#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 4.39 -1.28 1.47 0.00 -1.26 -4.62 118.16 116.86 3ci2 n LYS 21 Ca 0.00 -4.24 -0.26 0.00 0.00 0.00 0.00 58.31 53.81 3ci2 n LYS 21 Cb 0.00 -2.39 0.13 0.00 0.00 0.00 0.00 35.03 32.77 3ci2 n LYS 21 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 3ci2 n THR 22 N -0.25 3.27 -3.63 3.15 -2.24 -1.26 -4.91 114.28 108.41 3ci2 n THR 22 Ca 0.49 -2.62 -0.15 0.00 -2.27 0.00 0.00 64.05 59.51 3ci2 n THR 22 Cb 0.25 -0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 67.62 3ci2 n THR 22 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3ci2 s GLU 23 N -3.54 0.90 -0.41 -0.78 2.56 -1.26 -0.39 118.70 115.77 3ci2 s GLU 23 Ca 0.59 -0.08 0.04 0.00 0.00 0.00 0.00 54.97 55.51 3ci2 s GLU 23 Cb 0.48 0.41 0.17 0.00 2.00 0.00 0.00 34.13 37.19 3ci2 s GLU 23 CO 0.04 -0.29 0.33 -1.58 -0.56 0.00 0.00 175.26 173.20 3ci2 s TRP 24 N -1.67 1.11 0.06 5.30 0.51 -0.86 -4.95 118.94 118.43 3ci2 s TRP 24 Ca -0.10 -2.29 -0.03 0.00 -2.12 0.00 0.00 56.10 51.57 3ci2 s TRP 24 Cb -0.02 -0.96 -0.28 0.00 -0.81 0.00 0.00 33.47 31.41 3ci2 s TRP 24 CO 0.04 -0.82 1.06 -1.00 -0.51 0.00 0.00 176.95 175.72 3ci2 h PRO 25 N 5.76 0.24 0.00 4.98 0.13 -1.95 -3.33 132.00 137.83 3ci2 h PRO 25 Ca 0.25 -0.41 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3ci2 h PRO 25 Cb 0.91 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3ci2 h PRO 25 CO 0.37 1.16 0.14 1.05 -0.23 0.00 0.00 178.00 180.49 3ci2 h GLU 26 N 0.07 0.00 -0.40 0.86 9.09 -2.00 -1.61 114.58 120.58 3ci2 h GLU 26 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 3ci2 h GLU 26 Cb 1.97 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.07 3ci2 h GLU 26 CO 0.18 0.00 0.00 1.47 0.05 0.00 0.00 179.01 180.71 3ci2 n LEU 27 N -2.61 4.27 -4.60 3.06 -0.00 -1.25 -5.04 117.00 110.83 3ci2 n LEU 27 Ca -0.02 -2.76 -0.29 0.00 -0.00 0.00 0.00 56.01 52.95 3ci2 n LEU 27 Cb 0.19 -0.53 0.21 0.00 -0.00 0.00 0.00 43.42 43.28 3ci2 n LEU 27 CO 0.13 0.70 0.59 -0.69 -0.00 0.00 0.00 177.39 178.12 3ci2 s VAL 28 N -2.38 2.08 -1.67 1.47 1.01 -0.61 -3.62 120.40 116.66 3ci2 s VAL 28 Ca 0.43 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.44 3ci2 s VAL 28 Cb 0.32 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 34.38 3ci2 s VAL 28 CO 0.14 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.82 3ci2 n GLY 29 N -0.27 1.50 3.43 4.51 0.00 -0.61 -4.89 105.19 108.86 3ci2 n GLY 29 