TYR 91 Ca -0.18 0.00 0.01 0.00 -0.00 0.00 0.00 57.90 57.73 2ozw n TYR 91 Cb 0.51 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.84 2ozw n TYR 91 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2ozw n GLY 92 N 0.00 -2.13 3.49 -7.48 0.00 0.37 -0.06 105.19 99.39 2ozw n GLY 92 Ca 0.00 -1.45 -0.17 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.70 -0.61 0.74 1.61 -0.85 -0.29 -4.60 117.35 112.65 2ozw s TYR 93 Ca 0.00 1.06 -0.11 0.00 -0.52 0.00 0.00 57.07 57.50 2ozw s TYR 93 Cb 0.00 0.38 0.04 0.00 0.38 0.00 0.00 41.96 42.75 2ozw s TYR 93 CO 0.00 -0.58 1.08 0.45 -1.52 0.00 0.00 175.55 174.97 2ozw s SER 94 N -1.18 4.98 -0.17 -0.18 0.15 -0.95 -4.75 113.70 111.61 2ozw s SER 94 Ca -0.11 1.44 0.13 0.00 0.70 0.00 0.00 55.95 58.11 2ozw s SER 94 Cb -0.01 -2.25 -0.20 0.00 -1.71 0.00 0.00 66.02 61.86 2ozw s SER 94 CO 0.09 -1.67 0.03 1.15 1.20 0.00 0.00 173.24 174.04 2ozw n MET 95 N -3.26 1.21 0.18 5.44 0.00 -1.26 -2.31 117.12 117.11 2ozw n MET 95 Ca 0.07 0.01 0.05 0.00 0.00 0.00 0.00 57.70 57.83 2ozw n MET 95 Cb 0.55 -1.42 0.28 0.00 0.00 0.00 0.00 33.22 32.63 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 0.92 0.00 3.17 0.00 -2.03 -3.38 119.26 118.66 2ozw h ALA 96 Ca -0.45 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.10 2ozw h ALA 96 Cb 1.98 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2ozw h ALA 96 CO 0.01 0.49 0.00 0.66 0.00 0.00 0.00 179.25 180.41 2ozw n TYR 97 N -3.46 0.00 -1.69 0.00 4.01 -1.26 -5.14 117.16 109.61 2ozw n TYR 97 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 2ozw n TYR 97 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.58 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 0.23 -2.14 3.74 2.72 0.00 -0.98 -4.29 105.19 104.48 2ozw n GLY 98 Ca 0.00 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.69 4.34 0.84 1.61 0.04 -1.26 -1.27 135.00 138.61 2ozw s PRO 99 Ca 0.00 2.17 -0.12 0.00 0.04 0.00 0.00 61.00 63.09 2ozw s PRO 99 Cb 0.00 -3.15 0.10 0.00 0.04 0.00 0.00 34.50 31.49 2ozw s PRO 99 CO 0.00 -0.31 1.13 0.00 0.04 0.00 0.00 177.00 177.86 2ozw s ALA 100 N -0.07 2.20 -1.28 8.56 0.00 -0.97 -4.52 121.76 125.68 2ozw s ALA 100 Ca 0.57 -0.46 -0.17 0.00 0.00 0.00 0.00 51.96 51.89 2ozw s ALA 100 Cb -0.39 -3.03 0.09 0.00 0.00 0.00 0.00 23.12 19.79 2ozw s ALA 100 CO 0.42 -1.90 1.69 -0.65 0.00 0.00 0.00 175.76 175.32 2ozw s GLN 101 N -5.33 4.01 0.66 0.00 -1.52 -1.26 -4.83 119.66 111.39 2ozw s GLN 101 Ca 0.62 -2.09 0.34 0.00 -1.95 0.00 0.00 55.36 52.28 2ozw s GLN 101 Cb -0.13 -5.46 1.87 0.00 -0.22 0.00 0.00 33.01 29.06 2ozw s GLN 101 CO 0.52 -2.18 2.06 0.45 -0.25 0.00 0.00 175.29 175.90 2ozw h HIS 102 N 7.51 0.00 -0.72 0.91 3.86 -1.95 -0.54 115.15 124.21 2ozw h HIS 102 Ca 0.43 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.75 2ozw h HIS 102 Cb 0.87 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.26 2ozw h HIS 102 CO 1.38 0.00 0.32 0.00 0.86 0.00 0.00 177.93 180.49 2ozw h ALA 103 N 1.56 1.00 -0.12 2.45 0.00 -1.98 -0.23 119.26 121.95 2ozw h ALA 