#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ip9 n ALA 2 N 0.00 -1.54 -0.06 4.61 0.00 -1.26 -4.95 120.51 117.31 1ip9 n ALA 2 Ca 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 53.44 52.90 1ip9 n ALA 2 Cb 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 19.45 19.32 1ip9 n ALA 2 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1ip9 h MET 3 N 0.00 0.00 -4.42 0.00 2.07 -2.16 -3.49 114.93 106.93 1ip9 h MET 3 Ca -0.11 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.52 1ip9 h MET 3 Cb 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.12 1ip9 h MET 3 CO 0.07 0.67 -0.15 0.41 1.07 0.00 0.00 176.91 178.98 1ip9 n GLY 4 N 1.67 -0.97 3.34 8.32 0.00 -1.26 -5.07 105.19 111.21 1ip9 n GLY 4 Ca -0.07 0.46 -0.09 0.00 0.00 0.00 0.00 46.02 46.32 1ip9 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ip9 s SER 5 N -2.30 -0.01 0.00 1.61 0.01 -1.26 -5.17 113.70 106.58 1ip9 s SER 5 Ca 0.07 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 56.60 1ip9 s SER 5 Cb -0.02 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.65 1ip9 s SER 5 CO 0.46 -0.89 0.00 -0.24 0.41 0.00 0.00 173.24 172.99 1ip9 n SER 6 N -0.21 0.00 0.00 2.44 2.88 -1.26 -5.08 113.62 112.40 1ip9 n SER 6 Ca -0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1ip9 n SER 6 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 1ip9 n SER 6 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1ip9 n THR 7 N -0.20 0.00 -0.79 2.46 -2.24 -1.26 -5.16 114.28 107.08 1ip9 n THR 7 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1ip9 n THR 7 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1ip9 n THR 7 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ip9 n SER 8 N -1.24 -4.28 0.00 3.42 2.88 -1.26 -5.05 113.62 108.09 1ip9 n SER 8 Ca 0.00 0.88 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 1ip9 n SER 8 Cb 0.00 -2.40 0.00 0.00 -0.75 0.00 0.00 64.21 61.06 1ip9 n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ip9 n GLY 9 N -2.65 3.44 3.68 0.46 0.00 -1.26 -5.10 105.19 103.76 1ip9 n GLY 9 Ca -0.03 -1.58 -0.29 0.00 0.00 0.00 0.00 46.02 44.13 1ip9 n GLY 9 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ip9 s LEU 10 N 0.00 1.66 0.04 0.99 1.43 -1.26 -5.07 118.68 116.47 1ip9 s LEU 10 Ca 0.00 1.20 -0.02 0.00 -1.03 0.00 0.00 54.13 54.28 1ip9 s LEU 10 Cb 0.00 -3.41 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 1ip9 s LEU 10 CO 0.00 -3.08 0.00 -0.54 0.23 0.00 0.00 176.35 172.96 1ip9 s LYS 11 N -4.97 0.51 0.22 1.70 -0.14 -1.26 -5.16 119.74 110.63 1ip9 s LYS 11 Ca 0.65 -0.91 0.05 0.00 -1.36 0.00 0.00 55.97 54.41 1ip9 s LYS 11 Cb -0.18 0.19 -0.03 0.00 -1.68 0.00 0.00 37.83 36.12 1ip9 s LYS 11 CO 0.57 -0.10 0.24 0.95 -0.76 0.00 0.00 175.35 176.25 1ip9 s THR 12 N -2.81 4.80 -0.16 2.17 -4.23 -1.26 -4.70 115.64 109.45 1ip9 s THR 12 Ca -0.03 -1.12 -0.15 0.00 -1.18 0.00 0.00 61.69 59.20 1ip9 s THR 