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.31 1.55 0.44 1.61 1.02 -1.24 -4.81 119.74 115.01 3ci2 s LYS 30 Ca 0.00 -1.63 -0.04 0.00 0.02 0.00 0.00 55.97 54.32 3ci2 s LYS 30 Cb 0.00 -1.70 -0.04 0.00 -0.52 0.00 0.00 37.83 35.57 3ci2 s LYS 30 CO 0.00 0.34 0.72 -1.54 -0.92 0.00 0.00 175.35 173.95 3ci2 s SER 31 N -3.10 6.28 0.23 2.83 1.04 -1.26 0.37 113.70 120.09 3ci2 s SER 31 Ca 0.25 0.82 -0.18 0.00 0.48 0.00 0.00 55.95 57.32 3ci2 s SER 31 Cb -0.06 -2.20 0.24 0.00 0.10 0.00 0.00 66.02 64.10 3ci2 s SER 31 CO 0.12 -0.50 1.55 1.62 0.98 0.00 0.00 173.24 177.01 3ci2 h VAL 32 N 0.40 0.00 -0.40 5.02 3.04 -1.21 -1.08 116.25 122.02 3ci2 h VAL 32 Ca -0.48 0.00 0.06 0.00 -1.01 0.00 0.00 66.70 65.27 3ci2 h VAL 32 Cb 1.21 0.00 -0.05 0.00 -2.01 0.00 0.00 31.29 30.44 3ci2 h VAL 32 CO 0.62 0.00 0.09 -0.33 -1.01 0.00 0.00 177.57 176.94 3ci2 h GLU 33 N -0.00 0.22 -0.61 4.17 4.39 -1.94 0.41 114.58 121.21 3ci2 h GLU 33 Ca 0.35 -0.01 0.12 0.00 0.34 0.00 0.00 59.36 60.15 3ci2 h GLU 33 Cb 0.60 -0.05 -0.09 0.00 -0.10 0.00 0.00 28.75 29.10 3ci2 h GLU 33 CO -0.99 0.14 0.09 1.49 -1.16 0.00 0.00 179.01 178.59 3ci2 h GLU 34 N 0.22 0.21 -0.16 2.33 4.22 -1.62 0.17 114.58 119.95 3ci2 h GLU 34 Ca 0.19 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.60 3ci2 h GLU 34 Cb 0.22 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3ci2 h GLU 34 CO -0.24 0.14 0.03 0.00 -2.18 0.00 0.00 179.01 176.76 3ci2 h ALA 35 N 1.51 0.21 -0.51 2.92 0.00 -0.06 -1.92 119.26 121.41 3ci2 h ALA 35 Ca 0.32 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.19 3ci2 h ALA 35 Cb 0.50 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.13 3ci2 h ALA 35 CO -0.44 -0.15 -0.16 0.87 0.00 0.00 0.00 179.25 179.37 3ci2 h LYS 36 N 0.05 -0.03 -0.33 0.00 1.57 0.96 0.18 116.57 118.97 3ci2 h LYS 36 Ca 0.05 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.90 3ci2 h LYS 36 Cb 0.27 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.51 3ci2 h LYS 36 CO 0.00 -0.02 -0.36 -0.22 -0.57 0.00 0.00 179.45 178.28 3ci2 h LYS 37 N -0.04 -0.30 0.43 3.15 3.64 -0.55 0.32 116.57 123.21 3ci2 h LYS 37 Ca 0.24 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 3ci2 h LYS 37 Cb 0.41 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 3ci2 h LYS 37 CO -0.54 -0.20 -0.21 0.28 -2.27 0.00 0.00 179.45 176.51 3ci2 h VAL 38 N -0.32 0.57 -0.13 2.00 2.07 -0.23 -1.71 116.25 118.49 3ci2 h VAL 38 Ca 0.14 