#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nho n VAL 2 N 0.00 0.00 -3.05 3.17 3.14 -1.26 -4.76 118.33 115.57 1nho n VAL 2 Ca 0.00 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.96 1nho n VAL 2 Cb 0.00 -0.01 -0.06 0.00 -1.06 0.00 0.00 33.84 32.71 1nho n VAL 2 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1nho s VAL 3 N 0.00 4.78 -0.26 1.55 1.01 -1.25 -4.85 120.40 121.37 1nho s VAL 3 Ca 0.00 0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.40 1nho s VAL 3 Cb 0.00 -4.21 0.07 0.00 0.00 0.00 0.00 36.38 32.24 1nho s VAL 3 CO 0.00 -0.55 -0.03 0.20 0.00 0.00 0.00 175.10 174.71 1nho s ASN 4 N 1.98 4.15 -0.02 3.32 -0.87 -1.20 -0.20 114.94 122.09 1nho s ASN 4 Ca 0.26 -1.43 0.07 0.00 -1.57 0.00 0.00 52.86 50.19 1nho s ASN 4 Cb -0.13 -1.30 -0.02 0.00 -0.02 0.00 0.00 41.25 39.78 1nho s ASN 4 CO 0.19 -0.27 -0.22 -0.63 -2.57 0.00 0.00 177.10 173.60 1nho s ILE 5 N 1.27 1.73 -0.09 0.60 -1.09 -1.18 -4.14 121.20 118.30 1nho s ILE 5 Ca -0.02 -0.93 -0.00 0.00 -2.23 0.00 0.00 60.65 57.46 1nho s ILE 5 Cb -0.19 -1.44 0.02 0.00 -1.58 0.00 0.00 42.46 39.27 1nho s ILE 5 CO -0.08 0.49 -0.06 -0.70 -1.23 0.00 0.00 174.94 173.36 1nho s GLU 6 N -0.47 1.30 -0.35 2.79 2.12 -1.08 0.37 118.70 123.39 1nho s GLU 6 Ca 0.07 -0.18 -0.03 0.00 0.36 0.00 0.00 54.97 55.19 1nho s GLU 6 Cb -0.09 -1.39 0.07 0.00 0.26 0.00 0.00 34.13 32.99 1nho s GLU 6 CO -0.00 -0.23 0.10 0.14 -0.54 0.00 0.00 175.26 174.72 1nho s VAL 7 N 1.60 3.26 -0.61 3.70 -7.23 -0.71 -0.67 120.40 119.74 1nho s VAL 7 Ca 0.02 -1.58 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 1nho s VAL 7 Cb -0.13 -3.01 0.15 0.00 0.56 0.00 0.00 36.38 33.96 1nho s VAL 7 CO -0.06 -0.34 0.40 0.12 -0.31 0.00 0.00 175.10 174.91 1nho s PHE 8 N 1.24 3.35 0.00 2.82 5.36 0.15 0.53 117.98 131.43 1nho s PHE 8 Ca 0.01 -2.94 0.00 0.00 -0.96 0.00 0.00 56.93 53.03 1nho s PHE 8 Cb -0.21 -3.04 0.00 0.00 -0.34 0.00 0.00 43.02 39.44 1nho s PHE 8 CO -0.01 -0.78 0.00 2.41 -1.46 0.00 0.00 175.22 175.37 1nho n THR 9 N 3.19 0.00 0.00 0.12 -1.04 -1.16 0.53 114.28 115.93 1nho n THR 9 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1nho n THR 9 Cb 0.35 -0.65 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 1nho n THR 9 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1nho n SER 10 N -2.41 0.00 0.07 8.00 2.88 -1.26 -2.96 113.62 117.94 1nho n SER 10 Ca 0.00 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1nho n SER 10 Cb 0.22 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.63 1nho n SER 10 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1nho h PRO 11 N 0.00 0.00 0.00 -1.46 0.13 -1.89 -3.27 132.00 125.51 1nho h PRO 11 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1nho h PRO 11 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1nho h PRO 11 CO 0.00 0.45 