#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2sni s LYS 21 N 0.00 3.51 0.00 1.47 2.20 -1.26 -4.89 119.74 120.77 2sni s LYS 21 Ca 0.00 0.12 0.11 0.00 -0.36 0.00 0.00 55.97 55.84 2sni s LYS 21 Cb 0.00 -3.93 0.05 0.00 -1.51 0.00 0.00 37.83 32.44 2sni s LYS 21 CO 0.00 -1.22 0.78 0.25 -0.36 0.00 0.00 175.35 174.80 2sni n THR 22 N 6.39 0.00 -3.86 3.43 -2.24 -1.26 -4.90 114.28 111.83 2sni n THR 22 Ca 0.06 -0.45 -0.11 0.00 -2.27 0.00 0.00 64.05 61.28 2sni n THR 22 Cb 0.48 1.19 -0.09 0.00 -2.10 0.00 0.00 70.33 69.81 2sni n THR 22 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2sni s GLU 23 N -1.15 0.59 -0.50 -0.78 -1.05 -1.26 -1.34 118.70 113.20 2sni s GLU 23 Ca 0.12 -0.53 0.07 0.00 -0.15 0.00 0.00 54.97 54.47 2sni s GLU 23 Cb 0.09 0.24 0.24 0.00 -0.44 0.00 0.00 34.13 34.26 2sni s GLU 23 CO 0.20 -0.16 0.58 0.91 0.95 0.00 0.00 175.26 177.74 2sni n TRP 24 N 1.04 1.27 -0.24 4.83 8.01 -0.41 -4.95 117.44 126.98 2sni n TRP 24 Ca -0.21 -3.80 0.05 0.00 -1.31 0.00 0.00 57.50 52.23 2sni n TRP 24 Cb 0.57 -0.38 0.29 0.00 -2.01 0.00 0.00 31.31 29.77 2sni n TRP 24 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2sni h PRO 25 N 4.32 0.89 -0.03 -0.99 0.13 -1.95 -2.38 132.00 132.00 2sni h PRO 25 Ca 0.14 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.23 2sni h PRO 25 Cb 0.80 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 31.72 2sni h PRO 25 CO 0.60 0.59 0.09 1.05 -0.23 0.00 0.00 178.00 180.10 2sni h GLU 26 N 0.92 0.00 0.00 0.86 9.09 -1.98 -2.99 114.58 120.48 2sni h GLU 26 Ca 0.35 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.76 2sni h GLU 26 Cb 0.19 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.29 2sni h GLU 26 CO -0.12 0.00 -0.52 -0.07 0.05 0.00 0.00 179.01 178.35 2sni h LEU 27 N 0.00 0.00 -9.56 3.06 3.38 -1.84 -3.46 115.31 106.89 2sni h LEU 27 Ca 0.01 -0.11 -0.59 0.00 0.09 0.00 0.00 57.88 57.29 2sni h LEU 27 Cb 0.19 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.02 2sni h LEU 27 CO -0.00 0.05 0.63 0.52 0.09 0.00 0.00 178.44 179.73 2sni n VAL 28 N -2.38 0.75 0.00 1.22 0.31 -1.13 -0.67 118.33 116.43 2sni n VAL 28 Ca 0.03 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2sni n VAL 28 Cb 0.47 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 2sni n VAL 28 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2sni n GLY 29 N 2.39 3.26 3.79 2.92 0.00 0.11 -4.94 105.19 112.70 2sni n GLY 29 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2sni n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sni s LYS 30 N -0.58 2.63 0.67 1.61 3.01 0.15 -4.61 119.74 122.63 2sni s LYS 30 Ca 0.00 1.15 -0.11 0.00 -1.01 0.00 0.00 55.97 56.00 2sni s LYS 30 Cb 0.00 -1.94 -0.01 0.00 -1.01 0.00 0.00 37.83 34.87 2sni s LYS 30 CO 0.00 -1.35 1.06 -1.54 0.51 0.00 0.00 175.35 174.02 2sni s SER 31 N -3.31 5.68 0.13 2.83 1.04 -1.26 -0.08 113.70 118.73 2sni s SER 31 Ca 0.61 1.44 -0.23 0.00 0.48 0.00 0.00 55.95 58.25 2sni s SER 31 Cb -0.17 -2.36 -0.02 0.00 0.10 0.00 0.00 66.02 63.57 2sni s SER 31 CO 0.52 -1.23 1.66 0.58 0.98 0.00 0.00 173.24 175.75 2sni h VAL 32 N -0.57 0.56 -0.96 5.02 2.07 -1.63 -0.64 116.25 120.10 2sni h VAL 32 Ca -0.44 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.14 2sni h VAL 32 Cb 1.21 0.56 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 2sni h VAL 32 CO 0.60 0.00 0.61 1.05 0.02 0.00 0.00 177.57 179.85 2sni h GLU 33 N -0.22 1.08 -0.21 1.57 9.09 -1.94 -0.85 114.58 123.10 2sni h GLU 33 Ca 0.09 -0.06 -0.03 0.00 0.05 0.00 0.00 59.36 59.40 2sni h GLU 33 Cb 0.36 -0.24 -0.01 0.00 -1.65 0.00 0.00 28.75 27.21 2sni h GLU 33 CO -0.25 0.71 0.00 0.93 0.05 0.00 0.00 179.01 180.46 2sni h GLU 34 N 1.11 0.38 -0.17 1.06 5.08 -1.84 -3.13 114.58 117.07 2sni h GLU 34 Ca 0.42 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.70 2sni h GLU 34 Cb 0.18 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2sni h GLU 34 CO -0.18 0.56 -0.12 0.00 -1.00 0.00 0.00 179.01 178.27 2sni h ALA 35 N 0.80 0.00 -1.00 3.43 0.00 -0.35 -2.64 119.26 119.49 2sni h ALA 35 Ca 0.06 0.07 0.17 0.00 0.00 0.00 0.00 54.91 55.20 2sni h ALA 35 Cb 0.39 0.27 -0.10 0.00 0.00 0.00 0.00 17.79 18.36 2sni h ALA 35 CO 0.01 -0.56 0.62 0.87 0.00 0.00 0.00 179.25 180.19 2sni h LYS 36 N -0.13 0.81 -0.31 0.00 1.57 -1.17 -1.50 116.57 115.84 2sni h LYS 36 Ca 0.10 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2sni h LYS 36 Cb 0.28 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2sni h LYS 36 CO -0.25 0.53 -0.14 0.87 -0.57 0.00 0.00 179.45 179.90 2sni h LYS 37 N 0.83 0.64 -0.14 3.15 1.57 -1.43 -1.63 116.57 119.57 2sni h LYS 37 Ca 0.55 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 59.04 2sni h LYS 37 Cb 0.77 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 2sni h LYS 37 CO -0.33 0.86 0.04 0.28 -0.57 0.00 0.00 179.45 179.72 2sni h VAL 38 N 0.40 1.18 0.38 0.50 2.07 -1.20 -2.55 116.25 117.04 2sni h VAL 38 Ca 0.07 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 2sni h VAL 38 Cb 0.66 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2sni h VAL 38 CO 0.04 0.17 -0.34 0.40 0.02 0.00 0.00 177.57 177.86 2sni h ILE 39 N 0.04 0.29 -0.40 4.57 2.04 -1.27 -0.98 117.51 121.81 2sni h ILE 39 Ca 0.04 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.02 2sni h ILE 39 Cb 0.23 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 2sni h ILE 39 CO -0.00 0.00 0.32 -0.07 0.00 0.00 0.00 178.15 178.40 2sni h LEU 40 N -0.74 0.00 -0.19 1.44 3.38 -1.34 0.91 115.31 118.78 2sni h LEU 40 Ca -0.03 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 2sni h LEU 40 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2sni h LEU 40 CO -0.04 0.00 -0.42 -0.61 0.09 0.00 0.00 178.44 177.46 2sni h GLN 41 N 0.00 0.62 0.13 1.13 4.15 -0.97 -2.41 115.11 117.76 2sni h GLN 41 Ca 0.19 -0.41 -0.28 0.00 