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.69 3ci2 h VAL 38 Cb 0.56 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 3ci2 h VAL 38 CO -0.50 0.00 -0.03 0.40 0.02 0.00 0.00 177.57 177.45 3ci2 h ILE 39 N -0.58 0.86 -0.74 4.57 2.04 -0.15 0.35 117.51 123.86 3ci2 h ILE 39 Ca -0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.87 3ci2 h ILE 39 Cb 0.45 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 3ci2 h ILE 39 CO 0.09 0.00 0.49 -0.07 0.00 0.00 0.00 178.15 178.66 3ci2 h LEU 40 N -0.00 0.67 -0.56 1.44 3.38 -0.39 0.27 115.31 120.12 3ci2 h LEU 40 Ca 0.06 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.06 3ci2 h LEU 40 Cb 0.10 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 3ci2 h LEU 40 CO -0.14 0.43 0.34 -0.61 0.09 0.00 0.00 178.44 178.55 3ci2 h GLN 41 N 0.76 0.66 -0.05 1.13 4.15 0.59 -0.88 115.11 121.47 3ci2 h GLN 41 Ca 0.32 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.68 3ci2 h GLN 41 Cb 0.29 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 27.83 3ci2 h GLN 41 CO -0.11 0.44 -0.08 -0.44 -1.93 0.00 0.00 178.83 176.71 3ci2 h ASP 42 N 0.68 0.16 -2.13 -0.69 5.19 0.32 -3.38 116.42 116.58 3ci2 h ASP 42 Ca 0.22 -0.53 -0.58 0.00 -0.62 0.00 0.00 57.03 55.52 3ci2 h ASP 42 Cb 0.01 -0.05 -0.41 0.00 0.18 0.00 0.00 39.33 39.07 3ci2 h ASP 42 CO -0.09 0.66 -0.79 1.17 -3.12 0.00 0.00 179.24 177.07 3ci2 n LYS 43 N -4.70 1.96 0.00 3.56 4.81 0.79 -5.02 118.16 119.56 3ci2 n LYS 43 Ca -0.08 -4.17 0.00 0.00 -0.87 0.00 0.00 58.31 53.19 3ci2 n LYS 43 Cb 0.32 -1.90 0.00 0.00 0.02 0.00 0.00 35.03 33.47 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 0.86 0.00 0.00 1.64 -0.02 -0.34 -0.02 135.00 137.13 3ci2 n PRO 44 Ca 0.27 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.89 3ci2 n PRO 44 Cb 0.46 0.00 0.50 0.00 -0.02 0.00 0.00 33.50 34.44 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 -2.46 0.69 -1.52 -0.52 -0.00 -1.26 -4.86 120.64 110.71 3ci2 n GLU 45 Ca 0.00 -0.32 -0.33 0.00 -0.00 0.00 0.00 57.16 56.51 3ci2 n GLU 45 Cb 0.00 -1.49 -0.13 0.00 -0.00 0.00 0.00 31.44 29.82 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 -0.88 0.58 -2.44 -1.84 0.00 0.97 -4.82 120.51 112.08 3ci2 n ALA 46 Ca 0.13 -0.66 -0.39 0.00 0.00 0.00 0.00 53.44 52.52 3ci2 n ALA 46 Cb 0.31 -2.62 -0.03 0.00 0.00 0.00 0.00 19.45 17.11 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 8.42 3.27 -0.36 0.00 -0.44 0.41 -4.79 119.66 126.16 3ci2 s GLN 47 Ca 1.22 -0.65 -0.19 0.00 -2.50 0.00 0.00 55.36 53.25 3ci2 s GLN 47 Cb -0.81 -4.94 0.00 0.00 -1.64 0.00 0.00 33.01 25.62 3ci2 s GLN 47 CO 0.41 -2.40 0.54 0.42 0.50 0.00 0.00 175.29 174.76 3ci2 s ILE 48 N 6.22 4.98 0.06 -2.34 1.01 -1.26 -3.83 121.20 126.05 3ci2 s ILE 48 Ca 0.48 0.34 0.01 0.00 0.00 0.00 0.00 60.65 61.49 3ci2 s ILE 48 Cb -0.04 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 3ci2 s ILE 48 CO 0.00 -0.27 0.15 -0.63 0.00 0.00 0.00 174.94 174.20 3ci2 s ILE 49 N 2.47 5.04 0.16 2.92 -1.09 -1.26 -4.95 121.20 124.49 3ci2 s ILE 49 Ca 0.20 -0.53 0.03 0.00 -2.23 0.00 0.00 60.65 58.11 3ci2 s ILE 49 Cb -0.15 -3.44 -0.03 0.00 -1.58 0.00 0.00 42.46 37.25 3ci2 s ILE 49 CO 0.14 0.15 0.30 0.54 -1.23 0.00 0.00 174.94 174.83 3ci2 s VAL 50 N -1.45 5.31 -0.05 2.92 0.11 -1.26 -3.27 120.40 122.72 3ci2 s VAL 50 Ca 0.32 -0.72 -0.02 0.00 -2.93 0.00 0.00 61.98 58.63 3ci2 s VAL 50 Cb -0.13 -3.76 0.03 0.00 -1.53 0.00 0.00 36.38 31.00 3ci2 s VAL 50 CO 0.25 -0.13 0.11 -0.76 -3.33 0.00 0.00 175.10 171.24 3ci2 s LEU 51 N -3.34 1.01 -0.28 2.54 1.43 -0.19 -4.89 118.68 114.97 3ci2 s LEU 51 Ca 0.35 0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 53.37 3ci2 s LEU 51 Cb -0.11 0.24 -0.01 0.00 0.03 0.00 0.00 46.19 46.34 3ci2 s LEU 51 CO 0.29 -0.12 1.51 -2.16 0.23 0.00 0.00 176.35 176.10 3ci2 s PRO 52 N 0.91 3.77 -0.31 1.29 0.04 -1.26 -1.10 135.00 138.34 3ci2 s PRO 52 Ca -0.07 1.43 -0.44 0.00 0.04 0.00 0.00 61.00 61.96 3ci2 s PRO 52 Cb -0.10 -4.00 -0.19 0.00 0.04 0.00 0.00 34.50 30.25 3ci2 s PRO 52 CO -0.04 -1.32 1.47 0.28 0.04 0.00 0.00 177.00 177.43 3ci2 n VAL 53 N 6.51 0.04 0.00 -0.36 0.31 0.20 -1.39 118.33 123.64 3ci2 n VAL 53 Ca 0.18 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 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 3.29 2.51 3.31 2.92 0.00 -1.26 -4.97 105.19 110.98 3ci2 n GLY 54 Ca 0.27 -0.90 -0.28 0.00 0.00 0.00 0.00 46.02 45.11 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 0.01 -1.64 2.61 -1.04 -0.48 -4.90 114.28 108.84 3ci2 n THR 55 Ca 0.00 -0.01 -0.38 0.00 -2.04 0.00 0.00 64.05 61.62 3ci2 n THR 55 Cb 0.00 -1.81 0.04 0.00 -1.82 0.00 0.00 70.33 66.74 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 6.23 3.49 -1.57 12.58 2.08 -1.26 -4.93 119.36 135.98 3ci2 n ILE 56 Ca 0.29 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 63.10 3ci2 n ILE 56 Cb 0.26 -1.24 0.00 0.00 -0.75 0.00 0.00 39.64 37.91 3ci2 n ILE 56 