103 Ca 0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2ozw h ALA 103 Cb 0.47 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2ozw h ALA 103 CO -0.00 -0.14 0.03 0.82 0.00 0.00 0.00 179.25 179.96 2ozw h ILE 104 N 0.51 1.20 -0.04 0.00 2.04 -1.51 -2.87 117.51 116.84 2ozw h ILE 104 Ca 0.38 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.64 2ozw h ILE 104 Cb 0.49 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2ozw h ILE 104 CO -0.33 0.18 -0.08 0.28 0.00 0.00 0.00 178.15 178.20 2ozw h SER 105 N -0.01 -0.23 -0.27 1.72 0.02 -1.48 -2.09 113.55 111.21 2ozw h SER 105 Ca 0.04 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2ozw h SER 105 Cb 0.25 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2ozw h SER 105 CO 0.00 -0.11 0.06 0.71 -1.14 0.00 0.00 176.83 176.35 2ozw h THR 106 N -0.11 1.22 -0.96 -2.27 1.35 -1.07 0.91 112.91 111.98 2ozw h THR 106 Ca 0.05 -0.72 -0.00 0.00 -0.55 0.00 0.00 66.41 65.19 2ozw h THR 106 Cb 0.18 1.18 -0.05 0.00 -1.73 0.00 0.00 68.15 67.73 2ozw h THR 106 CO -0.11 0.23 0.59 -0.33 -0.25 0.00 0.00 175.52 175.65 2ozw h GLU 107 N 0.26 1.29 -0.18 4.72 4.39 -1.38 0.81 114.58 124.48 2ozw h GLU 107 Ca 0.08 -0.11 -0.18 0.00 0.34 0.00 0.00 59.36 59.49 2ozw h GLU 107 Cb 0.29 -0.28 0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2ozw h GLU 107 CO 0.00 0.89 -0.59 0.87 -1.16 0.00 0.00 179.01 179.02 2ozw h LYS 108 N 1.32 0.73 -0.53 2.33 1.57 -1.10 -1.93 116.57 118.95 2ozw h LYS 108 Ca 0.35 -0.54 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 2ozw h LYS 108 Cb -0.08 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2ozw h LYS 108 CO -0.07 1.16 0.04 0.82 -0.57 0.00 0.00 179.45 180.83 2ozw h ILE 109 N 0.44 1.26 -0.41 1.86 2.04 -0.49 -0.59 117.51 121.62 2ozw h ILE 109 Ca -0.02 -1.04 0.05 0.00 1.00 0.00 0.00 64.86 64.86 2ozw h ILE 109 Cb 1.22 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 38.13 2ozw h ILE 109 CO 0.13 0.37 0.13 0.11 0.00 0.00 0.00 178.15 178.88 2ozw h LYS 110 N 0.79 0.27 -0.70 2.37 1.57 -0.85 -0.09 116.57 119.93 2ozw h LYS 110 Ca 0.16 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 2ozw h LYS 110 Cb 0.47 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 2ozw h LYS 110 CO 0.02 0.18 0.33 0.00 -0.57 0.00 0.00 179.45 179.41 2ozw h ALA 111 N 1.28 0.90 -0.09 3.86 0.00 -0.84 -2.53 119.26 121.85 2ozw h ALA 111 Ca 0.19 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2ozw h ALA 111 Cb 0.20 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2ozw h ALA 111 CO -0.21 0.47 -0.62 -0.22 0.00 0.00 0.00 179.25 178.66 2ozw h LYS 112 N 0.98 0.31 -2.17 0.00 3.64 -0.79 -3.38 116.57 115.15 2ozw h LYS 112 Ca 0.24 -0.22 -0.57 0.00 -1.27 0.00 0.00 60.65 58.83 2ozw h LYS 112 Cb 0.12 0.03 -0.41 0.00 -0.41 0.00 0.00 32.23 31.57 2ozw h LYS 112 CO -0.03 0.83 -0.79 0.66 -2.27 0.00 0.00 179.45 177.86 2ozw n TYR 113 N -3.87 2.71 0.47 1.91 4.01 -0.08 -4.93 117.16 117.38 2ozw n TYR 113 Ca -0.03 -3.96 0.07 0.00 -0.16 0.00 0.00 57.90 53.83 2ozw n TYR 113 Cb 0.63 -0.48 