0.00 2.41 -0.23 0.00 0.00 178.00 180.63 1nho n THR 12 N -3.07 0.00 -3.49 1.56 -1.04 -1.26 -4.84 114.28 102.15 1nho n THR 12 Ca -0.05 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.94 1nho n THR 12 Cb 0.83 -0.25 -0.00 0.00 -1.82 0.00 0.00 70.33 69.09 1nho n THR 12 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nho s PRO 14 N -2.09 3.44 0.00 0.00 0.04 -1.26 -4.81 135.00 130.31 1nho s PRO 14 Ca 0.04 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.06 1nho s PRO 14 Cb -0.00 -4.00 0.00 0.00 0.04 0.00 0.00 34.50 30.54 1nho s PRO 14 CO 0.03 -1.41 0.37 0.66 0.04 0.00 0.00 177.00 176.68 1nho n TYR 15 N 7.49 0.00 -2.70 0.56 4.01 -1.26 -4.67 117.16 120.59 1nho n TYR 15 Ca 0.04 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.73 1nho n TYR 15 Cb 0.48 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.62 1nho n TYR 15 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1nho n PRO 17 N -0.77 0.62 -0.00 0.00 -0.04 -1.26 -3.75 135.00 129.79 1nho n PRO 17 Ca -0.04 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1nho n PRO 17 Cb 0.85 -1.26 -0.00 0.00 -0.04 0.00 0.00 33.50 33.05 1nho n PRO 17 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 1nho n MET 18 N 0.41 0.02 0.32 0.54 1.56 -1.26 -4.32 117.12 114.39 1nho n MET 18 Ca 0.00 0.01 0.17 0.00 -0.27 0.00 0.00 57.70 57.61 1nho n MET 18 Cb 0.22 -0.30 0.93 0.00 2.15 0.00 0.00 33.22 36.22 1nho n MET 18 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1nho h ALA 19 N -0.91 1.19 -0.32 -5.12 0.00 -1.81 0.15 119.26 112.43 1nho h ALA 19 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1nho h ALA 19 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1nho h ALA 19 CO 0.00 -0.19 -0.48 -0.84 0.00 0.00 0.00 179.25 177.74 1nho h ILE 20 N 0.00 1.27 -0.82 0.00 3.07 -1.79 -2.62 117.51 116.62 1nho h ILE 20 Ca 0.00 -1.66 0.14 0.00 1.55 0.00 0.00 64.86 64.89 1nho h ILE 20 Cb 0.39 1.54 -0.06 0.00 -0.27 0.00 0.00 36.82 38.42 1nho h ILE 20 CO 0.00 0.55 0.53 -0.08 -1.05 0.00 0.00 178.15 178.10 1nho h GLU 21 N 0.70 0.57 -0.23 0.16 4.57 -0.88 1.07 114.58 120.53 1nho h GLU 21 Ca 0.03 -0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 1nho h GLU 21 Cb 1.09 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.54 1nho h GLU 21 CO 0.11 0.38 -0.10 0.28 -1.18 0.00 0.00 179.01 178.50 1nho h VAL 22 N 0.58 1.30 -0.36 0.32 2.07 -1.49 0.63 116.25 119.30 1nho h VAL 22 Ca 0.40 -1.16 -0.08 0.00 0.82 0.00 0.00 66.70 66.69 1nho h VAL 22 Cb 0.72 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 1nho h VAL 22 CO -0.16 0.36 -0.10 0.58 0.02 0.00 0.00 177.57 178.27 1nho h VAL 23 N 0.20 1.24 -0.48 2.57 2.07 -0.53 -2.32 116.25 118.99 1nho h VAL 23 Ca 0.05 -1.05 -0.12 0.00 0.82 0.00 0.00 66.70 66.40 1nho h VAL 23 Cb 0.59 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1nho