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 3ci2 n VAL 57 N -1.39 0.00 -2.93 1.39 0.24 -1.26 -5.17 118.33 109.21 3ci2 n VAL 57 Ca 0.12 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.13 3ci2 n VAL 57 Cb 0.45 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.80 3ci2 n VAL 57 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3ci2 s THR 58 N 2.25 4.85 -0.38 3.34 -4.23 -1.26 -5.02 115.64 115.18 3ci2 s THR 58 Ca 0.00 0.46 0.01 0.00 -1.18 0.00 0.00 61.69 60.98 3ci2 s THR 58 Cb 0.00 -3.75 0.39 0.00 1.34 0.00 0.00 72.50 70.49 3ci2 s THR 58 CO 0.00 -0.52 1.82 0.23 -0.54 0.00 0.00 174.62 175.61 3ci2 n MET 59 N -1.33 2.01 -1.29 3.99 2.81 -1.26 -4.96 117.12 117.08 3ci2 n MET 59 Ca 0.01 -2.18 -0.18 0.00 -1.81 0.00 0.00 57.70 53.55 3ci2 n MET 59 Cb 0.54 -1.85 0.12 0.00 -0.71 0.00 0.00 33.22 31.32 3ci2 n MET 59 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 3ci2 n GLU 60 N -0.42 -0.65 -2.90 0.03 0.28 -1.26 -5.05 120.64 110.66 3ci2 n GLU 60 Ca 0.43 -1.35 -0.20 0.00 -0.16 0.00 0.00 57.16 55.87 3ci2 n GLU 60 Cb 0.99 -0.78 -0.02 0.00 1.43 0.00 0.00 31.44 33.06 3ci2 n GLU 60 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 3ci2 n TYR 61 N -3.01 1.92 -2.19 -1.84 4.19 -1.26 -4.85 117.16 110.12 3ci2 n TYR 61 Ca 0.10 -3.54 -0.42 0.00 3.31 0.00 0.00 57.90 57.35 3ci2 n TYR 61 Cb 0.36 -0.38 0.00 0.00 0.49 0.00 0.00 39.34 39.82 3ci2 n TYR 61 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 3ci2 n ARG 62 N -0.05 3.84 0.07 2.98 5.12 -1.26 -4.58 116.66 122.78 3ci2 n ARG 62 Ca 0.25 -3.43 0.21 0.00 -1.93 0.00 0.00 57.85 52.95 3ci2 n ARG 62 Cb 0.62 -2.86 0.74 0.00 -1.16 0.00 0.00 32.46 29.80 3ci2 n ARG 62 CO 0.00 0.00 0.00 0.97 -1.93 0.00 0.00 177.63 176.67 3ci2 h ILE 63 N 3.44 0.42 0.00 0.55 6.09 -1.87 0.55 117.51 126.70 3ci2 h ILE 63 Ca 0.49 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.98 3ci2 h ILE 63 Cb 0.54 0.66 0.00 0.00 0.47 0.00 0.00 36.82 38.49 3ci2 h ILE 63 CO 1.61 0.00 0.00 -0.90 -3.07 0.00 0.00 178.15 175.79 3ci2 n ASP 64 N -3.81 0.00 -4.01 2.19 5.68 -1.26 -4.78 116.55 110.56 3ci2 n ASP 64 Ca 0.08 0.35 -0.09 0.00 -0.50 0.00 0.00 54.79 54.62 3ci2 n ASP 64 Cb 0.62 -0.36 -0.11 0.00 -1.14 0.00 0.00 41.12 40.13 3ci2 n ASP 64 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3ci2 s ARG 65 N -2.72 0.38 -0.55 0.11 3.52 0.19 0.15 118.95 120.04 3ci2 s ARG 65 Ca 0.01 -0.72 -0.01 0.00 -0.13 0.00 0.00 55.73 54.88 3ci2 s ARG 65 