12 Cb -0.00 -3.55 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 1ip9 s THR 12 CO -0.06 -0.26 0.35 -0.89 -0.54 0.00 0.00 174.62 173.22 1ip9 s THR 13 N -1.96 5.27 -0.56 3.99 2.01 -0.28 -4.78 115.64 119.32 1ip9 s THR 13 Ca 0.33 0.65 -0.22 0.00 0.31 0.00 0.00 61.69 62.75 1ip9 s THR 13 Cb -0.09 -3.68 0.05 0.00 0.01 0.00 0.00 72.50 68.79 1ip9 s THR 13 CO 0.26 0.35 0.86 -0.75 -0.69 0.00 0.00 174.62 174.66 1ip9 s LYS 14 N 0.67 3.23 0.03 4.92 2.20 -1.26 -2.59 119.74 126.94 1ip9 s LYS 14 Ca 0.19 -0.56 0.06 0.00 -0.36 0.00 0.00 55.97 55.29 1ip9 s LYS 14 Cb -0.14 -4.11 -0.03 0.00 -1.51 0.00 0.00 37.83 32.04 1ip9 s LYS 14 CO 0.06 -1.49 -0.14 0.42 -0.36 0.00 0.00 175.35 173.83 1ip9 s ILE 15 N 3.62 3.09 -0.20 5.43 1.01 -0.89 -4.87 121.20 128.38 1ip9 s ILE 15 Ca 0.24 -1.06 0.01 0.00 0.00 0.00 0.00 60.65 59.85 1ip9 s ILE 15 Cb -0.15 -2.32 0.03 0.00 0.01 0.00 0.00 42.46 40.02 1ip9 s ILE 15 CO 0.15 0.35 -0.17 -0.54 0.00 0.00 0.00 174.94 174.73 1ip9 s LYS 16 N -1.46 2.85 0.76 2.79 -0.14 -1.26 -1.01 119.74 122.26 1ip9 s LYS 16 Ca 0.16 -0.93 -0.10 0.00 -1.36 0.00 0.00 55.97 53.74 1ip9 s LYS 16 Cb -0.11 -2.67 0.07 0.00 -1.68 0.00 0.00 37.83 33.44 1ip9 s LYS 16 CO 0.06 -0.29 1.10 -0.06 -0.76 0.00 0.00 175.35 175.41 1ip9 s PHE 17 N 1.26 2.96 -0.44 3.18 0.40 -0.02 -0.75 117.98 124.58 1ip9 s PHE 17 Ca 0.02 0.64 0.07 0.00 -0.60 0.00 0.00 56.93 57.07 1ip9 s PHE 17 Cb -0.15 -3.34 0.25 0.00 0.51 0.00 0.00 43.02 40.29 1ip9 s PHE 17 CO -0.11 -1.58 0.56 0.66 0.70 0.00 0.00 175.22 175.45 1ip9 n TYR 18 N -3.13 0.40 -2.37 0.36 4.02 0.62 -2.94 117.16 114.12 1ip9 n TYR 18 Ca 0.08 -3.67 -0.43 0.00 -0.01 0.00 0.00 57.90 53.87 1ip9 n TYR 18 Cb 0.61 -0.37 -0.02 0.00 -0.02 0.00 0.00 39.34 39.53 1ip9 n TYR 18 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1ip9 s TYR 19 N -1.38 2.57 0.00 -0.72 5.04 -0.79 -1.58 117.35 120.50 1ip9 s TYR 19 Ca 0.36 0.81 0.00 0.00 -2.44 0.00 0.00 57.07 55.79 1ip9 s TYR 19 Cb 0.16 -3.93 0.00 0.00 0.35 0.00 0.00 41.96 38.54 1ip9 s TYR 19 CO -0.10 -1.93 0.00 1.63 -1.34 0.00 0.00 175.55 173.81 1ip9 n LYS 20 N 7.40 0.00 0.00 4.97 5.02 -1.03 -1.00 118.16 133.51 1ip9 n LYS 20 Ca 0.15 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.59 1ip9 n LYS 20 Cb 0.46 0.00 0.75 0.00 -0.02 0.00 0.00 35.03 36.22 1ip9 n LYS 20 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ip9 n ASP 21 N -1.20 0.29 -4.97 4.39 9.92 -1.26 -4.83 116.55 118.88 1ip9 n ASP 21 Ca 0.00 -0.67 -0.21 0.00 -0.53 0.00 0.00 54.79 53.38 1ip9 n ASP 21 Cb 0.00 -0.10 0.02 0.00 -0.64 0.00 0.00 41.12 40.40 1ip9 n ASP 21 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1ip9 s ASP 22 N -2.31 5.67 -0.02 -2.24 2.15 -0.17 -5.12 116.67 114.63 1ip9 s ASP 22 Ca 0.36 0.03 -0.13 0.00 0.43 0.00 0.00 52.55 53.24 1ip9 s ASP 22 Cb 0.21 -1.19 0.02 0.00 -0.30 0.00 0.00 42.92 41.66 1ip9 s ASP 22 CO 0.43 -0.79 0.28 -0.63 -0.17 0.00 0.00 