h VAL 23 CO 0.03 0.35 -0.18 -0.78 0.02 0.00 0.00 177.57 177.01 1nho h ASP 24 N 0.57 0.99 -0.36 0.57 1.82 0.13 0.14 116.42 120.28 1nho h ASP 24 Ca 0.10 -0.38 0.02 0.00 -0.39 0.00 0.00 57.03 56.38 1nho h ASP 24 Cb 0.50 -0.27 -0.03 0.00 0.68 0.00 0.00 39.33 40.21 1nho h ASP 24 CO 0.03 1.15 0.19 -0.33 -1.61 0.00 0.00 179.24 178.67 1nho h GLU 25 N 0.83 0.37 0.07 0.28 4.39 -0.44 0.40 114.58 120.48 1nho h GLU 25 Ca 0.11 -0.02 -0.28 0.00 0.34 0.00 0.00 59.36 59.52 1nho h GLU 25 Cb 0.75 -0.08 0.02 0.00 -0.10 0.00 0.00 28.75 29.34 1nho h GLU 25 CO 0.06 0.25 -1.14 0.00 -1.16 0.00 0.00 179.01 177.02 1nho h ALA 26 N 1.18 0.11 0.00 3.43 0.00 -1.35 -3.01 119.26 119.63 1nho h ALA 26 Ca 0.15 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1nho h ALA 26 Cb 0.05 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1nho h ALA 26 CO -0.10 0.74 0.00 0.87 0.00 0.00 0.00 179.25 180.76 1nho h LYS 27 N 0.28 0.00 -0.08 0.00 6.56 -0.53 -2.66 116.57 120.15 1nho h LYS 27 Ca -0.15 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.34 1nho h LYS 27 Cb 1.80 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.47 1nho h LYS 27 CO 0.21 0.00 -0.36 0.87 -2.06 0.00 0.00 179.45 178.11 1nho h LYS 28 N 0.00 0.38 -1.10 3.15 6.56 -0.20 1.49 116.57 126.85 1nho h LYS 28 Ca 0.00 -0.30 0.32 0.00 -1.06 0.00 0.00 60.65 59.60 1nho h LYS 28 Cb 0.63 0.06 -0.11 0.00 -0.57 0.00 0.00 32.23 32.24 1nho h LYS 28 CO 0.00 0.94 0.70 1.05 -2.06 0.00 0.00 179.45 180.08 1nho h GLU 29 N -0.09 0.31 0.00 3.15 -0.00 -1.33 -1.54 114.58 115.08 1nho h GLU 29 Ca -0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 59.32 1nho h GLU 29 Cb 1.01 -0.07 0.00 0.00 -0.00 0.00 0.00 28.75 29.69 1nho h GLU 29 CO 0.07 0.20 -0.16 0.34 -0.00 0.00 0.00 179.01 179.46 1nho n PHE 30 N -4.73 0.05 -2.73 2.06 7.35 -1.14 -4.70 117.46 113.63 1nho n PHE 30 Ca 0.29 0.02 -0.42 0.00 -0.76 0.00 0.00 57.45 56.58 1nho n PHE 30 Cb 1.03 -0.16 -0.02 0.00 0.35 0.00 0.00 39.48 40.67 1nho n PHE 30 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1nho s GLY 31 N -3.22 1.61 0.58 7.13 0.00 0.51 -4.83 107.32 109.10 1nho s GLY 31 Ca -0.05 -2.56 0.39 0.00 0.00 0.00 0.00 44.72 42.50 1nho s GLY 31 CO 0.07 2.38 1.45 -1.80 0.00 0.00 0.00 173.10 175.21 1nho h ASP 32 N 9.15 0.00 -4.05 1.64 3.58 -1.46 -3.35 116.42 121.94 1nho h ASP 32 Ca 0.20 0.00 -0.46 0.00 0.42 0.00 0.00 57.03 57.19 1nho h ASP 32 Cb 1.