#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ci2 n LYS 21 N 0.00 1.84 -0.75 1.96 4.76 -1.26 -4.82 118.16 119.89 3ci2 n LYS 21 Ca 0.00 -3.63 0.08 0.00 -2.87 0.00 0.00 58.31 51.89 3ci2 n LYS 21 Cb 0.00 -1.55 0.37 0.00 -1.84 0.00 0.00 35.03 32.01 3ci2 n LYS 21 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3ci2 n THR 22 N -0.20 2.36 -4.00 -0.18 -2.24 -1.26 -4.91 114.28 103.85 3ci2 n THR 22 Ca 0.18 -1.36 -0.09 0.00 -2.27 0.00 0.00 64.05 60.51 3ci2 n THR 22 Cb 0.78 -0.11 -0.11 0.00 -2.10 0.00 0.00 70.33 68.79 3ci2 n THR 22 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3ci2 s GLU 23 N -2.40 0.37 -0.47 -0.78 1.03 -1.26 0.15 118.70 115.34 3ci2 s GLU 23 Ca 0.52 -0.72 0.06 0.00 0.03 0.00 0.00 54.97 54.87 3ci2 s GLU 23 Cb 0.37 0.13 0.22 0.00 -0.80 0.00 0.00 34.13 34.06 3ci2 s GLU 23 CO 0.19 -0.06 0.52 0.91 -1.33 0.00 0.00 175.26 175.48 3ci2 n TRP 24 N 1.31 0.57 0.08 4.83 8.01 -0.50 -4.91 117.44 126.83 3ci2 n TRP 24 Ca -0.22 -3.68 -0.13 0.00 -1.31 0.00 0.00 57.50 52.16 3ci2 n TRP 24 Cb 0.56 -0.27 -0.07 0.00 -2.01 0.00 0.00 31.31 29.52 3ci2 n TRP 24 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 3ci2 h PRO 25 N 4.52 0.31 0.00 -0.99 0.13 -1.96 -3.25 132.00 130.77 3ci2 h PRO 25 Ca 0.15 -0.40 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3ci2 h PRO 25 Cb 0.83 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3ci2 h PRO 25 CO 0.53 1.11 0.00 1.05 -0.23 0.00 0.00 178.00 180.47 3ci2 h GLU 26 N 0.15 0.00 -0.65 0.86 9.09 -1.99 -0.69 114.58 121.35 3ci2 h GLU 26 Ca -0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.32 3ci2 h GLU 26 Cb 1.71 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.81 3ci2 h GLU 26 CO 0.17 0.00 0.00 1.47 0.05 0.00 0.00 179.01 180.70 3ci2 n LEU 27 N -2.91 4.49 -4.78 3.06 -0.00 -1.22 -4.96 117.00 110.68 3ci2 n LEU 27 Ca -0.02 -2.27 -0.30 0.00 -0.00 0.00 0.00 56.01 53.42 3ci2 n LEU 27 Cb 0.11 -0.57 0.10 0.00 -0.00 0.00 0.00 43.42 43.07 3ci2 n LEU 27 CO 0.20 0.73 0.70 -0.69 -0.00 0.00 0.00 177.39 178.33 3ci2 s VAL 28 N -1.90 3.02 0.00 1.47 1.01 -0.27 -3.94 120.40 119.80 3ci2 s VAL 28 Ca 0.47 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.78 3ci2 s VAL 28 Cb 0.31 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.69 3ci2 s VAL 28 CO 0.22 -0.43 0.00 0.61 0.00 0.00 0.00 175.10 175.50 3ci2 n GLY 29 N -1.83 0.84 3.39 4.51 0.00 -1.08 -4.98 105.19 106.04 3ci2 n GLY 29 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.90 3ci2 