175.17 174.29 1ip9 s ILE 23 N -2.52 0.06 0.00 4.11 1.01 -1.26 -1.88 121.20 120.72 1ip9 s ILE 23 Ca 0.51 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.69 1ip9 s ILE 23 Cb -0.10 -0.57 0.00 0.00 0.01 0.00 0.00 42.46 41.80 1ip9 s ILE 23 CO 0.36 -0.26 0.00 2.22 0.00 0.00 0.00 174.94 177.27 1ip9 n PHE 24 N 1.45 0.00 -4.05 3.97 -1.74 -1.15 -4.93 117.46 111.01 1ip9 n PHE 24 Ca -0.21 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.56 1ip9 n PHE 24 Cb 0.56 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.51 1ip9 n PHE 24 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1ip9 s ALA 25 N -2.00 0.31 -0.14 1.98 0.00 -1.26 -0.84 121.76 119.81 1ip9 s ALA 25 Ca 0.00 -1.23 -0.20 0.00 0.00 0.00 0.00 51.96 50.53 1ip9 s ALA 25 Cb 0.00 1.11 0.05 0.00 0.00 0.00 0.00 23.12 24.28 1ip9 s ALA 25 CO 0.00 -0.81 0.52 -1.17 0.00 0.00 0.00 175.76 174.30 1ip9 s LEU 26 N -3.13 0.00 -0.38 0.00 2.96 -0.18 -4.90 118.68 113.05 1ip9 s LEU 26 Ca 0.27 0.86 -0.08 0.00 -0.22 0.00 0.00 54.13 54.95 1ip9 s LEU 26 Cb -0.00 1.86 0.06 0.00 0.50 0.00 0.00 46.19 48.61 1ip9 s LEU 26 CO 0.14 -0.30 0.20 -0.04 -1.32 0.00 0.00 176.35 175.03 1ip9 s MET 27 N -0.23 2.62 0.20 1.98 -1.94 -1.25 -2.10 119.30 118.58 1ip9 s MET 27 Ca -0.04 -1.32 -0.02 0.00 -1.71 0.00 0.00 55.69 52.60 1ip9 s MET 27 Cb -0.03 -3.66 -0.05 0.00 2.01 0.00 0.00 34.83 33.10 1ip9 s MET 27 CO 0.03 -0.82 0.40 -0.51 -0.01 0.00 0.00 175.02 174.11 1ip9 s LEU 28 N 1.43 4.22 0.00 -0.03 2.01 -1.07 -4.74 118.68 120.50 1ip9 s LEU 28 Ca 0.01 0.47 0.08 0.00 0.01 0.00 0.00 54.13 54.70 1ip9 s LEU 28 Cb -0.21 -3.23 -0.04 0.00 0.01 0.00 0.00 46.19 42.71 1ip9 s LEU 28 CO 0.03 -0.04 0.45 1.17 1.01 0.00 0.00 176.35 178.98 1ip9 n LYS 29 N -0.52 3.26 0.00 1.70 4.81 -1.26 -1.12 118.16 125.03 1ip9 n LYS 29 Ca -0.04 -0.29 0.00 0.00 -0.87 0.00 0.00 58.31 57.11 1ip9 n LYS 29 Cb 0.53 -0.95 0.00 0.00 0.02 0.00 0.00 35.03 34.63 1ip9 n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ip9 n GLY 30 N 0.99 2.15 0.02 3.14 0.00 -1.26 -4.91 105.19 105.32 1ip9 n GLY 30 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.15 1ip9 n GLY 30 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ip9 n ASP 31 N 0.00 0.19 -4.53 1.61 5.75 -1.26 -4.94 116.55 113.37 1ip9 n ASP 31 Ca 0.00 -0.03 -0.50 0.00 -0.01 0.00 0.00 54.79 54.25 1ip9 n ASP 31 Cb 0.00 1.71 -0.04 0.00 -1.03 0.00 0.00 41.12 41.76 1ip9 n ASP 31 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1ip9 n THR 32 N -2.25 1.11 -3.39 2.12 -1.04 -1.26 -4.96 114.28 104.62 1ip9 n THR 32 Ca -0.03 -0.28 -0.12 0.00 -2.04 0.00 0.00 64.05 61.58 1ip9 n THR 32 Cb 0.55 -0.53 0.02 0.00 -1.82 0.00 0.00 70.33 68.54 1ip9 n THR 32 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1ip9 n THR 33 N 1.03 0.00 0.09 12.58 -2.24 -1.26 -4.51 114.28 119.97 1ip9 n THR 33 Ca 0.16 -1.09 -0.18 0.00 -2.27 0.00 0.00 64.05 60.67 1ip9 n THR 33 Cb 0.23 -0.48 -0.14 0.00 -2.10 0.00 0.00 70.33 67.83 1ip9 n THR 33 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1ip9 h TYR 34 N 0.34 0.56 0.00 4.78 3.20 -1.85 -2.24 116.97 121.76 1ip9 h TYR 34 Ca -0.16 -0.41 -0.07 0.00 3.14 0.00 0.00 58.73 61.23 1ip9 h TYR 34 Cb 0.66 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 1ip9 h TYR 34 CO 0.00 1.41 -0.33 0.87 -1.64 0.00 0.00 178.16 178.47 1ip9 h LYS 35 N 0.08 0.00 -0.05 1.82 1.57 -1.96 -0.90 116.57 117.14 1ip9 h LYS 35 Ca -0.23 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 1ip9 h LYS 35 Cb 2.04 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.34 1ip9 h LYS 35 CO 0.19 0.33 -0.04 1.49 -0.57 0.00 0.00 179.45 180.85 1ip9 h GLU 36 N 0.00 0.12 -0.88 3.15 4.57 -1.94 -1.88 114.58 117.72 1ip9 h GLU 36 Ca -0.00 -0.06 0.10 0.00 -1.18 0.00 0.00 59.36 58.22 1ip9 h GLU 36 Cb 1.00 -0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.52 1ip9 h GLU 36 CO 0.04 0.54 0.57 1.25 -1.18 0.00 0.00 179.01 180.23 1ip9 h LEU 37 N -0.30 0.77 0.20 1.64 6.46 -1.17 0.12 115.31 123.02 1ip9 h LEU 37 Ca 0.01 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 1ip9 h LEU 37 Cb 0.51 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.30 1ip9 h LEU 37 CO 0.01 0.45 -0.22 0.03 -0.62 0.00 0.00 178.44 178.09 1ip9 h ARG 38 N 0.85 -0.40 0.00 1.25 3.08 -0.56 0.25 114.38 118.85 1ip9 h ARG 38 Ca 0.41 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.49 1ip9 h ARG 38 Cb 0.44 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1ip9 h ARG 38 CO -0.18 -0.27 0.00 0.45 -1.07 0.00 0.00 179.97 178.90 1ip9 n SER 39 N -3.65 0.58 0.08 7.04 2.88 -0.76 -1.28 113.62 118.51 1ip9 n SER 39 Ca -0.05 0.69 0.12 0.00 -1.33 0.00 0.00 58.87 58.30 1ip9 n SER 39 Cb 0.19 -0.80 0.12 0.00 -0.75 0.00 0.00 64.21 62.97 1ip9 n SER 39 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1ip9 h LYS 40 N 0.00 0.00 0.00 -1.46 1.57 -0.02 -3.37 116.57 113.29 1ip9 h LYS 40 Ca 0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 1ip9 h LYS 40 Cb 0.20 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.46 1ip9 h LYS 40 CO 0.00 0.00 -2.11 -0.89 -0.57 0.00 0.00 179.45 175.88 1ip9 n ILE 41 N -2.32 1.11 -0.25 1.86 5.41 0.80 -4.38 119.36 121.60 1ip9 n ILE 41 Ca 0.02 -0.62 0.05 0.00 1.00 0.00 0.00 62.75 63.20 1ip9 n ILE 41 Cb 0.48 -0.74 0.15 0.00 -0.71 0.00 0.00 39.64 38.82 1ip9 n ILE 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ip9 h ALA 42 N 0.59 0.78 0.00 -1.39 0.00 -1.34 0.46 119.26 118.36 1ip9 h ALA 42 Ca -0.44 0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1ip9 h ALA 42 Cb 1.92 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 20.08 1ip9 h ALA 42 CO 0.00 -0.41 -0.33 -1.00 0.00 0.00 0.00 179.25 177.51 1ip9 h PRO 43 N 0.12 0.00 -0.00 0.00 0.13 -1.77 -1.37 132.00 129.10 1ip9 h PRO 43 Ca 0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.53 1ip9 h PRO 43 