0.77 0.00 0.00 58.65 58.91 2sni h GLN 41 Cb 0.82 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.57 2sni h GLN 41 CO -0.00 1.03 -1.32 -0.44 -1.93 0.00 0.00 178.83 176.17 2sni h ASP 42 N 0.29 0.44 -2.30 -0.69 3.32 0.81 -3.41 116.42 114.89 2sni h ASP 42 Ca 0.00 -0.50 -0.56 0.00 0.02 0.00 0.00 57.03 55.99 2sni h ASP 42 Cb 1.03 -0.14 -0.37 0.00 0.22 0.00 0.00 39.33 40.07 2sni h ASP 42 CO 0.09 1.39 -0.93 -0.75 -1.72 0.00 0.00 179.24 177.32 2sni s LYS 43 N -2.64 0.87 0.53 3.56 2.20 0.28 -4.84 119.74 119.70 2sni s LYS 43 Ca -0.05 -1.95 0.25 0.00 -0.36 0.00 0.00 55.97 53.86 2sni s LYS 43 Cb 0.07 -1.31 1.40 0.00 -1.51 0.00 0.00 37.83 36.48 2sni s LYS 43 CO 0.88 -1.37 2.00 -1.35 -0.36 0.00 0.00 175.35 175.15 2sni h PRO 44 N 5.75 0.00 -0.07 4.03 0.11 -1.62 -1.23 132.00 138.97 2sni h PRO 44 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2sni h PRO 44 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2sni h PRO 44 CO 0.34 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.28 2sni n GLU 45 N -4.35 1.53 -1.72 1.05 0.00 -1.26 -4.95 120.64 110.94 2sni n GLU 45 Ca 0.09 -0.79 -0.42 0.00 0.00 0.00 0.00 57.16 56.04 2sni n GLU 45 Cb 0.59 -1.42 -0.01 0.00 0.00 0.00 0.00 31.44 30.60 2sni n GLU 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2sni n ALA 46 N -0.02 1.73 -3.70 -1.84 0.00 -0.47 -4.91 120.51 111.30 2sni n ALA 46 Ca 0.18 0.36 -0.38 0.00 0.00 0.00 0.00 53.44 53.60 2sni n ALA 46 Cb 0.28 -2.33 -0.10 0.00 0.00 0.00 0.00 19.45 17.30 2sni n ALA 46 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2sni s GLN 47 N -1.66 2.19 0.13 0.00 -1.52 0.17 -4.97 119.66 114.00 2sni s GLN 47 Ca 0.57 -1.86 -0.24 0.00 -1.95 0.00 0.00 55.36 51.88 2sni s GLN 47 Cb -0.54 -3.70 -0.07 0.00 -0.22 0.00 0.00 33.01 28.47 2sni s GLN 47 CO 0.60 -1.12 0.73 0.42 -0.25 0.00 0.00 175.29 175.68 2sni s ILE 48 N 1.11 4.48 -0.02 1.08 1.01 -1.26 -1.33 121.20 126.27 2sni s ILE 48 Ca 0.08 1.60 0.00 0.00 0.00 0.00 0.00 60.65 62.33 2sni s ILE 48 Cb -0.23 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.17 2sni s ILE 48 CO -0.03 0.51 0.01 -0.51 0.00 0.00 0.00 174.94 174.92 2sni s ILE 49 N -1.02 0.11 -0.20 2.92 -1.16 -0.78 -4.95 121.20 116.12 2sni s ILE 49 Ca 0.35 0.10 -0.08 0.00 -0.51 0.00 0.00 60.65 60.51 2sni s ILE 49 Cb -0.22 -0.21 -0.04 0.00 0.61 0.00 0.00 42.46 42.60 2sni s ILE 49 CO 0.24 0.12 0.08 -0.69 -2.81 0.00 0.00 174.94 171.89 2sni s VAL 50 N 0.93 4.84 0.10 4.00 1.01 -1.26 -0.19 120.40 129.83 2sni s VAL 50 Ca -0.09 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 61.91 2sni s VAL 50 Cb -0.12 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 2sni s VAL 50 CO -0.02 0.42 -0.09 -0.76 0.00 0.00 0.00 175.10 174.65 2sni s LEU 51 N 0.66 2.43 0.30 3.92 1.43 0.38 -4.96 118.68 122.84 2sni s LEU 51 Ca 0.04 -0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 52.00 2sni s LEU 51 Cb -0.13 -0.23 -0.10 0.00 