n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ci2 s LYS 30 N -0.19 1.51 0.47 1.61 1.02 -1.25 -4.88 119.74 118.03 3ci2 s LYS 30 Ca 0.00 -1.81 -0.05 0.00 0.02 0.00 0.00 55.97 54.13 3ci2 s LYS 30 Cb 0.00 -0.69 -0.04 0.00 -0.52 0.00 0.00 37.83 36.58 3ci2 s LYS 30 CO 0.00 -0.17 0.77 -1.54 -0.92 0.00 0.00 175.35 173.49 3ci2 s SER 31 N -3.40 6.25 0.22 2.83 1.04 -1.26 0.04 113.70 119.42 3ci2 s SER 31 Ca 0.34 0.89 -0.14 0.00 0.48 0.00 0.00 55.95 57.52 3ci2 s SER 31 Cb 0.07 -2.22 0.25 0.00 0.10 0.00 0.00 66.02 64.22 3ci2 s SER 31 CO 0.13 -0.56 1.61 1.62 0.98 0.00 0.00 173.24 177.01 3ci2 h VAL 32 N 0.26 0.26 -0.83 5.02 3.04 -1.40 -0.22 116.25 122.39 3ci2 h VAL 32 Ca -0.47 0.00 0.10 0.00 -1.01 0.00 0.00 66.70 65.32 3ci2 h VAL 32 Cb 1.21 0.26 -0.07 0.00 -2.01 0.00 0.00 31.29 30.68 3ci2 h VAL 32 CO 0.62 0.00 0.47 -0.33 -1.01 0.00 0.00 177.57 177.31 3ci2 h GLU 33 N -0.03 0.76 -0.19 4.17 4.39 -1.94 0.19 114.58 121.92 3ci2 h GLU 33 Ca 0.32 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.93 3ci2 h GLU 33 Cb 0.53 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3ci2 h GLU 33 CO -0.72 0.50 -0.03 0.93 -1.16 0.00 0.00 179.01 178.53 3ci2 h GLU 34 N 0.78 0.36 -0.46 2.33 4.39 -1.56 -2.30 114.58 118.12 3ci2 h GLU 34 Ca 0.40 -0.13 0.09 0.00 0.34 0.00 0.00 59.36 60.06 3ci2 h GLU 34 Cb 0.38 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 28.93 3ci2 h GLU 34 CO -0.25 0.60 -0.06 0.00 -1.16 0.00 0.00 179.01 178.13 3ci2 h ALA 35 N 0.75 0.36 -0.33 3.43 0.00 0.47 -0.99 119.26 122.95 3ci2 h ALA 35 Ca 0.05 0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.19 3ci2 h ALA 35 Cb 0.45 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 3ci2 h ALA 35 CO 0.02 -0.42 -0.10 0.87 0.00 0.00 0.00 179.25 179.62 3ci2 h LYS 36 N 0.05 -0.02 -0.64 0.00 1.57 -0.50 0.18 116.57 117.21 3ci2 h LYS 36 Ca 0.22 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.13 3ci2 h LYS 36 Cb 0.34 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.56 3ci2 h LYS 36 CO -0.43 -0.01 0.13 0.87 -0.57 0.00 0.00 179.45 179.44 3ci2 h LYS 37 N -0.02 0.24 0.66 3.15 1.57 -0.69 0.34 116.57 121.83 3ci2 h LYS 37 Ca 0.16 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 3ci2 h LYS 37 Cb 0.27 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.53 3ci2 h LYS 37 CO -0.35 0.16 -0.32 0.28 -0.57 0.00 0.00 179.45 178.65 3ci2 h VAL 38 N 0.25 0.32 -0.58 0.50 2.07 0.21 -2.65 116.25 116.38 3ci2 h VAL 38 Ca 0.34 -0.08 0.08 0.00 0.82 0.00 0.00 66.70 