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 1nho h ASP 32 CO 1.29 0.00 0.31 -0.54 -2.88 0.00 0.00 179.24 177.42 1nho s LYS 33 N -4.66 4.09 0.12 0.28 1.02 -1.26 -4.88 119.74 114.44 1nho s LYS 33 Ca -0.04 0.99 0.05 0.00 0.02 0.00 0.00 55.97 56.99 1nho s LYS 33 Cb 0.21 -2.20 -0.04 0.00 -0.52 0.00 0.00 37.83 35.28 1nho s LYS 33 CO 0.69 -0.09 -0.13 0.42 -0.92 0.00 0.00 175.35 175.32 1nho s ILE 34 N -2.31 1.24 -0.47 2.17 1.09 -1.26 -3.94 121.20 117.73 1nho s ILE 34 Ca 0.60 -1.70 0.06 0.00 -1.10 0.00 0.00 60.65 58.50 1nho s ILE 34 Cb -0.09 -1.49 0.18 0.00 -1.06 0.00 0.00 42.46 39.99 1nho s ILE 34 CO 0.20 -0.45 0.56 -0.62 -0.10 0.00 0.00 174.94 174.53 1nho s ASP 35 N -2.45 -0.23 -0.18 3.58 -1.08 0.72 -4.82 116.67 112.20 1nho s ASP 35 Ca 0.08 -2.21 -0.13 0.00 -0.52 0.00 0.00 52.55 49.77 1nho s ASP 35 Cb -0.04 0.94 -0.05 0.00 -1.46 0.00 0.00 42.92 42.31 1nho s ASP 35 CO 0.02 -0.11 0.24 -0.69 0.52 0.00 0.00 175.17 175.16 1nho s VAL 36 N 0.62 5.33 0.02 1.11 1.01 -1.20 -3.09 120.40 124.20 1nho s VAL 36 Ca 0.30 0.43 0.03 0.00 0.00 0.00 0.00 61.98 62.74 1nho s VAL 36 Cb 0.01 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1nho s VAL 36 CO -0.11 0.39 -0.02 -1.61 0.00 0.00 0.00 175.10 173.76 1nho s GLU 37 N 0.53 2.66 -0.16 2.72 2.02 1.17 -4.79 118.70 122.85 1nho s GLU 37 Ca 0.14 -0.70 -0.04 0.00 0.02 0.00 0.00 54.97 54.38 1nho s GLU 37 Cb -0.12 -2.59 0.07 0.00 0.10 0.00 0.00 34.13 31.58 1nho s GLU 37 CO 0.02 0.60 0.15 -1.59 0.02 0.00 0.00 175.26 174.46 1nho s LYS 38 N -1.73 0.09 0.33 1.61 0.00 -1.26 -1.74 119.74 117.05 1nho s LYS 38 Ca 0.21 0.15 0.08 0.00 0.00 0.00 0.00 55.97 56.41 1nho s LYS 38 Cb -0.11 -1.28 -0.04 0.00 0.00 0.00 0.00 37.83 36.40 1nho s LYS 38 CO 0.12 -0.59 0.11 0.42 0.00 0.00 0.00 175.35 175.41 1nho s ILE 39 N 2.23 3.06 0.35 3.79 1.01 0.19 -4.83 121.20 126.99 1nho s ILE 39 Ca 0.04 -1.75 0.03 0.00 0.00 0.00 0.00 60.65 58.97 1nho s ILE 39 Cb -0.15 -2.95 -0.02 0.00 0.01 0.00 0.00 42.46 39.35 1nho s ILE 39 CO -0.09 -0.21 0.52 -0.62 0.00 0.00 0.00 174.94 174.54 1nho s ASP 40 N -3.81 6.12 0.15 3.58 2.15 -1.26 -3.00 116.67 120.60 1nho s ASP 40 Ca 0.36 0.20 -0.10 0.00 0.43 0.00 0.00 52.55 53.45 1nho s ASP 40 Cb -0.03 -1.71 -0.03 0.00 -0.30 0.00 0.00 42.92 40.85 1nho s ASP 40 CO 0.22 -0.37 1.46 -0.29 -0.17 0.00 0.00 175.17 176.02 1nho h ILE 41 N 0.78 1.28 -0.00 4.11 2.10 -1.75 0.18 117.51 124.20 1nho h ILE 41 Ca -0.49 -1.63 0.00 0.00 1.08 0.00 0.00 64.86 63.82 1nho h ILE 41 Cb 1.24 1.49 0.00 0.00 -1.09 0.00 0.00 36.82 38.46 1nho h ILE 41 CO 0.59 0.54 -0.01 1.15 -1.08 0.00 0.00 178.15 179.33 1nho n MET 42 N -4.03 0.79 -0.05 2.19 0.00 -1.26 -3.19 117.12 111.57 1nho n MET 42 Ca -0.03 -0.07 -0.08 0.00 0.00 0.00 0.00 57.70 57.52 1nho n MET 42 Cb 0.58 -1.50 -0.04 0.00 0.00 0.00 0.00 33.22 32.26 1nho n MET 42 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 175.97 177.52 1nho n VAL 43 N -1.05 0.51 -2.25 3.17 3.14 -1.10 -4.71 118.33 116.03 1nho n VAL 43 Ca 0.19 -0.17 -0.35 0.00 -2.96 0.00 0.00 64.34 61.05 1nho n VAL 43 Cb 0.19 -1.18 0.02 0.00 -1.06 0.00 0.00 33.84 31.80 1nho n VAL 43 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1nho n ASP 44 N -3.06 6.46 0.00 6.55 2.03 0.62 -4.73 116.55 