0.03 0.00 0.00 46.19 45.76 2sni s LEU 51 CO 0.01 -0.31 1.24 -2.16 0.23 0.00 0.00 176.35 175.36 2sni s PRO 52 N -3.00 4.45 0.75 1.29 0.04 -1.26 -1.22 135.00 136.05 2sni s PRO 52 Ca 0.06 2.07 -0.13 0.00 0.04 0.00 0.00 61.00 63.04 2sni s PRO 52 Cb -0.01 -3.12 0.05 0.00 0.04 0.00 0.00 34.50 31.46 2sni s PRO 52 CO -0.01 -0.07 1.14 0.54 0.04 0.00 0.00 177.00 178.63 2sni s VAL 53 N -0.99 2.79 -0.69 -0.36 0.11 0.06 -3.75 120.40 117.57 2sni s VAL 53 Ca 0.48 0.32 -0.00 0.00 -2.93 0.00 0.00 61.98 59.86 2sni s VAL 53 Cb -0.37 -2.75 0.00 0.00 -1.53 0.00 0.00 36.38 31.73 2sni s VAL 53 CO 0.47 -0.27 0.01 0.61 -3.33 0.00 0.00 175.10 172.59 2sni n GLY 54 N -0.31 0.04 3.66 6.54 0.00 -1.26 -4.96 105.19 108.90 2sni n GLY 54 Ca 0.11 -0.54 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 2sni n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2sni s THR 55 N -2.42 3.53 0.01 2.61 -4.23 -1.25 -5.12 115.64 108.76 2sni s THR 55 Ca 0.01 -1.84 -0.16 0.00 -1.18 0.00 0.00 61.69 58.52 2sni s THR 55 Cb -0.00 -2.88 -0.06 0.00 1.34 0.00 0.00 72.50 70.90 2sni s THR 55 CO 0.01 -0.35 0.43 -0.63 -0.54 0.00 0.00 174.62 173.54 2sni s ILE 56 N -2.26 4.99 0.22 2.99 -1.09 -1.26 -5.10 121.20 119.70 2sni s ILE 56 Ca 0.31 0.90 0.03 0.00 -2.23 0.00 0.00 60.65 59.66 2sni s ILE 56 Cb -0.07 -3.74 -0.05 0.00 -1.58 0.00 0.00 42.46 37.02 2sni s ILE 56 CO 0.20 0.56 0.01 0.68 -1.23 0.00 0.00 174.94 175.17 2sni s VAL 57 N -1.00 0.88 0.53 2.92 -7.23 -1.26 -5.14 120.40 110.09 2sni s VAL 57 Ca 0.25 -2.01 -0.22 0.00 -1.81 0.00 0.00 61.98 58.19 2sni s VAL 57 Cb -0.17 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 2sni s VAL 57 CO 0.14 -0.31 1.27 0.42 -0.31 0.00 0.00 175.10 176.31 2sni s THR 58 N -3.53 2.51 -0.48 5.32 -4.23 -1.26 -4.96 115.64 109.01 2sni s THR 58 Ca 0.29 0.37 0.03 0.00 -1.18 0.00 0.00 61.69 61.20 2sni s THR 58 Cb 0.06 -3.18 0.56 0.00 1.34 0.00 0.00 72.50 71.28 2sni s THR 58 CO 0.08 -0.02 1.84 0.23 -0.54 0.00 0.00 174.62 176.21 2sni n MET 59 N -0.96 2.40 -3.39 3.99 2.81 -1.26 -4.95 117.12 115.77 2sni n MET 59 Ca 0.10 -3.20 -0.34 0.00 -1.81 0.00 0.00 57.70 52.44 2sni n MET 59 Cb 0.47 -2.16 -0.06 0.00 -0.71 0.00 0.00 33.22 30.76 2sni n MET 59 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 2sni s GLU 60 N -3.48 3.92 -0.26 0.03 1.03 -1.26 -5.06 118.70 113.62 2sni s GLU 60 Ca 0.57 0.41 -0.08 0.00 0.03 0.00 0.00 54.97 55.91 2sni s GLU 60 Cb 0.47 -2.86 -0.03 0.00 -0.80 0.00 0.00 34.13 30.92 2sni s GLU 60 CO 0.05 0.44 0.08 -0.47 -1.33 0.00 0.00 175.26 174.03 2sni s TYR 61 N -1.56 3.10 -0.26 4.83 6.14 -1.26 -5.05 117.35 123.30 2sni s TYR 61 Ca 0.40 -0.45 0.00 0.00 0.64 0.00 0.00 57.07 57.67 2sni s TYR 61 Cb -0.14 -2.26 0.04 0.00 0.42 0.00 0.00 41.96 40.03 2sni s TYR 61 CO 0.20 -0.37 -0.08 1.03 0.64 0.00 0.00 175.55 176.96 2sni s ARG 62 N 1.61 2.53 0.56 4.97 0.52 -1.26 -5.02 118.95 122.86 2sni s ARG 62 Ca 0.06 -1.17 0.23 