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1ip9 h PRO 43 CO -0.63 0.33 -0.29 0.54 -0.23 0.00 0.00 178.00 177.72 1ip9 n ARG 44 N -3.48 0.46 -0.11 0.86 5.12 0.10 -3.91 116.66 115.70 1ip9 n ARG 44 Ca -0.00 -0.24 -0.12 0.00 -1.93 0.00 0.00 57.85 55.56 1ip9 n ARG 44 Cb 0.49 -1.50 -0.14 0.00 -1.16 0.00 0.00 32.46 30.15 1ip9 n ARG 44 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1ip9 n ILE 45 N -1.06 1.37 -0.34 0.55 5.41 0.12 -4.98 119.36 120.43 1ip9 n ILE 45 Ca 0.10 -0.73 0.00 0.00 1.00 0.00 0.00 62.75 63.12 1ip9 n ILE 45 Cb 0.33 -0.80 0.00 0.00 -0.71 0.00 0.00 39.64 38.46 1ip9 n ILE 45 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1ip9 n ASP 46 N -2.90 -0.65 -3.48 4.38 8.00 -0.57 -5.04 116.55 116.29 1ip9 n ASP 46 Ca -0.36 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 54.95 1ip9 n ASP 46 Cb 1.08 -0.11 -0.08 0.00 -0.02 0.00 0.00 41.12 41.99 1ip9 n ASP 46 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1ip9 s THR 47 N -2.25 0.04 -0.52 -3.53 -1.32 -1.14 -5.05 115.64 101.87 1ip9 s THR 47 Ca 0.00 -2.00 0.05 0.00 -1.21 0.00 0.00 61.69 58.53 1ip9 s THR 47 Cb 0.00 -2.49 0.07 0.00 -1.51 0.00 0.00 72.50 68.57 1ip9 s THR 47 CO 0.00 0.00 0.82 0.47 -2.21 0.00 0.00 174.62 173.70 1ip9 n ASP 48 N -1.42 1.78 -3.70 8.08 8.00 -1.26 -4.42 116.55 123.60 1ip9 n ASP 48 Ca 0.06 -1.50 -0.27 0.00 0.71 0.00 0.00 54.79 53.79 1ip9 n ASP 48 Cb 0.63 -0.04 -0.17 0.00 -0.02 0.00 0.00 41.12 41.52 1ip9 n ASP 48 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1ip9 s ASN 49 N -0.63 2.58 0.06 -2.24 -0.87 -1.26 -4.99 114.94 107.60 1ip9 s ASN 49 Ca 0.07 -0.67 -0.02 0.00 -1.57 0.00 0.00 52.86 50.67 1ip9 s ASN 49 Cb 0.04 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.25 40.77 1ip9 s ASN 49 CO 0.06 -0.31 0.02 0.72 -2.57 0.00 0.00 177.10 175.03 1ip9 s PHE 50 N 1.95 0.47 -0.25 2.20 -0.71 -1.26 -1.70 117.98 118.68 1ip9 s PHE 50 Ca 0.01 -0.99 -0.07 0.00 -1.04 0.00 0.00 56.93 54.84 1ip9 s PHE 50 Cb -0.16 -0.33 -0.02 0.00 -1.21 0.00 0.00 43.02 41.29 1ip9 s PHE 50 CO -0.08 -0.42 0.06 0.21 -1.34 0.00 0.00 175.22 173.66 1ip9 s LYS 51 N -3.92 3.58 -0.17 1.99 2.20 -0.44 -4.83 119.74 118.16 1ip9 s LYS 51 Ca 0.08 -0.52 -0.07 0.00 -0.36 0.00 0.00 55.97 55.09 1ip9 s LYS 51 Cb 0.07 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 33.04 1ip9 s LYS 51 CO -0.09 -0.22 0.06 -0.51 -0.36 0.00 0.00 175.35 174.23 1ip9 s LEU 52 N 1.60 3.85 0.28 5.43 1.43 -1.26 -0.92 118.68 129.09 1ip9 s LEU 52 Ca 0.06 0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 1ip9 s LEU 52 Cb -0.15 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1ip9 s LEU 52 CO 0.03 0.22 0.13 -1.10 0.23 0.00 0.00 176.35 175.86 1ip9 s GLN 53 N 0.11 1.51 -1.12 1.70 1.11 -0.61 -1.00 119.66 121.36 1ip9 s GLN 53 Ca 0.05 -1.85 -0.20 0.00 0.01 0.00 0.00 55.36 53.37 1ip9 s GLN 53 Cb -0.12 -0.16 0.07 0.00 -1.01 0.00 0.00 33.01 31.79 1ip9 s GLN 53 CO 0.01 -0.39 