Cb 0.01 0.08 0.14 0.00 -1.56 0.00 0.00 34.95 33.62 3ci2 s ARG 65 CO 0.02 -0.05 0.34 0.08 -0.81 0.00 0.00 175.30 174.88 3ci2 s VAL 66 N -1.84 3.26 -0.15 7.11 1.01 -1.26 -3.81 120.40 124.73 3ci2 s VAL 66 Ca -0.12 -2.91 -0.39 0.00 0.00 0.00 0.00 61.98 58.57 3ci2 s VAL 66 Cb -0.07 -3.19 -0.16 0.00 0.00 0.00 0.00 36.38 32.97 3ci2 s VAL 66 CO -0.02 -0.82 1.63 -1.14 0.00 0.00 0.00 175.10 174.75 3ci2 n ARG 67 N 3.57 1.23 -3.78 2.72 0.63 0.37 -4.50 116.66 116.89 3ci2 n ARG 67 Ca 0.06 0.45 -0.33 0.00 -0.92 0.00 0.00 57.85 57.10 3ci2 n ARG 67 Cb 0.37 -2.13 -0.10 0.00 0.45 0.00 0.00 32.46 31.05 3ci2 n ARG 67 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 3ci2 s LEU 68 N 2.62 5.09 -0.44 6.15 2.96 -1.20 -2.41 118.68 131.45 3ci2 s LEU 68 Ca 0.94 -3.46 -0.28 0.00 -0.22 0.00 0.00 54.13 51.10 3ci2 s LEU 68 Cb -1.01 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 43.91 3ci2 s LEU 68 CO 0.59 -0.20 1.53 -0.36 -1.32 0.00 0.00 176.35 176.58 3ci2 s PHE 69 N -0.94 2.19 0.48 5.38 0.08 -1.25 -1.02 117.98 122.90 3ci2 s PHE 69 Ca 0.23 0.63 0.05 0.00 0.12 0.00 0.00 56.93 57.96 3ci2 s PHE 69 Cb -0.12 -4.27 -0.01 0.00 -0.57 0.00 0.00 43.02 38.04 3ci2 s PHE 69 CO -0.10 -2.22 0.23 0.14 -0.10 0.00 0.00 175.22 173.17 3ci2 s VAL 70 N 6.13 1.85 0.00 -0.44 -7.23 -0.26 -3.18 120.40 117.27 3ci2 s VAL 70 Ca 0.64 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 59.14 3ci2 s VAL 70 Cb -0.15 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.27 3ci2 s VAL 70 CO 0.31 0.00 0.00 -0.90 -0.31 0.00 0.00 175.10 174.20 3ci2 n ASP 71 N -1.44 0.00 -0.52 4.85 5.75 0.71 0.59 116.55 126.49 3ci2 n ASP 71 Ca -0.05 0.00 0.14 0.00 -0.01 0.00 0.00 54.79 54.87 3ci2 n ASP 71 Cb 0.65 0.00 0.49 0.00 -1.03 0.00 0.00 41.12 41.23 3ci2 n ASP 71 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3ci2 n LYS 72 N 0.00 1.71 -2.69 0.11 4.01 -1.26 -3.66 118.16 116.39 3ci2 n LYS 72 Ca 0.00 -1.04 -0.08 0.00 -0.51 0.00 0.00 58.31 56.68 3ci2 n LYS 72 Cb 0.00 -1.47 0.03 0.00 -0.51 0.00 0.00 35.03 33.08 3ci2 n LYS 72 CO 0.00 0.00 0.00 1.47 -1.11 0.00 0.00 177.40 177.76 3ci2 n LEU 73 N 0.26 1.61 -1.72 -0.35 -0.00 -1.26 -5.01 117.00 110.53 3ci2 n LEU 73 Ca 0.19 -3.62 0.00 0.00 -0.00 0.00 0.00 56.01 52.57 3ci2 n LEU 73 Cb 0.37 0.40 0.00 0.00 -0.00 0.00 0.00 43.42 44.19 3ci2 n LEU 73 CO 0.16 1.48 0.00 -0.90 -0.00 0.00 0.00 177.39 178.13 3ci2 n ASP 74 N -0.19 -0.57 -4.90 1.45 5.75 -1.24 -4.93 116.55 