0.00 -0.52 0.00 0.00 55.73 54.33 2sni s ARG 62 Cb -0.15 -2.95 1.53 0.00 0.52 0.00 0.00 34.95 33.89 2sni s ARG 62 CO 0.04 -0.50 2.16 0.97 0.02 0.00 0.00 175.30 177.99 2sni h ILE 63 N 6.43 0.73 -0.16 1.52 2.10 -1.96 -2.75 117.51 123.42 2sni h ILE 63 Ca -0.26 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.68 2sni h ILE 63 Cb 1.07 0.94 0.00 0.00 -1.09 0.00 0.00 36.82 37.75 2sni h ILE 63 CO 0.53 0.00 0.00 0.47 -1.08 0.00 0.00 178.15 178.07 2sni n ASP 64 N -4.18 2.74 -4.82 2.19 8.00 -1.26 -4.59 116.55 114.63 2sni n ASP 64 Ca -0.01 -1.81 -0.36 0.00 0.71 0.00 0.00 54.79 53.32 2sni n ASP 64 Cb 0.18 -0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.13 2sni n ASP 64 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2sni s ARG 65 N -1.37 4.17 -0.22 -1.24 3.52 -1.05 0.46 118.95 123.23 2sni s ARG 65 Ca 0.25 0.75 -0.02 0.00 -0.13 0.00 0.00 55.73 56.58 2sni s ARG 65 Cb 0.16 -2.96 0.07 0.00 -1.56 0.00 0.00 34.95 30.66 2sni s ARG 65 CO 0.23 0.46 0.03 0.08 -0.81 0.00 0.00 175.30 175.29 2sni s VAL 66 N -1.44 0.72 -0.06 7.11 1.01 -0.44 -1.39 120.40 125.92 2sni s VAL 66 Ca 0.39 -0.79 -0.24 0.00 0.00 0.00 0.00 61.98 61.33 2sni s VAL 66 Cb -0.17 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 2sni s VAL 66 CO 0.20 -0.27 0.74 -0.13 0.00 0.00 0.00 175.10 175.64 2sni s ARG 67 N 1.75 4.46 -0.24 2.72 0.52 -1.26 -1.87 118.95 125.04 2sni s ARG 67 Ca 0.00 0.96 -0.04 0.00 -0.52 0.00 0.00 55.73 56.13 2sni s ARG 67 Cb -0.17 -3.45 0.00 0.00 0.52 0.00 0.00 34.95 31.85 2sni s ARG 67 CO -0.11 0.05 -0.02 -0.51 0.02 0.00 0.00 175.30 174.73 2sni s LEU 68 N 0.82 3.13 -0.27 2.53 1.43 0.74 -4.39 118.68 122.68 2sni s LEU 68 Ca 0.40 -0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 52.84 2sni s LEU 68 Cb -0.18 -1.76 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2sni s LEU 68 CO 0.20 -0.07 0.27 -0.36 0.23 0.00 0.00 176.35 176.61 2sni s PHE 69 N 1.46 3.25 0.22 0.29 0.40 -1.25 -0.47 117.98 121.88 2sni s PHE 69 Ca 0.04 0.26 0.10 0.00 -0.60 0.00 0.00 56.93 56.74 2sni s PHE 69 Cb -0.15 -2.45 -0.04 0.00 0.51 0.00 0.00 43.02 40.89 2sni s PHE 69 CO -0.02 -0.15 -0.13 0.14 0.70 0.00 0.00 175.22 175.75 2sni s VAL 70 N 1.78 2.90 0.79 -0.44 -7.23 -0.35 0.23 120.40 118.07 2sni s VAL 70 Ca 0.11 -1.96 -0.05 0.00 -1.81 0.00 0.00 61.98 58.27 2sni s VAL 70 Cb -0.16 -2.47 0.17 0.00 0.56 0.00 0.00 36.38 34.48 2sni s VAL 70 CO 0.10 -0.23 1.09 -0.90 -0.31 0.00 0.00 175.10 174.85 2sni n ASP 71 N -0.23 0.99 0.05 4.85 5.68 -0.78 -0.76 116.55 126.35 2sni n ASP 71 Ca -0.09 -1.94 0.03 0.00 -0.50 0.00 0.00 54.79 52.29 2sni n ASP 71 Cb 0.57 -0.75 0.18 0.00 -1.14 0.00 0.00 41.12 39.98 2sni n ASP 71 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2sni n LYS 72 N -3.11 0.04 0.00 0.11 4.76 -1.26 -1.24 118.16 117.46 2sni n LYS 72 Ca 0.16 0.54 0.11 0.00 -2.87 0.00 0.00 58.31 56.25 2sni n LYS 72 Cb 0.58 -1.64 -0.04 0.00 -1.84 0.00 