67.87 3ci2 h VAL 38 Cb 0.53 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 3ci2 h VAL 38 CO -0.44 0.01 0.22 0.40 0.02 0.00 0.00 177.57 177.78 3ci2 h ILE 39 N -0.95 0.80 -0.72 4.57 2.04 0.25 0.46 117.51 123.96 3ci2 h ILE 39 Ca -0.09 -0.14 0.05 0.00 1.00 0.00 0.00 64.86 65.68 3ci2 h ILE 39 Cb 0.70 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 3ci2 h ILE 39 CO 0.15 0.07 0.48 -0.07 0.00 0.00 0.00 178.15 178.78 3ci2 h LEU 40 N 0.41 0.70 -0.84 1.44 3.38 -0.38 0.37 115.31 120.39 3ci2 h LEU 40 Ca 0.29 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 3ci2 h LEU 40 Cb 0.33 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3ci2 h LEU 40 CO -0.28 0.47 0.26 -0.61 0.09 0.00 0.00 178.44 178.36 3ci2 h GLN 41 N 0.81 1.11 0.01 1.13 4.15 0.28 -0.96 115.11 121.65 3ci2 h GLN 41 Ca 0.30 -0.22 -0.11 0.00 0.77 0.00 0.00 58.65 59.39 3ci2 h GLN 41 Cb 0.17 -0.17 0.01 0.00 0.21 0.00 0.00 27.48 27.69 3ci2 h GLN 41 CO -0.09 0.93 -0.45 -0.44 -1.93 0.00 0.00 178.83 176.85 3ci2 h ASP 42 N 1.08 0.37 -2.16 -0.69 5.19 -0.59 -3.39 116.42 116.22 3ci2 h ASP 42 Ca 0.24 -0.80 -0.58 0.00 -0.62 0.00 0.00 57.03 55.27 3ci2 h ASP 42 Cb 0.26 -0.11 -0.41 0.00 0.18 0.00 0.00 39.33 39.24 3ci2 h ASP 42 CO -0.01 1.12 -0.74 1.17 -3.12 0.00 0.00 179.24 177.65 3ci2 n LYS 43 N -4.35 2.25 0.00 3.56 4.81 0.12 -5.03 118.16 119.52 3ci2 n LYS 43 Ca -0.10 -4.36 0.00 0.00 -0.87 0.00 0.00 58.31 52.98 3ci2 n LYS 43 Cb 0.61 -2.02 0.00 0.00 0.02 0.00 0.00 35.03 33.63 3ci2 n LYS 43 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3ci2 n PRO 44 N 0.64 0.00 -0.01 1.64 -0.02 -0.37 0.16 135.00 137.05 3ci2 n PRO 44 Ca 0.28 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 3ci2 n PRO 44 Cb 0.45 0.00 0.72 0.00 -0.02 0.00 0.00 33.50 34.65 3ci2 n PRO 44 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3ci2 n GLU 45 N -1.97 1.18 -1.53 -0.52 -0.00 -1.26 -4.83 120.64 111.71 3ci2 n GLU 45 Ca 0.00 -0.26 -0.13 0.00 -0.00 0.00 0.00 57.16 56.76 3ci2 n GLU 45 Cb 0.00 -1.43 -0.10 0.00 -0.00 0.00 0.00 31.44 29.91 3ci2 n GLU 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3ci2 n ALA 46 N -0.62 0.31 -2.22 -1.84 0.00 0.12 -4.78 120.51 111.49 3ci2 n ALA 46 Ca 0.20 -1.73 -0.43 0.00 0.00 0.00 0.00 53.44 51.48 3ci2 n ALA 46 Cb 0.16 -3.10 -0.02 0.00 0.00 0.00 0.00 19.45 16.48 3ci2 n ALA 46 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3ci2 s GLN 47 N 8.44 3.56 0.13 0.00 -0.44 0.14 -4.72 119.66 126.75 3ci2 s GLN 47 Ca 0.84 1.21 0.05 0.00 -2.50 0.00 0.00 55.36 54.96 3ci2 s GLN 47 Cb -0.12 -4.07 -0.04 0.00 -1.64 0.00 0.00 33.01 27.14 3ci2 s GLN 47 CO 0.15 -1.59 0.05 0.42 0.50 0.00 0.00 175.29 174.83 3ci2 s ILE 48 N 5.77 4.18 0.27 -2.34 1.01 -1.26 -4.03 121.20 124.79 3ci2 s ILE 48 Ca 0.68 -1.07 0.08 0.00 0.00 0.00 0.00 60.65 60.34 3ci2 s ILE 48 Cb -0.18 -3.06 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 3ci2 s ILE 48 CO 0.32 0.01 -0.10 -0.63 0.00 0.00 0.00 174.94 174.54 3ci2 s ILE 49 N -1.54 1.83 -0.26 2.92 -1.09 -1.24 -5.00 121.20 116.83 3ci2 s ILE 49 Ca 0.28 -2.19 -0.07 0.00 -2.23 0.00 0.00 60.65 56.44 3ci2 s ILE 49 Cb -0.11 -2.36 -0.02 0.00 -1.58 0.00 0.00 42.46 38.40 3ci2 s ILE 49 CO 0.20 -0.37 0.07 0.54 -1.23 0.00 0.00 174.94 174.15 3ci2 s VAL 50 N -2.90 4.21 -0.03 2.92 0.11 -1.26 -3.49 120.40 119.97 3ci2 s VAL 50 Ca 0.28 -0.31 0.04 0.00 -2.93 0.00 0.00 61.98 59.06 3ci2 s VAL 50 Cb 0.01 -3.02 -0.00 0.00 -1.53 0.00 0.00 36.38 31.84 3ci2 s VAL 50 CO 0.12 0.27 -0.14 -0.76 -3.33 0.00 0.00 175.10 171.26 3ci2 s LEU 51 N 1.59 1.90 0.19 2.54 1.02 -1.18 -5.04 118.68 119.70 3ci2 s LEU 51 Ca 0.06 -0.28 -0.30 0.00 0.02 0.00 0.00 54.13 53.63 3ci2 s LEU 51 Cb -0.16 -0.79 -0.08 0.00 0.02 0.00 0.00 46.19 45.19 3ci2 s LEU 51 CO 0.03 0.13 1.12 -2.16 0.02 0.00 0.00 176.35 175.50 3ci2 s PRO 52 N -0.00 4.57 -0.13 1.29 0.04 -1.26 -0.70 135.00 138.81 3ci2 s PRO 52 Ca -0.01 1.76 -0.41 0.00 0.04 0.00 0.00 61.00 62.38 3ci2 s PRO 52 Cb -0.09 -3.26 -0.19 0.00 0.04 0.00 0.00 34.50 31.00 3ci2 s PRO 52 CO 0.01 0.05 1.35 0.28 0.04 0.00 0.00 177.00 178.73 3ci2 n VAL 53 N 2.31 0.04 0.00 -0.36 0.31 0.15 -2.13 118.33 118.65 3ci2 n VAL 53 Ca 0.03 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 3ci2 n VAL 53 Cb 0.46 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.90 3ci2 n VAL 53 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ci2 n GLY 54 N 2.69 3.01 3.18 2.92 0.00 -1.26 -5.04 105.19 110.70 3ci2 n GLY 54 Ca 0.23 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.80 3ci2 n GLY 54 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ci2 n THR 55 N 0.00 0.00 -1.65 2.61 -1.04 -0.91 -4.77 114.28 108.51 3ci2 n THR 55 Ca 0.00 -0.21 -0.49 0.00 -2.04 0.00 0.00 64.05 61.32 3ci2 n THR 55 Cb 0.00 -0.38 -0.05 0.00 -1.82 0.00 0.00 70.33 68.08 3ci2 n THR 55 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3ci2 n ILE 56 N -3.98 0.52 0.00 12.58 2.08 -1.26 -4.87 119.36 124.43 3ci2 n ILE 56 Ca 0.00 -0.14 0.00 0.00 0.56 0.00 0.00 62.75 