111.91 3ci2 n ASP 74 Ca 0.10 0.29 -0.29 0.00 -0.01 0.00 0.00 54.79 54.87 3ci2 n ASP 74 Cb 0.81 -0.68 -0.04 0.00 -1.03 0.00 0.00 41.12 40.18 3ci2 n ASP 74 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 3ci2 s ASN 75 N -1.36 6.22 -0.90 -1.12 0.01 -1.26 -0.59 114.94 115.94 3ci2 s ASN 75 Ca 0.00 0.19 -0.25 0.00 -0.71 0.00 0.00 52.86 52.09 3ci2 s ASN 75 Cb 0.00 -1.87 0.03 0.00 0.41 0.00 0.00 41.25 39.83 3ci2 s ASN 75 CO 0.00 0.13 1.45 -0.63 -1.51 0.00 0.00 177.10 176.54 3ci2 s ILE 76 N -1.58 3.79 0.07 0.60 1.01 0.16 -0.20 121.20 125.05 3ci2 s ILE 76 Ca 0.34 -0.31 -0.16 0.00 0.00 0.00 0.00 60.65 60.53 3ci2 s ILE 76 Cb -0.12 -4.88 -0.16 0.00 0.01 0.00 0.00 42.46 37.30 3ci2 s ILE 76 CO 0.27 -1.79 1.27 0.00 0.00 0.00 0.00 174.94 174.70 3ci2 h ALA 77 N 10.23 0.26 -2.82 9.38 0.00 -1.87 -1.61 119.26 132.83 3ci2 h ALA 77 Ca 0.02 -0.54 -0.63 0.00 0.00 0.00 0.00 54.91 53.76 3ci2 h ALA 77 Cb 1.03 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.65 3ci2 h ALA 77 CO 1.35 0.51 -0.76 -1.14 0.00 0.00 0.00 179.25 179.21 3ci2 s GLN 78 N -3.75 1.80 0.19 0.00 0.74 -1.19 -5.03 119.66 112.42 3ci2 s GLN 78 Ca -0.12 -1.49 -0.30 0.00 0.05 0.00 0.00 55.36 53.50 3ci2 s GLN 78 Cb 0.07 -1.96 -0.08 0.00 1.10 0.00 0.00 33.01 32.15 3ci2 s GLN 78 CO 0.86 0.39 1.07 0.08 -0.55 0.00 0.00 175.29 177.14 3ci2 s VAL 79 N -1.93 3.92 0.77 1.34 1.01 -1.26 -4.86 120.40 119.39 3ci2 s VAL 79 Ca 0.25 1.70 -0.10 0.00 0.00 0.00 0.00 61.98 63.83 3ci2 s VAL 79 Cb -0.07 -4.08 0.07 0.00 0.00 0.00 0.00 36.38 32.29 3ci2 s VAL 79 CO 0.14 0.31 1.13 -2.84 0.00 0.00 0.00 175.10 173.84 3ci2 s PRO 80 N -0.52 2.09 0.23 2.72 0.02 -1.26 -4.89 135.00 133.40 3ci2 s PRO 80 Ca 0.48 0.04 -0.22 0.00 0.02 0.00 0.00 61.00 61.31 3ci2 s PRO 80 Cb -0.29 -2.02 0.05 0.00 0.02 0.00 0.00 34.50 32.27 3ci2 s PRO 80 CO 0.35 -1.46 0.87 -0.98 -0.33 0.00 0.00 177.00 175.44 3ci2 s ARG 81 N -5.47 1.56 0.00 5.54 1.70 -1.01 -2.03 118.95 119.24 3ci2 s ARG 81 Ca 0.61 -0.91 0.00 0.00 -0.47 0.00 0.00 55.73 54.97 3ci2 s ARG 81 Cb -0.11 0.50 0.00 0.00 -0.57 0.00 0.00 34.95 34.77 3ci2 s ARG 81 CO 0.48 -0.72 0.00 0.28 -1.08 0.00 0.00 175.30 174.26 3ci2 n VAL 82 N -0.50 0.00 -0.44 4.99 0.31 0.47 -0.48 118.33 122.68 3ci2 n VAL 82 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3ci2 n VAL 82 Cb 0.60 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.53 3ci2 n VAL 82 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12