0.33 0.00 -0.31 0.00 0.00 39.34 39.51 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 0.34 0.03 0.01 -0.72 -0.04 -0.98 -1.69 135.00 131.94 2ozw n PRO 114 Ca 0.28 0.28 0.06 0.00 -0.04 0.00 0.00 63.50 64.08 2ozw n PRO 114 Cb 0.46 -1.55 0.25 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.60 0.03 -4.11 3.54 2.03 -1.26 -4.79 116.55 110.39 2ozw n ASP 115 Ca 0.03 0.51 -0.27 0.00 0.52 0.00 0.00 54.79 55.58 2ozw n ASP 115 Cb 0.17 -0.52 -0.08 0.00 -0.72 0.00 0.00 41.12 39.98 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 -3.02 1.78 0.08 -0.67 2.02 -0.68 -5.18 117.35 111.67 2ozw s TYR 116 Ca 0.05 -1.31 0.02 0.00 -0.37 0.00 0.00 57.07 55.46 2ozw s TYR 116 Cb 0.07 -1.19 -0.03 0.00 -0.40 0.00 0.00 41.96 40.41 2ozw s TYR 116 CO 0.21 -0.30 -0.07 -2.00 -1.57 0.00 0.00 175.55 171.82 2ozw s GLU 117 N -3.68 0.73 0.02 -0.62 2.12 -1.26 -4.95 118.70 111.06 2ozw s GLU 117 Ca 0.19 -1.11 0.01 0.00 0.36 0.00 0.00 54.97 54.43 2ozw s GLU 117 Cb 0.01 -0.27 -0.02 0.00 0.26 0.00 0.00 34.13 34.11 2ozw s GLU 117 CO 0.13 0.02 -0.05 0.08 -0.54 0.00 0.00 175.26 174.91 2ozw s VAL 118 N -2.69 0.29 0.21 3.70 1.01 -1.26 -3.00 120.40 118.66 2ozw s VAL 118 Ca 0.03 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.31 2ozw s VAL 118 Cb -0.01 -0.35 -0.05 0.00 0.00 0.00 0.00 36.38 35.97 2ozw s VAL 118 CO -0.02 -0.28 0.08 0.42 0.00 0.00 0.00 175.10 175.29 2ozw s THR 119 N -0.98 0.43 0.12 3.92 -4.23 -0.14 -4.95 115.64 109.81 2ozw s THR 119 Ca -0.08 -1.99 -0.08 0.00 -1.18 0.00 0.00 61.69 58.36 2ozw s THR 119 Cb -0.07 -2.43 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 2ozw s THR 119 CO -0.00 -0.16 0.20 -1.66 -0.54 0.00 0.00 174.62 172.45 2ozw s TRP 120 N -3.84 0.33 -0.17 3.99 1.48 -1.26 -1.30 118.94 118.17 2ozw s TRP 120 Ca 0.33 -0.74 -0.15 0.00 -1.06 0.00 0.00 56.10 54.49 2ozw s TRP 120 Cb 0.07 -0.12 0.04 0.00 -1.16 0.00 0.00 33.47 32.31 2ozw s TRP 120 CO 0.10 -0.60 0.44 0.00 -4.06 0.00 0.00 176.95 172.83 2ozw s ALA 121 N -3.92 -1.09 -1.31 2.67 0.00 -1.16 -4.97 121.76 111.97 2ozw s ALA 121 Ca 0.11 1.28 -0.17 0.00 0.00 0.00 0.00 51.96 53.18 2ozw s ALA 121 Cb 0.05 -0.75 0.08 0.00 0.00 0.00 0.00 23.12 22.50 2ozw s ALA 121 CO -0.06 -0.21 1.77 -1.71 0.00 0.00 0.00 175.76 175.55 2ozw n ASN 122 N 2.98 4.84 -2.15 0.00 4.05 -1.26 -4.44 115.26 119.27 2ozw n ASN 122 Ca -0.14 -2.92 -0.10 0.00 0.45 0.00 0.00 54.58 51.87 2ozw n ASN 122 Cb 0.57 -1.72 -0.04 0.00 1.23 0.00 0.00 39.78 39.82 2ozw n ASN 122 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 2ozw n ASP 123 N 7.76 -0.42 0.00 1.20 -0.08 -1.26 -5.02 116.55 118.73 2ozw n ASP 123 Ca 0.48 -2.13 0.00 0.00 -1.51 0.00 0.00 54.79 51.63 2ozw n ASP 123 Cb 0.45 0.94 0.00 0.00 2.34 0.00 0.00 41.12 44.85 2ozw n ASP 123 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2ozw n GLY 124 N -0.33 -0.48 0.00 0.27 0.00 -1.26 -0.48 105.19 102.91 2ozw n GLY 124 Ca 0.04 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.12 2ozw n GLY 124 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30