63.17 3ci2 n ILE 56 Cb 0.66 -1.88 0.00 0.00 -0.75 0.00 0.00 39.64 37.66 3ci2 n ILE 56 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 3ci2 n VAL 57 N 5.53 0.00 -2.64 1.39 0.31 -1.26 -4.95 118.33 116.71 3ci2 n VAL 57 Ca 0.25 0.04 -0.43 0.00 -0.01 0.00 0.00 64.34 64.18 3ci2 n VAL 57 Cb 0.29 -0.77 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 3ci2 n VAL 57 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3ci2 n THR 58 N -1.51 4.06 0.00 2.52 -1.04 -1.26 -4.76 114.28 112.29 3ci2 n THR 58 Ca 0.00 -4.28 0.00 0.00 -2.04 0.00 0.00 64.05 57.73 3ci2 n THR 58 Cb 0.00 -2.41 0.00 0.00 -1.82 0.00 0.00 70.33 66.10 3ci2 n THR 58 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 3ci2 n MET 59 N 6.86 0.00 -0.09 -2.82 1.56 -1.26 -5.10 117.12 116.27 3ci2 n MET 59 Ca 0.44 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.87 3ci2 n MET 59 Cb 0.44 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.81 3ci2 n MET 59 CO 0.00 0.00 0.00 -0.85 -0.73 0.00 0.00 175.97 174.39 3ci2 n GLU 60 N 0.00 0.15 -3.97 2.12 0.00 -1.26 -5.05 120.64 112.63 3ci2 n GLU 60 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.83 3ci2 n GLU 60 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 31.44 31.30 3ci2 n GLU 60 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 3ci2 s TYR 61 N -0.76 3.60 -1.26 -1.84 5.04 -1.26 -5.00 117.35 115.87 3ci2 s TYR 61 Ca 0.00 -2.67 -0.08 0.00 -2.44 0.00 0.00 57.07 51.88 3ci2 s TYR 61 Cb 0.00 -2.75 0.18 0.00 0.35 0.00 0.00 41.96 39.73 3ci2 s TYR 61 CO 0.00 -0.93 1.91 0.54 -1.34 0.00 0.00 175.55 175.73 3ci2 n ARG 62 N 4.39 3.88 -0.53 4.97 3.00 -1.26 -4.78 116.66 126.34 3ci2 n ARG 62 Ca -0.02 -3.64 0.45 0.00 -0.01 0.00 0.00 57.85 54.63 3ci2 n ARG 62 Cb 0.42 -2.83 0.75 0.00 0.00 0.00 0.00 32.46 30.80 3ci2 n ARG 62 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 3ci2 h ILE 63 N 3.51 0.11 0.00 0.55 6.09 -1.92 0.41 117.51 126.27 3ci2 h ILE 63 Ca 0.42 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.91 3ci2 h ILE 63 Cb 0.57 0.12 0.00 0.00 0.47 0.00 0.00 36.82 37.98 3ci2 h ILE 63 CO 1.57 0.00 0.13 -2.24 -3.07 0.00 0.00 178.15 174.54 3ci2 h ASP 64 N 0.00 0.00 -4.55 2.19 3.04 -1.92 -3.43 116.42 111.76 3ci2 h ASP 64 Ca 0.77 0.00 -0.38 0.00 -3.24 0.00 0.00 57.03 54.18 3ci2 h ASP 64 Cb 3.24 0.00 -0.22 0.00 -1.04 0.00 0.00 39.33 41.31 3ci2 h ASP 64 CO -0.01 0.00 -0.77 -0.60 -2.04 0.00 0.00 179.24 175.82 3ci2 s ARG 65 N -3.80 0.74 -0.09 4.15 3.52 0.14 0.26 118.95 123.88 