124.41 1nho n ASP 44 Ca -0.17 -3.77 0.03 0.00 0.52 0.00 0.00 54.79 51.40 1nho n ASP 44 Cb 0.65 -0.87 0.19 0.00 -0.72 0.00 0.00 41.12 40.38 1nho n ASP 44 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1nho n ARG 45 N -0.44 0.17 0.30 -0.67 0.00 -1.19 -2.23 116.66 112.60 1nho n ARG 45 Ca 0.47 0.08 0.18 0.00 -0.00 0.00 0.00 57.85 58.58 1nho n ARG 45 Cb 0.37 -1.50 0.94 0.00 -0.00 0.00 0.00 32.46 32.28 1nho n ARG 45 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 1nho h GLU 46 N 0.00 0.00 -0.17 2.89 4.11 -1.89 -2.71 114.58 116.81 1nho h GLU 46 Ca 0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.45 1nho h GLU 46 Cb 0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1nho h GLU 46 CO 0.00 0.00 -0.32 -0.22 0.07 0.00 0.00 179.01 178.54 1nho h LYS 47 N 0.00 -0.26 0.00 1.06 1.63 -1.85 0.66 116.57 117.81 1nho h LYS 47 Ca 0.03 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1nho h LYS 47 Cb 0.44 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 1nho h LYS 47 CO -0.00 -0.17 0.00 0.00 -3.45 0.00 0.00 179.45 175.83 1nho n ALA 48 N -2.88 1.30 -0.10 5.00 0.00 -1.02 -3.37 120.51 119.45 1nho n ALA 48 Ca -0.03 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.49 1nho n ALA 48 Cb 0.20 -1.04 0.15 0.00 0.00 0.00 0.00 19.45 18.77 1nho n ALA 48 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1nho n ILE 49 N -1.30 -0.12 -0.04 0.00 -5.35 0.23 0.62 119.36 113.40 1nho n ILE 49 Ca 0.01 0.61 -0.08 0.00 -0.27 0.00 0.00 62.75 63.02 1nho n ILE 49 Cb 0.02 -0.97 -0.02 0.00 -1.74 0.00 0.00 39.64 36.93 1nho n ILE 49 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1nho h GLU 50 N 0.00 -0.20 0.00 6.28 3.07 -1.76 -3.37 114.58 118.59 1nho h GLU 50 Ca 0.24 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1nho h GLU 50 Cb 0.60 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1nho h GLU 50 CO -0.24 -0.14 -0.81 2.48 -1.40 0.00 0.00 179.01 178.91 1nho n TYR 51 N -5.35 0.00 -0.19 4.33 4.11 2.73 -4.98 117.16 117.81 1nho n TYR 51 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.89 1nho n TYR 51 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.60 1nho n TYR 51 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1nho n GLY 52 N 2.64 0.00 0.00 -7.48 0.00 0.70 -4.66 105.19 96.39 1nho n GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nho n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nho n LEU 53 N 0.00 2.03 -3.79 0.99 4.77 -1.26 -4.38 117.00 115.37 1nho n LEU 53 Ca 0.00 0.11 -0.42 0.00 -0.03 0.00 0.00 56.01 55.67 1nho n LEU 53 Cb 0.06 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1nho n LEU 53 CO 0.00 0.00 1.78 0.23 -1.33 0.00 0.00 177.39 178.07 1nho n MET 54 N -0.44 4.29 -3.76 3.23 2.81 -1.26 -4.96 117.12 117.02 1nho n MET 54 Ca 0.00 -3.92 -0.37 0.00 -1.81 0.00 0.00 57.70 51.60 1nho