0.00 35.03 32.09 2sni n LYS 72 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2sni n LEU 73 N -1.73 1.72 -1.38 -0.35 7.99 -1.26 -4.97 117.00 117.02 2sni n LEU 73 Ca -0.00 -0.68 -0.10 0.00 -0.01 0.00 0.00 56.01 55.22 2sni n LEU 73 Cb 0.01 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 43.34 2sni n LEU 73 CO 0.03 0.34 -0.01 0.47 -1.51 0.00 0.00 177.39 176.70 2sni n ASP 74 N -0.45 -3.46 -4.65 -1.43 8.00 -0.37 -4.97 116.55 109.21 2sni n ASP 74 Ca 0.08 -0.11 -0.32 0.00 0.71 0.00 0.00 54.79 55.15 2sni n ASP 74 Cb 0.43 -2.41 -0.09 0.00 -0.02 0.00 0.00 41.12 39.02 2sni n ASP 74 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2sni s ASN 75 N -2.84 4.95 0.12 -2.24 0.01 -1.26 -1.50 114.94 112.19 2sni s ASN 75 Ca 0.11 -0.07 -0.32 0.00 -0.71 0.00 0.00 52.86 51.88 2sni s ASN 75 Cb -0.05 -1.24 -0.11 0.00 0.41 0.00 0.00 41.25 40.26 2sni s ASN 75 CO 0.14 0.27 1.82 -0.38 -1.51 0.00 0.00 177.10 177.44 2sni n ILE 76 N 1.36 0.33 0.46 0.60 2.08 0.89 -1.87 119.36 123.22 2sni n ILE 76 Ca -0.14 -0.06 0.09 0.00 0.56 0.00 0.00 62.75 63.20 2sni n ILE 76 Cb 0.53 -2.07 -0.12 0.00 -0.75 0.00 0.00 39.64 37.22 2sni n ILE 76 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2sni n ALA 77 N 5.45 3.61 -2.56 -1.39 0.00 0.13 -0.72 120.51 125.03 2sni n ALA 77 Ca 0.18 -0.48 -0.08 0.00 0.00 0.00 0.00 53.44 53.05 2sni n ALA 77 Cb 0.36 -0.66 -0.10 0.00 0.00 0.00 0.00 19.45 19.06 2sni n ALA 77 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2sni s GLU 78 N -2.99 0.55 -0.07 0.00 2.02 -1.24 -4.98 118.70 111.99 2sni s GLU 78 Ca 0.01 -0.89 -0.29 0.00 0.02 0.00 0.00 54.97 53.81 2sni s GLU 78 Cb 0.13 0.20 -0.07 0.00 0.10 0.00 0.00 34.13 34.49 2sni s GLU 78 CO 0.77 -0.12 2.02 0.08 0.02 0.00 0.00 175.26 178.02 2sni s VAL 79 N -2.86 3.09 0.25 2.63 1.01 -1.26 -4.67 120.40 118.58 2sni s VAL 79 Ca -0.03 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 2sni s VAL 79 Cb 0.00 -3.08 -0.10 0.00 0.00 0.00 0.00 36.38 33.20 2sni s VAL 79 CO -0.06 -0.03 1.41 -2.84 0.00 0.00 0.00 175.10 173.58 2sni s PRO 80 N 5.10 4.29 0.03 2.72 0.02 -1.26 -4.88 135.00 141.02 2sni s PRO 80 Ca 0.91 2.26 -0.12 0.00 0.02 0.00 0.00 61.00 64.07 2sni s PRO 80 Cb -0.38 -3.12 0.01 0.00 0.02 0.00 0.00 34.50 31.04 2sni s PRO 80 CO 0.38 -0.38 0.25 -0.98 -0.33 0.00 0.00 177.00 175.95 2sni s ARG 81 N -0.47 0.71 0.39 5.54 1.70 -1.26 -1.29 118.95 124.28 2sni s ARG 81 Ca 0.58 -0.48 -0.26 0.00 -0.47 0.00 0.00 55.73 55.11 2sni s ARG 81 Cb -0.41 0.30 -0.09 0.00 -0.57 0.00 0.00 34.95 34.19 2sni s ARG 81 CO 0.43 -0.21 1.21 0.08 -1.08 0.00 0.00 175.30 175.73 2sni s VAL 82 N -2.21 3.00 0.00 4.99 1.01 -0.45 -4.10 120.40 122.64 2sni s VAL 82 Ca -0.08 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.77 2sni s VAL 82 Cb -0.02 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2sni s VAL 82 CO -0.02 0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.80