1.51 0.95 0.01 0.00 0.00 175.29 177.38 1ip9 s THR 54 N -3.68 4.13 -0.70 -0.19 -4.23 -0.26 -1.22 115.64 109.49 1ip9 s THR 54 Ca 0.36 -1.33 -0.18 0.00 -1.18 0.00 0.00 61.69 59.36 1ip9 s THR 54 Cb 0.06 -5.07 -0.17 0.00 1.34 0.00 0.00 72.50 68.66 1ip9 s THR 54 CO 0.16 -1.91 1.80 1.17 -0.54 0.00 0.00 174.62 175.30 1ip9 n LYS 55 N 8.31 0.00 -0.22 3.99 0.00 0.85 -2.04 118.16 129.05 1ip9 n LYS 55 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.69 1ip9 n LYS 55 Cb 0.49 -0.97 0.00 0.00 0.00 0.00 0.00 35.03 34.55 1ip9 n LYS 55 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1ip9 n LEU 56 N 6.53 0.00 0.14 3.14 4.77 -1.25 -4.36 117.00 125.98 1ip9 n LEU 56 Ca 0.47 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.56 1ip9 n LEU 56 Cb 0.04 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.21 1ip9 n LEU 56 CO 0.69 -0.35 0.34 2.19 -1.33 0.00 0.00 177.39 178.92 1ip9 h PHE 57 N -0.49 0.00 0.15 -1.77 -5.15 -1.93 -3.34 116.94 104.41 1ip9 h PHE 57 Ca 0.00 0.00 -0.34 0.00 -0.20 0.00 0.00 57.97 57.43 1ip9 h PHE 57 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.17 1ip9 h PHE 57 CO 0.00 0.00 -1.72 0.38 -2.00 0.00 0.00 178.31 174.97 1ip9 h ASP 58 N 0.00 0.49 0.00 -0.68 2.03 -1.98 -3.48 116.42 112.80 1ip9 h ASP 58 Ca 0.00 -0.76 0.00 0.00 -0.73 0.00 0.00 57.03 55.54 1ip9 h ASP 58 Cb 0.98 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.32 1ip9 h ASP 58 CO 0.00 1.65 0.00 0.61 -1.03 0.00 0.00 179.24 180.47 1ip9 n GLY 59 N 1.80 -0.33 3.46 7.15 0.00 -1.25 -5.15 105.19 110.87 1ip9 n GLY 59 Ca -0.23 0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 1ip9 n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ip9 s SER 60 N 0.00 -0.59 0.00 1.61 1.04 -1.26 -3.97 113.70 110.52 1ip9 s SER 60 Ca 0.00 0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.69 1ip9 s SER 60 Cb 0.00 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.69 1ip9 s SER 60 CO 0.00 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1ip9 n GLY 61 N 0.09 2.94 3.71 7.32 0.00 -0.86 -4.51 105.19 113.87 1ip9 n GLY 61 Ca -0.17 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 1ip9 n GLY 61 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ip9 n GLU 62 N 0.00 2.70 -2.39 1.61 1.02 -1.26 -4.36 120.64 117.96 1ip9 n GLU 62 Ca 0.00 0.97 -0.40 0.00 -0.02 0.00 0.00 57.16 57.72 1ip9 n GLU 62 Cb 0.00 -2.82 -0.03 0.00 -0.02 0.00 0.00 31.44 28.57 1ip9 n GLU 62 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ip9 s GLU 63 N 1.39 3.04 -0.36 3.49 2.12 -1.26 -1.10 118.70 126.01 1ip9 s GLU 63 Ca 0.77 -0.06 -0.44 0.00 0.36 0.00 0.00 54.97 55.59 1ip9 s GLU 63 Cb -0.53 -4.34 -0.19 0.00 0.26 0.00 0.00 34.13 29.33 1ip9 s GLU 63 CO 0.34 -2.36 1.54 -0.89 -0.54 0.00 0.00 175.26 173.35 1ip9 n ILE 64 N 6.70 0.06 -1.45 -3.70 -0.00 -0.17 -4.78 119.36 116.01 1ip9 n ILE 64 Ca 0.11 -0.01 0.00 0.00 -0.00 0.00 0.00 62.75 62.85 1ip9 n