n MET 54 Cb 0.00 -2.70 -0.13 0.00 -0.71 0.00 0.00 33.22 29.69 1nho n MET 54 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nho s ALA 55 N -1.36 3.10 0.26 3.04 0.00 -1.26 -4.85 121.76 120.69 1nho s ALA 55 Ca 0.40 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1nho s ALA 55 Cb 0.11 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.13 1nho s ALA 55 CO -0.01 -0.72 0.00 0.28 0.00 0.00 0.00 175.76 175.32 1nho n VAL 56 N 4.89 0.00 -3.81 0.00 0.31 -1.26 -4.99 118.33 113.48 1nho n VAL 56 Ca -0.15 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.81 1nho n VAL 56 Cb 0.50 -0.19 -0.13 0.00 -0.91 0.00 0.00 33.84 33.11 1nho n VAL 56 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1nho s PRO 57 N -1.67 3.28 0.30 5.55 0.04 -1.26 -4.34 135.00 136.90 1nho s PRO 57 Ca 0.00 -0.72 -0.18 0.00 0.04 0.00 0.00 61.00 60.14 1nho s PRO 57 Cb 0.00 -3.25 0.06 0.00 0.04 0.00 0.00 34.50 31.35 1nho s PRO 57 CO 0.00 -0.32 0.88 0.00 0.04 0.00 0.00 177.00 177.60 1nho s ALA 58 N 1.51 -1.09 0.03 8.56 0.00 0.19 0.75 121.76 131.70 1nho s ALA 58 Ca 0.04 -0.57 -0.03 0.00 0.00 0.00 0.00 51.96 51.40 1nho s ALA 58 Cb -0.16 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.66 1nho s ALA 58 CO 0.01 -1.02 0.04 0.42 0.00 0.00 0.00 175.76 175.21 1nho s ILE 59 N -2.31 0.13 0.35 0.00 1.09 -0.99 0.31 121.20 119.77 1nho s ILE 59 Ca 0.18 -1.03 -0.04 0.00 -1.10 0.00 0.00 60.65 58.65 1nho s ILE 59 Cb -0.04 -0.64 -0.05 0.00 -1.06 0.00 0.00 42.46 40.67 1nho s ILE 59 CO 0.09 -0.57 0.61 0.00 -0.10 0.00 0.00 174.94 174.97 1nho s ALA 60 N -2.10 3.58 -0.74 9.38 0.00 0.16 -0.23 121.76 131.81 1nho s ALA 60 Ca -0.10 -0.60 -0.12 0.00 0.00 0.00 0.00 51.96 51.14 1nho s ALA 60 Cb -0.05 -2.34 0.19 0.00 0.00 0.00 0.00 23.12 20.93 1nho s ALA 60 CO -0.03 0.05 0.66 0.42 0.00 0.00 0.00 175.76 176.87 1nho s ILE 61 N -2.28 5.19 -0.86 0.00 1.01 0.59 -3.70 121.20 121.14 1nho s ILE 61 Ca 0.44 -2.40 -0.23 0.00 0.00 0.00 0.00 60.65 58.46 1nho s ILE 61 Cb -0.10 -4.25 -0.19 0.00 0.01 0.00 0.00 42.46 37.93 1nho s ILE 61 CO 0.34 -0.97 2.18 0.59 0.00 0.00 0.00 174.94 177.07 1nho n ASN 62 N 4.09 1.02 0.00 3.58 5.03 -1.26 0.41 115.26 128.13 1nho n ASN 62 Ca 0.08 -1.76 0.00 0.00 0.87 0.00 0.00 54.58 53.78 1nho n ASN 62 Cb 0.44 -1.50 0.00 0.00 -1.02 0.00 0.00 39.78 37.70 1nho n ASN 62 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1nho n GLY 63 N 6.27 1.69 1.36 7.41 0.00 -1.26 -3.95 105.19 116.71 1nho n GLY 63 Ca 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1nho n GLY 63 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1nho n VAL 64 N 0.00 0.76 0.00 1.61 0.24 0.17 -4.72 118.33 116.39 1nho n VAL 64 Ca 0.00 0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.55 1nho n VAL 64 Cb 0.00 -1.18 0.00 0.00 -1.47 0.00 0.00 33.84 31.19 1nho n VAL 64 