3ci2 s ARG 65 Ca -0.03 -0.88 -0.02 0.00 -0.13 0.00 0.00 55.73 54.66 3ci2 s ARG 65 Cb 0.08 -0.68 -0.03 0.00 -1.56 0.00 0.00 34.95 32.76 3ci2 s ARG 65 CO 0.26 0.15 0.01 0.08 -0.81 0.00 0.00 175.30 174.98 3ci2 s VAL 66 N -1.27 4.34 -0.24 7.11 1.01 -1.26 -1.05 120.40 129.04 3ci2 s VAL 66 Ca -0.04 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 3ci2 s VAL 66 Cb -0.10 -2.83 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 3ci2 s VAL 66 CO 0.02 0.60 0.20 -0.60 0.00 0.00 0.00 175.10 175.31 3ci2 s ARG 67 N -0.82 4.08 -0.68 2.72 6.06 -0.37 -3.67 118.95 126.28 3ci2 s ARG 67 Ca 0.13 -0.20 -0.06 0.00 -2.50 0.00 0.00 55.73 53.10 3ci2 s ARG 67 Cb -0.11 -3.55 0.18 0.00 0.06 0.00 0.00 34.95 31.52 3ci2 s ARG 67 CO 0.02 0.03 0.52 -0.51 -2.50 0.00 0.00 175.30 172.86 3ci2 s LEU 68 N 1.15 5.62 -0.34 -0.88 1.02 -1.23 -2.80 118.68 121.23 3ci2 s LEU 68 Ca 0.09 -2.81 -0.29 0.00 0.02 0.00 0.00 54.13 51.14 3ci2 s LEU 68 Cb -0.14 -1.95 -0.01 0.00 0.02 0.00 0.00 46.19 44.12 3ci2 s LEU 68 CO 0.05 -0.42 1.61 -0.36 0.02 0.00 0.00 176.35 177.26 3ci2 s PHE 69 N -0.01 2.09 0.43 0.29 0.08 -1.26 -3.08 117.98 116.53 3ci2 s PHE 69 Ca 0.17 0.63 0.08 0.00 0.12 0.00 0.00 56.93 57.93 3ci2 s PHE 69 Cb -0.18 -4.16 0.00 0.00 -0.57 0.00 0.00 43.02 38.11 3ci2 s PHE 69 CO -0.05 -2.57 0.50 0.14 -0.10 0.00 0.00 175.22 173.14 3ci2 s VAL 70 N 6.00 2.76 0.00 -0.44 -7.23 0.13 -1.87 120.40 119.74 3ci2 s VAL 70 Ca 0.71 -1.16 0.00 0.00 -1.81 0.00 0.00 61.98 59.72 3ci2 s VAL 70 Cb -0.20 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 33.82 3ci2 s VAL 70 CO 0.32 0.00 0.00 -0.90 -0.31 0.00 0.00 175.10 174.21 3ci2 n ASP 71 N -1.74 0.00 -0.76 4.85 5.75 0.22 0.32 116.55 125.19 3ci2 n ASP 71 Ca 0.06 0.00 0.09 0.00 -0.01 0.00 0.00 54.79 54.94 3ci2 n ASP 71 Cb 0.60 0.00 0.27 0.00 -1.03 0.00 0.00 41.12 40.97 3ci2 n ASP 71 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 3ci2 n LYS 72 N 0.00 1.97 -1.63 0.11 0.00 -1.26 -3.67 118.16 113.68 3ci2 n LYS 72 Ca 0.00 -1.49 0.03 0.00 0.00 0.00 0.00 58.31 56.85 3ci2 n LYS 72 Cb 0.00 -1.39 0.05 0.00 0.00 0.00 0.00 35.03 33.69 3ci2 n LYS 72 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 3ci2 n LEU 73 N 0.70 1.45 -2.36 3.14 4.77 -1.26 -5.00 117.00 118.44 3ci2 n LEU 73 Ca 0.16 -2.52 -0.07 0.00 -0.03 0.00 0.00 56.01 53.56 3ci2 n LEU 73 Cb 0.39 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 3ci2 n LEU 73 CO 0.12 0.76 -0.02 -0.67 -1.33 0.00 0.00 177.39 176.25 3ci2 n ASP 74 N 0.06 -0.87 -4.61 -1.43 -0.08 -1.24 -4.88 116.55 103.49 3ci2 n ASP 74 Ca 0.09 0.11 -0.34 0.00 -1.51 0.00 0.00 54.79 53.14 3ci2 n ASP 74 Cb 1.02 -0.84 -0.11 0.00 2.34 0.00 0.00 41.12 43.54 3ci2 n ASP 74 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 3ci2 s ASN 75 N -1.74 4.96 -0.20 1.67 0.01 -1.26 -0.93 114.94 117.44 3ci2 s ASN 75 Ca 0.13 0.04 -0.28 0.00 -0.71 0.00 0.00 52.86 52.03 3ci2 s ASN 75 Cb -0.07 -1.43 -0.05 0.00 0.41 0.00 0.00 41.25 40.10 3ci2 s ASN 75 CO 0.16 0.33 2.11 -0.63 -1.51 0.00 0.00 177.10 177.56 3ci2 s ILE 76 N -0.60 3.10 -0.18 0.60 1.01 0.11 -0.61 121.20 124.62 3ci2 s ILE 76 Ca 0.10 0.10 -0.17 0.00 0.00 0.00 0.00 60.65 60.68 3ci2 s ILE 76 Cb -0.12 -3.12 -0.21 0.00 0.01 0.00 0.00 42.46 39.02 3ci2 s ILE 76 CO 0.02 -0.07 0.25 0.00 0.00 0.00 0.00 174.94 175.14 3ci2 n ALA 77 N 10.90 0.82 -2.52 9.38 0.00 -1.06 -2.64 120.51 135.40 3ci2 n ALA 77 Ca 0.27 -0.53 -0.25 0.00 0.00 0.00 0.00 53.44 52.93 3ci2 n ALA 77 Cb 0.45 -0.58 -0.10 0.00 0.00 0.00 0.00 19.45 19.22 3ci2 n ALA 77 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3ci2 s GLN 78 N -2.43 1.86 0.29 0.00 0.74 -0.78 -5.02 119.66 114.33 3ci2 s GLN 78 Ca -0.27 -1.51 -0.29 0.00 0.05 0.00 0.00 55.36 53.34 3ci2 s GLN 78 Cb 0.06 -1.97 -0.09 0.00 1.10 0.00 0.00 33.01 32.11 3ci2 s GLN 78 CO 0.64 0.38 1.06 0.08 -0.55 0.00 0.00 175.29 176.91 3ci2 s VAL 79 N -2.06 3.62 0.51 1.34 1.01 -1.26 -4.60 120.40 118.96 3ci2 s VAL 79 Ca 0.27 1.56 -0.09 0.00 0.00 0.00 0.00 61.98 63.72 3ci2 s VAL 79 Cb -0.07 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 3ci2 s VAL 79 CO 0.15 0.32 0.88 -2.84 0.00 0.00 0.00 175.10 173.60 3ci2 s PRO 80 N -1.58 3.63 0.08 2.72 0.02 -1.26 -4.77 135.00 133.85 3ci2 s PRO 80 Ca 0.46 0.48 -0.23 0.00 0.02 0.00 0.00 61.00 61.73 3ci2 s PRO 80 Cb -0.29 -2.27 0.06 0.00 0.02 0.00 0.00 34.50 32.02 3ci2 s PRO 80 CO 0.37 -0.30 0.54 1.03 -0.33 0.00 0.00 177.00 178.32 3ci2 s ARG 81 N -4.68 1.12 0.38 5.54 3.00 -1.12 -1.41 118.95 121.77 3ci2 s ARG 81 Ca 0.51 -0.33 -0.25 0.00 0.00 0.00 0.00 55.73 55.67 3ci2 s ARG 81 Cb -0.10 0.51 -0.09 0.00 0.00 0.00 0.00 34.95 35.27 3ci2 s ARG 81 CO 0.44 -0.43 1.06 0.08 0.00 0.00 0.00 175.30 176.45 3ci2 s VAL 82 N -2.92 3.66 0.00 3.52 1.01 0.12 -1.23 120.40 124.56 3ci2 s VAL 82 Ca -0.03 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.30 3ci2 s VAL 82 Cb -0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 3ci2 s VAL 82 CO -0.06 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.73