ILE 64 Cb 0.50 -0.58 0.00 0.00 -0.00 0.00 0.00 39.64 39.56 1ip9 n ILE 64 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1ip9 n LYS 65 N 3.84 0.00 -3.67 0.38 5.02 -1.26 -4.68 118.16 117.79 1ip9 n LYS 65 Ca 0.28 -0.56 -0.13 0.00 -2.02 0.00 0.00 58.31 55.88 1ip9 n LYS 65 Cb 0.01 -0.42 -0.07 0.00 -0.02 0.00 0.00 35.03 34.53 1ip9 n LYS 65 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1ip9 s THR 66 N 0.00 0.05 0.55 -0.18 -4.23 -1.26 -4.99 115.64 105.59 1ip9 s THR 66 Ca 0.00 -0.42 0.26 0.00 -1.18 0.00 0.00 61.69 60.34 1ip9 s THR 66 Cb 0.00 -0.90 0.26 0.00 1.34 0.00 0.00 72.50 73.20 1ip9 s THR 66 CO 0.00 -0.23 1.77 0.44 -0.54 0.00 0.00 174.62 176.06 1ip9 h ASP 67 N 3.16 0.00 0.23 3.99 3.32 -1.92 0.27 116.42 125.46 1ip9 h ASP 67 Ca -0.31 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.41 1ip9 h ASP 67 Cb 1.19 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.77 1ip9 h ASP 67 CO 0.42 0.00 -1.53 -1.28 -1.72 0.00 0.00 179.24 175.13 1ip9 h SER 68 N 0.00 0.75 -0.47 6.45 0.87 -1.94 -1.37 113.55 117.83 1ip9 h SER 68 Ca 0.00 -0.93 -0.06 0.00 -1.23 0.00 0.00 61.79 59.57 1ip9 h SER 68 Cb 0.72 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1ip9 h SER 68 CO 0.00 1.72 0.08 1.56 -0.53 0.00 0.00 176.83 179.66 1ip9 h GLN 69 N 0.09 0.84 -0.01 2.24 1.08 -0.88 0.53 115.11 119.01 1ip9 h GLN 69 Ca -0.28 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 56.70 1ip9 h GLN 69 Cb 2.11 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 29.43 1ip9 h GLN 69 CO 0.23 0.79 -0.08 0.28 -0.95 0.00 0.00 178.83 179.11 1ip9 h VAL 70 N 0.80 1.55 0.00 -0.54 2.07 -1.47 -0.53 116.25 118.14 1ip9 h VAL 70 Ca 0.17 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.96 1ip9 h VAL 70 Cb 0.37 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 1ip9 h VAL 70 CO 0.01 0.46 0.00 -1.20 0.02 0.00 0.00 177.57 176.86 1ip9 n SER 71 N -4.67 0.38 0.03 0.57 7.64 -0.52 -0.25 113.62 116.80 1ip9 n SER 71 Ca -0.09 0.62 -0.22 0.00 1.01 0.00 0.00 58.87 60.20 1ip9 n SER 71 Cb 0.39 -0.69 -0.14 0.00 -1.01 0.00 0.00 64.21 62.76 1ip9 n SER 71 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1ip9 h ASN 72 N 0.00 0.45 0.69 6.43 -1.24 0.33 -0.63 115.58 121.60 1ip9 h ASN 72 Ca 0.00 -0.88 0.00 0.00 0.71 0.00 0.00 56.30 56.13 1ip9 h ASN 72 Cb 0.19 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.10 1ip9 h ASN 72 CO 0.00 1.61 0.00 0.40 -1.29 0.00 0.00 177.43 178.15 1ip9 h ILE 73 N -0.25 0.00 0.20 2.57 5.03 0.09 0.11 117.51 125.26 1ip9 h ILE 73 Ca -0.28 -0.33 -0.30 0.00 -0.12 0.00 0.00 64.86 63.83 1ip9 h ILE 73 Cb 1.80 1.26 0.02 0.00 -3.03 0.00 0.00 36.82 36.88 1ip9 h ILE 73 CO 0.10 0.00 -1.41 0.40 -0.68 0.00 0.00 178.15 176.56 1ip9 h ILE 74 N 0.00 1.21 0.00 -0.67 2.04 -0.53 0.53 117.51 120.09 1ip9 h ILE 74 Ca 0.00 -2.58 0.00 0.00 1.00 0.00 0.00 64.86 63.28 1ip9 h ILE 74 Cb 0.34 2.97 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 1ip9 h ILE 74 CO 0.00 0.79 -0.10 -0.61 0.00 0.00 0.00 178.15 178.23 1ip9 h GLN 75 N -0.02 0.00 -0.01 2.37 4.15 -0.53 -3.23 115.11 117.84 1ip9 h GLN 75 Ca -0.26 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1ip9 h GLN 75 Cb 2.