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1nho n VAL 65 N -3.42 0.00 -3.58 3.34 0.31 -0.88 -4.93 118.33 109.17 1nho n VAL 65 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 1nho n VAL 65 Cb 0.00 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 1nho n VAL 65 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1nho s ARG 66 N 0.97 0.79 0.27 5.55 3.52 -1.26 0.22 118.95 129.00 1nho s ARG 66 Ca 0.00 -0.34 -0.06 0.00 -0.13 0.00 0.00 55.73 55.20 1nho s ARG 66 Cb 0.00 0.33 -0.01 0.00 -1.56 0.00 0.00 34.95 33.70 1nho s ARG 66 CO 0.00 -0.35 0.38 -0.59 -0.81 0.00 0.00 175.30 173.93 1nho s PHE 67 N -2.99 0.85 -0.36 5.12 -0.71 0.69 -4.73 117.98 115.85 1nho s PHE 67 Ca 0.08 -1.12 -0.25 0.00 -1.04 0.00 0.00 56.93 54.60 1nho s PHE 67 Cb -0.01 -0.13 0.01 0.00 -1.21 0.00 0.00 43.02 41.69 1nho s PHE 67 CO -0.05 -0.95 0.90 0.08 -1.34 0.00 0.00 175.22 173.86 1nho s VAL 68 N -3.72 4.62 -0.28 -2.49 1.01 -1.26 -2.35 120.40 115.93 1nho s VAL 68 Ca 0.30 1.18 -0.16 0.00 0.00 0.00 0.00 61.98 63.31 1nho s VAL 68 Cb 0.01 -4.30 0.10 0.00 0.00 0.00 0.00 36.38 32.20 1nho s VAL 68 CO 0.14 -0.49 0.78 -0.83 0.00 0.00 0.00 175.10 174.70 1nho s GLY 69 N 1.83 -0.45 0.00 4.51 0.00 0.23 -4.88 107.32 108.56 1nho s GLY 69 Ca 0.37 2.64 0.00 0.00 0.00 0.00 0.00 44.72 47.73 1nho s GLY 69 CO 0.18 2.52 0.00 0.00 0.00 0.00 0.00 173.10 175.79 1nho n ALA 70 N 4.22 0.00 0.52 3.20 0.00 -1.20 0.04 120.51 127.29 1nho n ALA 70 Ca -0.19 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.23 1nho n ALA 70 Cb 0.58 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.10 1nho n ALA 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1nho n PRO 71 N -1.07 1.59 -2.64 0.00 -0.04 -1.26 -4.44 135.00 127.14 1nho n PRO 71 Ca 0.00 -0.72 -0.40 0.00 -0.04 0.00 0.00 63.50 62.34 1nho n PRO 71 Cb 0.00 -1.47 0.02 0.00 -0.04 0.00 0.00 33.50 32.01 1nho n PRO 71 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1nho n SER 72 N 0.13 7.16 0.17 3.54 3.41 -1.26 -4.70 113.62 122.07 1nho n SER 72 Ca 0.10 -3.69 0.02 0.00 -0.26 0.00 0.00 58.87 55.04 1nho n SER 72 Cb 0.63 -1.12 0.31 0.00 -0.26 0.00 0.00 64.21 63.77 1nho n SER 72 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1nho h ARG 73 N 4.08 0.00 -0.91 4.33 -0.00 -1.89 -3.06 114.38 116.92 1nho h ARG 73 Ca 0.51 0.00 0.23 0.00 -0.50 0.00 0.00 59.98 60.22 1nho h ARG 73 Cb 0.33 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 30.17 1nho h ARG 73 CO 1.16 0.44 0.40 1.49 0.00 0.00 0.00 179.97 183.46 1nho h GLU 74 N 0.00 0.36 -1.29 0.04 4.22 -1.86 0.63 114.58 116.68 1nho h GLU 74 Ca -0.00 -0.02 0.38 0.00 0.08 0.00 0.00 59.36 59.79 1nho h GLU 74 Cb 0.80 -0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.88 1nho h GLU 74 CO 0.06 0.24 0.87 0.93 -2.18 0.00 0.00 179.01 178.93 1nho h GLU 75 N 0.37 0.13 -0.46 1.92 