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.69 1ip9 h GLN 75 CO 0.20 0.00 0.00 0.00 -1.93 0.00 0.00 178.83 177.10 1ip9 n ALA 76 N -1.92 2.48 -3.41 3.38 0.00 0.33 -5.04 120.51 116.33 1ip9 n ALA 76 Ca 0.05 -0.55 -0.31 0.00 0.00 0.00 0.00 53.44 52.63 1ip9 n ALA 76 Cb 0.47 -0.14 0.03 0.00 0.00 0.00 0.00 19.45 19.81 1ip9 n ALA 76 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ip9 n LYS 77 N 0.23 -1.95 -4.20 0.00 4.81 0.17 -4.93 118.16 112.29 1ip9 n LYS 77 Ca 0.03 1.47 -0.35 0.00 -0.87 0.00 0.00 58.31 58.59 1ip9 n LYS 77 Cb 0.11 -2.84 -0.09 0.00 0.02 0.00 0.00 35.03 32.23 1ip9 n LYS 77 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1ip9 s LEU 78 N -2.85 3.71 0.15 3.14 2.01 -0.31 -5.00 118.68 119.54 1ip9 s LEU 78 Ca 0.30 0.13 -0.31 0.00 0.01 0.00 0.00 54.13 54.26 1ip9 s LEU 78 Cb -0.04 -1.89 -0.09 0.00 0.01 0.00 0.00 46.19 44.18 1ip9 s LEU 78 CO 0.86 0.29 1.41 -0.54 1.01 0.00 0.00 176.35 179.37 1ip9 s LYS 79 N -0.35 4.31 0.17 1.70 1.02 -1.26 -4.50 119.74 120.83 1ip9 s LYS 79 Ca 0.08 2.14 0.01 0.00 0.02 0.00 0.00 55.97 58.22 1ip9 s LYS 79 Cb -0.12 -3.21 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 1ip9 s LYS 79 CO 0.02 -0.42 0.33 0.42 -0.92 0.00 0.00 175.35 174.78 1ip9 s ILE 80 N 0.80 5.27 -0.07 2.17 -1.09 0.07 0.29 121.20 128.64 1ip9 s ILE 80 Ca 0.63 -0.53 0.05 0.00 -2.23 0.00 0.00 60.65 58.58 1ip9 s ILE 80 Cb -0.38 -3.74 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 1ip9 s ILE 80 CO 0.33 -0.13 -0.24 -0.55 -1.23 0.00 0.00 174.94 173.12 1ip9 s SER 81 N -3.19 3.03 -0.09 3.58 0.15 -0.36 0.23 113.70 117.06 1ip9 s SER 81 Ca 0.36 -0.52 0.01 0.00 0.70 0.00 0.00 55.95 56.51 1ip9 s SER 81 Cb -0.11 -1.01 -0.02 0.00 -1.71 0.00 0.00 66.02 63.17 1ip9 s SER 81 CO 0.29 0.21 -0.11 -0.69 1.20 0.00 0.00 173.24 174.14 1ip9 s VAL 82 N 0.00 3.27 0.35 4.45 1.01 -0.62 -1.58 120.40 127.29 1ip9 s VAL 82 Ca -0.08 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.34 1ip9 s VAL 82 Cb -0.15 -2.33 -0.07 0.00 0.00 0.00 0.00 36.38 33.83 1ip9 s VAL 82 CO 0.05 0.57 -0.02 -1.00 0.00 0.00 0.00 175.10 174.70 1ip9 s HIS 83 N -0.34 2.24 -0.19 5.22 3.76 -0.10 -2.47 115.29 123.42 1ip9 s HIS 83 Ca 0.04 -0.71 -0.12 0.00 -0.15 0.00 0.00 55.06 54.12 1ip9 s HIS 83 Cb -0.13 -1.44 -0.05 0.00 1.11 0.00 0.00 32.58 32.08 1ip9 s HIS 83 CO 0.02 0.34 0.23 -0.51 -0.85 0.00 0.00 174.74 173.98 1ip9 s ASP 84 N -3.58 6.32 0.00 1.40 1.11 -1.26 -1.32 116.67 119.34 1ip9 s ASP 84 Ca 0.34 0.37 0.00 0.00 0.18 0.00 0.00 52.55 53.43 1ip9 s ASP 84 Cb 0.07 -2.15 0.00 0.00 1.07 0.00 0.00 42.92 41.91 1ip9 s ASP 84 CO 0.16 0.11 0.15 2.30 1.18 0.00 0.00 175.17 179.06