4.39 -1.93 1.51 114.58 120.51 1nho h GLU 75 Ca 0.58 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 60.23 1nho h GLU 75 Cb 1.14 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.75 1nho h GLU 75 CO -0.55 0.09 0.10 -0.07 -1.16 0.00 0.00 179.01 177.42 1nho h LEU 76 N 0.14 0.70 -1.42 1.33 4.07 0.07 0.29 115.31 120.49 1nho h LEU 76 Ca 0.70 -0.24 0.10 0.00 0.08 0.00 0.00 57.88 58.52 1nho h LEU 76 Cb 2.34 -0.19 -0.05 0.00 1.08 0.00 0.00 40.66 43.85 1nho h LEU 76 CO -0.22 0.76 0.49 0.15 -1.08 0.00 0.00 178.44 178.54 1nho h PHE 77 N 0.62 0.69 0.08 1.13 3.04 0.21 0.41 116.94 123.11 1nho h PHE 77 Ca 0.14 0.02 -0.26 0.00 3.98 0.00 0.00 57.97 61.85 1nho h PHE 77 Cb 0.34 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 1nho h PHE 77 CO 0.02 0.32 -1.24 1.49 -2.02 0.00 0.00 178.31 176.88 1nho h GLU 78 N 0.64 0.16 -0.17 1.11 4.57 -0.82 -3.19 114.58 116.89 1nho h GLU 78 Ca 0.35 -0.28 -0.13 0.00 -1.18 0.00 0.00 59.36 58.12 1nho h GLU 78 Cb 0.49 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 1nho h GLU 78 CO -0.13 1.09 -0.45 0.00 -1.18 0.00 0.00 179.01 178.33 1nho h ALA 79 N 0.73 0.91 -0.35 2.92 0.00 0.92 -2.02 119.26 122.37 1nho h ALA 79 Ca -0.12 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 54.24 1nho h ALA 79 Cb 1.92 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 1nho h ALA 79 CO 0.16 0.65 -0.15 0.82 0.00 0.00 0.00 179.25 180.73 1nho h ILE 80 N 0.33 1.28 0.00 0.00 5.03 -1.07 0.27 117.51 123.36 1nho h ILE 80 Ca 0.02 -1.25 0.00 0.00 -0.12 0.00 0.00 64.86 63.51 1nho h ILE 80 Cb 0.93 1.35 0.00 0.00 -3.03 0.00 0.00 36.82 36.07 1nho h ILE 80 CO 0.08 0.41 0.00 -1.13 -0.68 0.00 0.00 178.15 176.83 1nho h ASN 81 N 0.51 0.00 -0.01 1.72 -1.24 -1.52 0.33 115.58 115.37 1nho h ASN 81 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1nho h ASN 81 Cb 0.68 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.73 1nho h ASN 81 CO 0.05 0.00 -0.42 -0.67 -1.29 0.00 0.00 177.43 175.10 1nho n ASP 82 N -2.79 1.57 -0.08 1.15 -0.08 -0.52 -0.63 116.55 115.17 1nho n ASP 82 Ca -0.01 -1.29 -0.11 0.00 -1.51 0.00 0.00 54.79 51.88 1nho n ASP 82 Cb 0.16 0.55 -0.06 0.00 2.34 0.00 0.00 41.12 44.10 1nho n ASP 82 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1nho h GLU 83 N 1.64 0.00 0.00 -0.67 4.57 0.75 -3.36 114.58 117.50 1nho h GLU 83 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1nho h GLU 83 Cb 0.56 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1nho h GLU 83 CO 0.00 0.45 -0.16 1.98 -1.18 0.00 0.00 179.01 180.09 1nho h MET 84 N -1.00 0.00 0.00 1.92 4.05 -0.55 -3.47 114.93 115.88 1nho h MET 84 Ca -0.12 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 1nho h MET 84 Cb 0.75 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 1nho h MET 84 CO -0.07 0.16 0.00 -1.91 0.23 0.00 0.00 176.91 175.32